A0A060D485_MAIZE Loading...

WRKY transcription factor

AlphaFold DB , UniProt , Accession A0A060D485, Species MAIZE (Zea mays, Maize), Gene WRKY25, Length 333 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	53	Low	62.4	Low	219 Å²	219	113.1 Å²	113.1	100%	1.079	62%	0.618	S	S	*	*				0	-21.9	0	-74.7	-166.5	175.8	0	0	113.3
2	A	55.7	Low	64.3	Low	74 Å²	74	108.5 Å²	108.5	61%	0.612	61%	0.606	S	S	*	*	H	α-helix	trans	-69.8	-40.9	178.1	0	0	0	0	0	113.9	A4 V5 E6	A2-A4 VanDerWaalsContact C-N 3.29Å; A2-A4 PolarHBondContact O-N 3.39Å; A2-V5 PolarHBondContact O-N 3.04Å; A2-V5 VanDerWaalsContact O-N 3.13Å; A2-E6 PolarHBondContact O-N 2.99Å
3	D	52.5	Low	66	Low	139 Å²	139	110.8 Å²	110.8	74%	0.743	60%	0.6	S	S	*	*	H	α-helix	trans	-62.9	-30	-176.4	-63.5	-81.9	0	0	0	114.7	V5 S7	D3-V5 VanDerWaalsContact C-N 3.35Å; D3-S7 WeakPolarHBondContact O-CB 3.37Å; D3-S7 PolarHBondContact O-N 3.29Å; D3-S7 VanDerWaalsContact O-N 3.1Å
4	A	53.7	Low	67.7	Low	72 Å²	72	104.6 Å²	104.6	60%	0.595	57%	0.566	S	S	*	*	H	α-helix	trans	-71.9	-30.1	178.5	0	0	0	0	0	112.6	A2 R8	A2-A4 VanDerWaalsContact C-N 3.29Å; A2-A4 PolarHBondContact O-N 3.39Å; A4-R8 PolarHBondContact O-N 3.44Å
5	V	55.3	Low	69	Low	109 Å²	109	104.5 Å²	104.5	66%	0.661	57%	0.57	S	S	*	*	H	α-helix	trans	-75.4	-40.7	177.4	173.6	0	0	0	0	110.3	A2 D3 R8 G9	A2-V5 PolarHBondContact O-N 3.04Å; A2-V5 VanDerWaalsContact O-N 3.13Å; D3-V5 VanDerWaalsContact C-N 3.35Å; V5-R8 PolarHBondContact O-N 3.35Å; V5-G9 PolarHBondContact O-N 3.38Å; V5-G9 VanDerWaalsContact O-N 3.09Å
6	E	54.8	Low	70.3	Confident	156 Å²	156	103 Å²	103	73%	0.729	57%	0.569	S	S	*	*	H	α-helix	trans	-62.3	-44.8	176.5	-155.2	99.2	-171.1	0	0	111.4	A2 R8 G9 G10	A2-E6 PolarHBondContact O-N 2.99Å; E6-R8 PolarHBondContact O-N 2.95Å; E6-G9 PolarHBondContact O-N 3.16Å; E6-G10 PolarHBondContact O-N 2.9Å
7	S	58.7	Low	71.5	Confident	43 Å²	43	98.2 Å²	98.2	30%	0.301	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-38.9	178.7	-177.5	0	0	0	0	112.4	D3 G10 R11	D3-S7 WeakPolarHBondContact O-CB 3.37Å; D3-S7 PolarHBondContact O-N 3.29Å; D3-S7 VanDerWaalsContact O-N 3.1Å; S7-G10 PolarHBondContact O-N 3.48Å; S7-R11 WeakPolarHBondContact O-CG 3.46Å; S7-R11 PolarHBondContact O-N 3.36Å; S7-R11 VanDerWaalsContact O-N 3.16Å
8	R	62.9	Low	72.4	Confident	208 Å²	208	97.3 Å²	97.3	79%	0.785	54%	0.536	S	S	*	.	H	α-helix	trans	-68	-38.1	176.3	-160	174.3	-176.5	-168.8	0.9	111.9	A4 V5 E6 A12	A4-R8 PolarHBondContact O-N 3.44Å; V5-R8 PolarHBondContact O-N 3.35Å; E6-R8 PolarHBondContact O-N 2.95Å; R8-A12 WeakPolarHBondContact O-CB 3.43Å; R8-A12 PolarHBondContact O-N 3.1Å; R8-A12 VanDerWaalsContact O-N 3.14Å
9	G	76.4	Confident	73.3	Confident	43 Å²	43	93.7 Å²	93.7	44%	0.443	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-42.3	175	0	0	0	0	0	113.2	V5 E6 A12 R13	V5-G9 PolarHBondContact O-N 3.38Å; V5-G9 VanDerWaalsContact O-N 3.09Å; E6-G9 PolarHBondContact O-N 3.16Å; G9-A12 PolarHBondContact O-N 3.03Å; G9-R13 WeakPolarHBondContact O-CB 3.5Å; G9-R13 PolarHBondContact O-N 3.12Å
10	G	82.2	Confident	74.3	Confident	25 Å²	25	95.6 Å²	95.6	26%	0.258	52%	0.522	S	S	.	.	H	α-helix	trans	-62.2	-44.3	177.4	0	0	0	0	0	112.8	E6 S7 R13 L14	E6-G10 PolarHBondContact O-N 2.9Å; S7-G10 PolarHBondContact O-N 3.48Å; G10-R13 PolarHBondContact O-N 3.17Å; G10-L14 WeakPolarHBondContact O-CB 3.13Å; G10-L14 PolarHBondContact O-N 3.13Å
11	R	81.3	Confident	75.2	Confident	156 Å²	156	91.4 Å²	91.4	59%	0.589	50%	0.5	S	S	*	.	H	α-helix	trans	-64.6	-43.2	175.9	-69.1	179.7	73.8	174.1	2.8	112.2	S7 R13 L14 V15	S7-R11 WeakPolarHBondContact O-CG 3.46Å; S7-R11 PolarHBondContact O-N 3.36Å; S7-R11 VanDerWaalsContact O-N 3.16Å; R11-R13 VanDerWaalsContact C-N 3.33Å; R11-R13 PolarHBondContact O-N 3.44Å; R11-L14 PolarHBondContact O-N 3.29Å; R11-V15 WeakPolarHBondContact O-CG2 3.47Å; R11-V15 PolarHBondContact O-N 3.37Å
12	A	84.7	Confident	76.9	Confident	58 Å²	58	84.9 Å²	84.9	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-41.6	176.7	0	0	0	0	0	111.9	R8 G9 V15 S16	R8-A12 WeakPolarHBondContact O-CB 3.43Å; R8-A12 PolarHBondContact O-N 3.1Å; R8-A12 VanDerWaalsContact O-N 3.14Å; G9-A12 PolarHBondContact O-N 3.03Å; A12-V15 PolarHBondContact O-N 2.96Å; A12-S16 PolarHBondContact O-N 3.04Å; A12-S16 PolarHBondContact O-OG 3.48Å; A12-S16 VanDerWaalsContact O-OG 3.12Å
13	R	87.3	Confident	78.6	Confident	138 Å²	138	85.3 Å²	85.3	52%	0.521	46%	0.459	S	S	.	.	H	α-helix	trans	-64.8	-41.4	175.9	-170.7	170.1	176.3	-108.8	-3.6	112.2	G9 G10 R11 S16 D17 M61	G9-R13 WeakPolarHBondContact O-CB 3.5Å; G9-R13 PolarHBondContact O-N 3.12Å; G10-R13 PolarHBondContact O-N 3.17Å; R11-R13 VanDerWaalsContact C-N 3.33Å; R11-R13 PolarHBondContact O-N 3.44Å; R13-S16 PolarHBondContact O-N 3.16Å; R13-D17 WeakPolarHBondContact O-CB 3.33Å; R13-D17 PolarHBondContact O-N 3.44Å; R13-M61 HydrophobicContact CB-SD 4.16Å; R13-M61 HydrophobicContact CG-CE 4.27Å; R13-M61 HydrophobicContact CG-SD 3.82Å; R13-M61 PolarHBondContact NH1-SD 3.41Å
14	L	89.5	Confident	80.6	Confident	24 Å²	24	79 Å²	79	13%	0.126	43%	0.425	C	S	.	.	H	α-helix	trans	-60.4	-45.4	175.1	-178.4	70.3	0	0	0	112.2	G10 R11 S16 D17 L18 S58 M61 L62	G10-L14 WeakPolarHBondContact O-CB 3.13Å; G10-L14 PolarHBondContact O-N 3.13Å; R11-L14 PolarHBondContact O-N 3.29Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 3.22Å; L14-D17 PolarHBondContact O-N 2.99Å; L14-L18 HydrophobicContact CG-CD1 4.23Å; L14-L18 WeakPolarHBondContact O-CG 3.24Å; L14-L18 PolarHBondContact O-N 3.14Å; L14-S58 WeakPolarHBondContact CD1-O 3.48Å; L14-M61 HydrophobicContact CB-CE 4.15Å; L14-M61 HydrophobicContact CD1-CE 3.99Å; L14-L62 HydrophobicContact CD1-CD1 4.25Å; L14-L62 HydrophobicContact CD1-CG 4.03Å; L14-L62 HydrophobicContact CD2-CD1 4.19Å; L14-L62 HydrophobicContact CD2-CD2 3.43Å; L14-L62 VanDerWaalsContact CD2-CD2 3.43Å; L14-L62 HydrophobicContact CD2-CG 3.7Å
15	V	87.3	Confident	82.4	Confident	103 Å²	103	76.3 Å²	76.3	62%	0.624	40%	0.401	S	S	*	.	H	α-helix	trans	-62.1	-43.2	177.6	173.2	0	0	0	0	110.8	R11 A12 L18 G19	R11-V15 WeakPolarHBondContact O-CG2 3.47Å; R11-V15 PolarHBondContact O-N 3.37Å; A12-V15 PolarHBondContact O-N 2.96Å; V15-L18 PolarHBondContact O-N 3.1Å; V15-G19 PolarHBondContact O-N 3Å
16	S	89.7	Confident	84.1	Confident	81 Å²	81	78.3 Å²	78.3	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-63	-42.5	175.6	-63.2	0	0	0	0	112.8	A12 R13 L14 G19 R20	A12-S16 PolarHBondContact O-N 3.04Å; A12-S16 PolarHBondContact O-OG 3.48Å; A12-S16 VanDerWaalsContact O-OG 3.12Å; R13-S16 PolarHBondContact O-N 3.16Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 3.22Å; S16-G19 PolarHBondContact O-N 2.94Å; S16-R20 PolarHBondContact O-N 3.14Å
17	D	90.3	Very high	85.8	Confident	21 Å²	21	75.4 Å²	75.4	11%	0.112	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-42.4	177.8	-79.7	0.6	0	0	0	110.9	R13 L14 R20 V21 S58 M61	R13-D17 WeakPolarHBondContact O-CB 3.33Å; R13-D17 PolarHBondContact O-N 3.44Å; L14-D17 PolarHBondContact O-N 2.99Å; D17-R20 PolarHBondContact O-N 3.38Å; D17-V21 WeakPolarHBondContact O-CG2 3.17Å; D17-V21 PolarHBondContact O-N 3.38Å; D17-S58 WeakPolarHBondContact CB-OG 3.44Å; D17-M61 HydrophobicContact CB-CE 4.21Å; D17-M61 WeakPolarHBondContact OD2-CE 3.48Å
18	L	88.3	Confident	87.4	Confident	83 Å²	83	74 Å²	74	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-39.3	175.5	-70	175.5	0	0	0	112.5	L14 V15 R20 V21 Q22	L14-L18 HydrophobicContact CG-CD1 4.23Å; L14-L18 WeakPolarHBondContact O-CG 3.24Å; L14-L18 PolarHBondContact O-N 3.14Å; V15-L18 PolarHBondContact O-N 3.1Å; L18-R20 VanDerWaalsContact C-N 3.32Å; L18-R20 PolarHBondContact O-N 3.09Å; L18-V21 WeakPolarHBondContact O-CB 3.45Å; L18-V21 PolarHBondContact O-N 3.24Å; L18-Q22 PolarHBondContact O-N 2.98Å
19	G	89.9	Confident	88.5	Confident	29 Å²	29	65.9 Å²	65.9	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-44	172.3	0	0	0	0	0	111.9	V15 S16 V21 Q22 D23	V15-G19 PolarHBondContact O-N 3Å; S16-G19 PolarHBondContact O-N 2.94Å; G19-V21 VanDerWaalsContact C-N 3.33Å; G19-V21 PolarHBondContact O-N 3.28Å; G19-Q22 WeakPolarHBondContact O-CB 3.34Å; G19-Q22 PolarHBondContact O-N 2.98Å; G19-D23 PolarHBondContact O-N 3.39Å
20	R	92.3	Very high	89	Confident	130 Å²	130	69.2 Å²	69.2	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-35.9	176	-170.2	176.4	178	-161.3	-0.5	112.7	S16 D17 L18 D23 L24 L54	S16-R20 PolarHBondContact O-N 3.14Å; D17-R20 PolarHBondContact O-N 3.38Å; L18-R20 VanDerWaalsContact C-N 3.32Å; L18-R20 PolarHBondContact O-N 3.09Å; R20-D23 PolarHBondContact O-N 2.96Å; R20-L24 HydrophobicContact CG-CD1 4.37Å; R20-L24 VanDerWaalsContact O-CG 3.27Å; R20-L24 WeakPolarHBondContact O-CG 3.48Å; R20-L24 PolarHBondContact O-N 3.4Å; R20-L54 HydrophobicContact CB-CD1 4.13Å; R20-L54 HydrophobicContact CG-CD1 3.67Å
21	V	92.6	Very high	89.1	Confident	8 Å²	8	71 Å²	71	5%	0.048	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-45.8	173.1	169	0	0	0	0	110.5	D17 L18 G19 D23 L24 V25 I51 L54	D17-V21 WeakPolarHBondContact O-CG2 3.17Å; D17-V21 PolarHBondContact O-N 3.38Å; L18-V21 WeakPolarHBondContact O-CB 3.45Å; L18-V21 PolarHBondContact O-N 3.24Å; G19-V21 VanDerWaalsContact C-N 3.33Å; G19-V21 PolarHBondContact O-N 3.28Å; V21-D23 VanDerWaalsContact C-N 3.34Å; V21-D23 PolarHBondContact O-N 3.22Å; V21-L24 PolarHBondContact O-N 2.94Å; V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 WeakPolarHBondContact O-CG2 3.19Å; V21-V25 PolarHBondContact O-N 3Å; V21-I51 HydrophobicContact CG1-CG2 4.24Å; V21-L54 HydrophobicContact CG2-CB 3.6Å; V21-L54 HydrophobicContact CG2-CD1 4.29Å
22	Q	89	Confident	89.1	Confident	83 Å²	83	66.4 Å²	66.4	39%	0.388	34%	0.339	S	S	.	.	H	α-helix	trans	-59.4	-43.1	176.9	-69.5	-178.6	1.8	0	0	112.2	L18 G19 L24 V25 R26 V296	L18-Q22 PolarHBondContact O-N 2.98Å; G19-Q22 WeakPolarHBondContact O-CB 3.34Å; G19-Q22 PolarHBondContact O-N 2.98Å; Q22-L24 VanDerWaalsContact C-N 3.34Å; Q22-L24 PolarHBondContact O-N 3.07Å; Q22-V25 PolarHBondContact O-N 3.41Å; Q22-R26 WeakPolarHBondContact O-CG 3.48Å; Q22-R26 PolarHBondContact O-N 3.29Å; Q22-V296 HydrophobicContact CG-CG1 3.77Å
23	D	92.6	Very high	88.8	Confident	83 Å²	83	72.9 Å²	72.9	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-38.2	177.9	-71.2	-31.9	0	0	0	112.7	G19 R20 V21 R26 Q27	G19-D23 PolarHBondContact O-N 3.39Å; R20-D23 PolarHBondContact O-N 2.96Å; V21-D23 VanDerWaalsContact C-N 3.34Å; V21-D23 PolarHBondContact O-N 3.22Å; D23-R26 PolarHBondContact O-N 2.95Å; D23-Q27 WeakPolarHBondContact O-CG 3.3Å; D23-Q27 PolarHBondContact O-N 3.38Å
24	L	93.6	Very high	87.8	Confident	5 Å²	5	69.6 Å²	69.6	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-69.6	-37.5	177	-69.3	165.8	0	0	0	112.6	R20 V21 Q22 R26 Q27 L28 L47 Q50 I51 L54	R20-L24 HydrophobicContact CG-CD1 4.37Å; R20-L24 VanDerWaalsContact O-CG 3.27Å; R20-L24 WeakPolarHBondContact O-CG 3.48Å; R20-L24 PolarHBondContact O-N 3.4Å; V21-L24 PolarHBondContact O-N 2.94Å; Q22-L24 VanDerWaalsContact C-N 3.34Å; Q22-L24 PolarHBondContact O-N 3.07Å; L24-R26 VanDerWaalsContact C-N 3.34Å; L24-Q27 PolarHBondContact O-N 3.25Å; L24-L28 WeakPolarHBondContact O-CB 3.33Å; L24-L28 PolarHBondContact O-N 2.93Å; L24-L47 HydrophobicContact CD2-CD2 3.62Å; L24-Q50 HydrophobicContact CD1-CB 3.97Å; L24-Q50 HydrophobicContact CD1-CG 3.55Å; L24-Q50 HydrophobicContact CD2-CG 4.29Å; L24-I51 HydrophobicContact CB-CD1 3.99Å; L24-I51 HydrophobicContact CB-CG1 3.52Å; L24-I51 HydrophobicContact CD1-CG1 4.13Å; L24-I51 HydrophobicContact CG-CG1 4.48Å; L24-L54 HydrophobicContact CD1-CD1 3.5Å; L24-L54 VanDerWaalsContact CD1-CD1 3.5Å
25	V	92.5	Very high	86.6	Confident	16 Å²	16	73 Å²	73	10%	0.097	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-45.1	174.1	171.8	0	0	0	0	109.9	V21 Q22 Q27 L28 E29 I51	V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 WeakPolarHBondContact O-CG2 3.19Å; V21-V25 PolarHBondContact O-N 3Å; Q22-V25 PolarHBondContact O-N 3.41Å; V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.32Å; V25-L28 WeakPolarHBondContact O-CB 3.49Å; V25-L28 PolarHBondContact O-N 3.48Å; V25-L28 VanDerWaalsContact O-N 3.13Å; V25-E29 WeakPolarHBondContact O-CG 3.46Å; V25-E29 PolarHBondContact O-N 2.95Å; V25-I51 HydrophobicContact CG2-CD1 3.86Å; V25-I51 HydrophobicContact CG2-CG1 4.35Å
26	R	90.6	Very high	85.5	Confident	151 Å²	151	70.9 Å²	70.9	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-59.3	-41.4	174.5	-70.3	172.9	178.4	-179.6	-0.4	112.4	Q22 D23 L24 E29 L30	Q22-R26 WeakPolarHBondContact O-CG 3.48Å; Q22-R26 PolarHBondContact O-N 3.29Å; D23-R26 PolarHBondContact O-N 2.95Å; L24-R26 VanDerWaalsContact C-N 3.34Å; R26-E29 PolarHBondContact O-N 2.97Å; R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.46Å; R26-L30 VanDerWaalsContact O-N 3.11Å
27	Q	90.5	Very high	84.5	Confident	95 Å²	95	72.8 Å²	72.8	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-41.2	175.2	-72.6	171.3	41.5	0	0	112	D23 L24 V25 L30 Q31 L47	D23-Q27 WeakPolarHBondContact O-CG 3.3Å; D23-Q27 PolarHBondContact O-N 3.38Å; L24-Q27 PolarHBondContact O-N 3.25Å; V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.32Å; Q27-L30 PolarHBondContact O-N 2.96Å; Q27-Q31 WeakPolarHBondContact O-CG 3.46Å; Q27-Q31 PolarHBondContact O-N 2.96Å; Q27-Q31 VanDerWaalsContact O-N 3.13Å; Q27-L47 HydrophobicContact CB-CD1 4.02Å; Q27-L47 HydrophobicContact CB-CD2 4.05Å
28	L	91.2	Very high	83.6	Confident	15 Å²	15	75.7 Å²	75.7	8%	0.079	41%	0.406	C	S	.	.	H	α-helix	trans	-64.2	-44.7	178.2	-179.5	62.9	0	0	0	110.9	L24 V25 L30 Q31 L32 C44 L47 V48 I51	L24-L28 WeakPolarHBondContact O-CB 3.33Å; L24-L28 PolarHBondContact O-N 2.93Å; V25-L28 WeakPolarHBondContact O-CB 3.49Å; V25-L28 PolarHBondContact O-N 3.48Å; V25-L28 VanDerWaalsContact O-N 3.13Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 3.12Å; L28-Q31 PolarHBondContact O-N 3.05Å; L28-L32 HydrophobicContact CD1-CD1 4.26Å; L28-L32 HydrophobicContact CD1-CG 4.31Å; L28-L32 HydrophobicContact CG-CD1 3.99Å; L28-L32 HydrophobicContact CG-CG 4.44Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 3.33Å; L28-C44 HydrophobicContact CD1-CB 3.76Å; L28-L47 HydrophobicContact CB-CB 4.35Å; L28-L47 HydrophobicContact CB-CD1 4.17Å; L28-L47 HydrophobicContact CD1-CB 4.24Å; L28-L47 HydrophobicContact CD1-CD1 4.38Å; L28-V48 HydrophobicContact CD1-CG2 4.19Å; L28-V48 HydrophobicContact CD2-CG2 3.71Å; L28-I51 HydrophobicContact CD2-CD1 4.12Å
29	E	86.7	Confident	83	Confident	37 Å²	37	75 Å²	75	17%	0.173	41%	0.413	C	S	.	.	H	α-helix	trans	-58.3	-41.7	175.1	-72.5	175.2	178.7	0	0	112.5	V25 R26 Q31 L32 R33 V289 F293	V25-E29 WeakPolarHBondContact O-CG 3.46Å; V25-E29 PolarHBondContact O-N 2.95Å; R26-E29 PolarHBondContact O-N 2.97Å; E29-Q31 VanDerWaalsContact C-N 3.33Å; E29-Q31 PolarHBondContact O-N 3.02Å; E29-L32 PolarHBondContact O-N 3.12Å; E29-R33 WeakPolarHBondContact O-CG 3.38Å; E29-R33 PolarHBondContact O-N 3.23Å; E29-V289 HydrophobicContact CG-CG1 4.21Å; E29-F293 WeakPolarHBondContact OE1-CD2 3.28Å
30	L	87.3	Confident	82.6	Confident	112 Å²	112	74.4 Å²	74.4	59%	0.586	40%	0.404	S	S	*	.	H	α-helix	trans	-63.8	-38	177.2	-72.5	171.5	0	0	0	112.2	R26 Q27 L28	R26-L30 WeakPolarHBondContact O-CG 3.47Å; R26-L30 PolarHBondContact O-N 3.46Å; R26-L30 VanDerWaalsContact O-N 3.11Å; Q27-L30 PolarHBondContact O-N 2.96Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 3.12Å
31	Q	83.4	Confident	82.3	Confident	62 Å²	62	71.3 Å²	71.3	29%	0.29	40%	0.399	S	S	.	.	H	α-helix	trans	-71.3	-37.8	176.5	-67	-60.9	-55.4	0	0	112.2	Q27 L28 E29 R33 A34 L43 C44 L47	Q27-Q31 WeakPolarHBondContact O-CG 3.46Å; Q27-Q31 PolarHBondContact O-N 2.96Å; Q27-Q31 VanDerWaalsContact O-N 3.13Å; L28-Q31 PolarHBondContact O-N 3.05Å; E29-Q31 VanDerWaalsContact C-N 3.33Å; E29-Q31 PolarHBondContact O-N 3.02Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 3.49Å; Q31-A34 CarbonylContact O-C 3.46Å; Q31-A34 PolarHBondContact O-N 3.33Å; Q31-L43 VanDerWaalsContact CD-CD2 3.47Å; Q31-L43 HydrophobicContact CG-CD2 3.82Å; Q31-L43 HydrophobicContact CG-CG 4.27Å; Q31-C44 VanDerWaalsContact CB-SG 3.58Å; Q31-L47 HydrophobicContact CG-CD1 4.26Å
32	L	82.2	Confident	82	Confident	61 Å²	61	74.4 Å²	74.4	32%	0.319	42%	0.415	S	S	.	.	H	α-helix	trans	-71.6	-25.5	178.9	-68.8	174.1	0	0	0	113.3	L28 E29 A34 V289	L28-L32 HydrophobicContact CD1-CD1 4.26Å; L28-L32 HydrophobicContact CD1-CG 4.31Å; L28-L32 HydrophobicContact CG-CD1 3.99Å; L28-L32 HydrophobicContact CG-CG 4.44Å; L28-L32 WeakPolarHBondContact O-CG 3.27Å; L28-L32 PolarHBondContact O-N 3.33Å; E29-L32 PolarHBondContact O-N 3.12Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 2.83Å; L32-V289 HydrophobicContact CD1-CG2 3.59Å
33	R	78.5	Confident	82.1	Confident	193 Å²	193	73 Å²	73	73%	0.728	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.2	175.4	-76.4	177.7	-173.6	169.9	7	113.9	E29 Q31	E29-R33 WeakPolarHBondContact O-CG 3.38Å; E29-R33 PolarHBondContact O-N 3.23Å; Q31-R33 VanDerWaalsContact C-N 3.34Å; Q31-R33 PolarHBondContact O-N 3.49Å
34	A	66.6	Low	81.9	Confident	70 Å²	70	69.9 Å²	69.9	58%	0.579	40%	0.395	S	S	*	.			trans	-142.9	73.3	179.8	0	0	0	0	0	111.1	Q31 L32 G36	Q31-A34 CarbonylContact O-C 3.46Å; Q31-A34 PolarHBondContact O-N 3.33Å; L32-A34 VanDerWaalsContact C-N 3.26Å; L32-A34 PolarHBondContact O-N 2.83Å; A34-G36 VanDerWaalsContact C-N 3.32Å; A34-G36 PolarHBondContact O-N 3Å
35	P	64	Low	81.8	Confident	96 Å²	96	76.4 Å²	76.4	62%	0.623	42%	0.419	S	S	*	.			trans	-73.7	86.9	179	30.1	-31.8	0	0	0	109.4
36	G	62.7	Low	81.8	Confident	57 Å²	57	82.6 Å²	82.6	59%	0.588	44%	0.441	S	S	*	.			trans	-92.4	-37.3	-175.3	0	0	0	0	0	114.8	A34	A34-G36 VanDerWaalsContact C-N 3.32Å; A34-G36 PolarHBondContact O-N 3Å
37	D	70.5	Confident	82	Confident	122 Å²	122	75.7 Å²	75.7	65%	0.652	42%	0.415	S	S	*	.	S	Bend	trans	-147.3	155.2	-163.2	-60	-49.3	0	0	0	112.7	A39 S40	D37-A39 PolarHBondContact O-N 3.34Å; D37-A39 VanDerWaalsContact O-N 3.08Å; D37-S40 WeakPolarHBondContact O-CA 3.34Å; D37-S40 VanDerWaalsContact O-CB 3.27Å; D37-S40 WeakPolarHBondContact O-CB 3.04Å; D37-S40 PolarHBondContact O-N 2.93Å; D37-S40 PolarHBondContact O-OG 3.02Å
38	A	71.6	Confident	82.1	Confident	82 Å²	82	74.4 Å²	74.4	68%	0.678	41%	0.414	S	S	*	.	H	α-helix	trans	-54	-31.2	173.8	0	0	0	0	0	113	S40 V41 D42	A38-S40 VanDerWaalsContact C-N 3.26Å; A38-S40 PolarHBondContact O-N 2.9Å; A38-V41 PolarHBondContact O-N 2.87Å; A38-D42 PolarHBondContact O-N 3.04Å
39	A	75.4	Confident	82.2	Confident	69 Å²	69	80.2 Å²	80.2	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-63	-29.8	174.3	0	0	0	0	0	113.4	D37 L43	D37-A39 PolarHBondContact O-N 3.34Å; D37-A39 VanDerWaalsContact O-N 3.08Å; A39-L43 WeakPolarHBondContact O-CB 3.45Å; A39-L43 PolarHBondContact O-N 3.46Å
40	S	81.4	Confident	82.5	Confident	15 Å²	15	81.5 Å²	81.5	11%	0.105	45%	0.446	C	S	.	.	H	α-helix	trans	-69	-36.1	176.5	73.4	0	0	0	0	111.5	D37 A38 L43 C44	D37-S40 WeakPolarHBondContact O-CA 3.34Å; D37-S40 VanDerWaalsContact O-CB 3.27Å; D37-S40 WeakPolarHBondContact O-CB 3.04Å; D37-S40 PolarHBondContact O-N 2.93Å; D37-S40 PolarHBondContact O-OG 3.02Å; A38-S40 VanDerWaalsContact C-N 3.26Å; A38-S40 PolarHBondContact O-N 2.9Å; S40-L43 PolarHBondContact O-N 3.37Å; S40-C44 PolarHBondContact O-N 2.93Å; S40-C44 PolarHBondContact O-SG 3.41Å
41	V	84.7	Confident	82.9	Confident	66 Å²	66	77.4 Å²	77.4	40%	0.4	43%	0.425	S	S	.	.	H	α-helix	trans	-68.2	-44.2	178.1	-176.6	0	0	0	0	110.7	A38 L43 C44 R45	A38-V41 PolarHBondContact O-N 2.87Å; V41-L43 VanDerWaalsContact C-N 3.3Å; V41-L43 PolarHBondContact O-N 3.46Å; V41-C44 WeakPolarHBondContact O-CB 3.48Å; V41-C44 PolarHBondContact O-N 3.28Å; V41-R45 WeakPolarHBondContact O-CG 3.44Å; V41-R45 PolarHBondContact O-N 2.81Å
42	D	87.4	Confident	83.4	Confident	72 Å²	72	78 Å²	78	39%	0.385	43%	0.432	S	S	.	.	H	α-helix	trans	-66.5	-33.7	176.2	-70.5	-35.8	0	0	0	112.2	A38 R45 R46	A38-D42 PolarHBondContact O-N 3.04Å; D42-R45 IonicContact OD1-NH1 3.83Å; D42-R45 PolarHBondContact OD1-NH1 3.42Å; D42-R46 WeakPolarHBondContact O-CG 3.49Å; D42-R46 PolarHBondContact O-N 3.41Å; D42-R46 PolarHBondContact O-NH1 3.28Å
43	L	89.8	Confident	83.8	Confident	53 Å²	53	77.8 Å²	77.8	28%	0.277	44%	0.44	S	S	.	.	H	α-helix	trans	-64.5	-45.2	170.6	-179.7	59	0	0	0	111.5	Q31 A39 S40 V41 R45 R46 L47	Q31-L43 VanDerWaalsContact CD-CD2 3.47Å; Q31-L43 HydrophobicContact CG-CD2 3.82Å; Q31-L43 HydrophobicContact CG-CG 4.27Å; A39-L43 WeakPolarHBondContact O-CB 3.45Å; A39-L43 PolarHBondContact O-N 3.46Å; S40-L43 PolarHBondContact O-N 3.37Å; V41-L43 VanDerWaalsContact C-N 3.3Å; V41-L43 PolarHBondContact O-N 3.46Å; L43-R45 VanDerWaalsContact C-N 3.34Å; L43-R45 PolarHBondContact O-N 3.13Å; L43-R46 PolarHBondContact O-N 3.45Å; L43-L47 HydrophobicContact CD1-CD1 4.43Å; L43-L47 HydrophobicContact CD1-CG 4.29Å; L43-L47 HydrophobicContact CG-CD1 4.18Å; L43-L47 HydrophobicContact CG-CG 4.49Å; L43-L47 WeakPolarHBondContact O-CG 3.17Å; L43-L47 PolarHBondContact O-N 3.35Å
44	C	90.3	Very high	84.4	Confident	18 Å²	18	69.4 Å²	69.4	12%	0.122	41%	0.409	C	S	.	.	H	α-helix	trans	-58	-46.1	175.2	-69.2	0	0	0	0	111.4	L28 Q31 S40 V41 R46 L47 V48	L28-C44 HydrophobicContact CD1-CB 3.76Å; Q31-C44 VanDerWaalsContact CB-SG 3.58Å; S40-C44 PolarHBondContact O-N 2.93Å; S40-C44 PolarHBondContact O-SG 3.41Å; V41-C44 WeakPolarHBondContact O-CB 3.48Å; V41-C44 PolarHBondContact O-N 3.28Å; C44-R46 VanDerWaalsContact C-N 3.35Å; C44-R46 PolarHBondContact O-N 3.23Å; C44-L47 PolarHBondContact O-N 2.86Å; C44-V48 WeakPolarHBondContact O-CG2 3.43Å; C44-V48 PolarHBondContact O-N 3.18Å
45	R	90.2	Very high	85.6	Confident	142 Å²	142	68.4 Å²	68.4	54%	0.536	40%	0.396	S	S	.	.	H	α-helix	trans	-57.3	-47.2	174.8	-71.6	179.4	-176	123.1	2.4	111.4	V41 D42 L43 L47 V48 H49	V41-R45 WeakPolarHBondContact O-CG 3.44Å; V41-R45 PolarHBondContact O-N 2.81Å; D42-R45 IonicContact OD1-NH1 3.83Å; D42-R45 PolarHBondContact OD1-NH1 3.42Å; L43-R45 VanDerWaalsContact C-N 3.34Å; L43-R45 PolarHBondContact O-N 3.13Å; R45-L47 PolarHBondContact O-N 3.07Å; R45-V48 PolarHBondContact O-N 3.06Å; R45-H49 PolarHBondContact O-CD2 3.22Å; R45-H49 PolarHBondContact O-N 3.27Å
46	R	93.5	Very high	86.9	Confident	146 Å²	146	68.6 Å²	68.6	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-60.1	-44.6	177.4	-74.6	-170	-57.7	-90	3.8	112.2	D42 L43 C44 H49 Q50	D42-R46 WeakPolarHBondContact O-CG 3.49Å; D42-R46 PolarHBondContact O-N 3.41Å; D42-R46 PolarHBondContact O-NH1 3.28Å; L43-R46 PolarHBondContact O-N 3.45Å; C44-R46 VanDerWaalsContact C-N 3.35Å; C44-R46 PolarHBondContact O-N 3.23Å; R46-H49 PolarHBondContact O-N 3.01Å; R46-Q50 WeakPolarHBondContact O-CB 3.39Å; R46-Q50 PolarHBondContact O-N 2.98Å
47	L	93.3	Very high	88.1	Confident	7 Å²	7	68 Å²	68	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-61.5	-45.8	177.8	-71.3	171.6	0	0	0	111.4	L24 Q27 L28 Q31 L43 C44 R45 H49 Q50 I51	L24-L47 HydrophobicContact CD2-CD2 3.62Å; Q27-L47 HydrophobicContact CB-CD1 4.02Å; Q27-L47 HydrophobicContact CB-CD2 4.05Å; L28-L47 HydrophobicContact CB-CB 4.35Å; L28-L47 HydrophobicContact CB-CD1 4.17Å; L28-L47 HydrophobicContact CD1-CB 4.24Å; L28-L47 HydrophobicContact CD1-CD1 4.38Å; Q31-L47 HydrophobicContact CG-CD1 4.26Å; L43-L47 HydrophobicContact CD1-CD1 4.43Å; L43-L47 HydrophobicContact CD1-CG 4.29Å; L43-L47 HydrophobicContact CG-CD1 4.18Å; L43-L47 HydrophobicContact CG-CG 4.49Å; L43-L47 WeakPolarHBondContact O-CG 3.17Å; L43-L47 PolarHBondContact O-N 3.35Å; C44-L47 PolarHBondContact O-N 2.86Å; R45-L47 PolarHBondContact O-N 3.07Å; L47-H49 PolarHBondContact O-N 3.42Å; L47-Q50 PolarHBondContact O-N 2.88Å; L47-I51 VanDerWaalsContact O-CG1 3.28Å; L47-I51 WeakPolarHBondContact O-CG1 3.32Å; L47-I51 PolarHBondContact O-N 3.03Å
48	V	93.6	Very high	89	Confident	68 Å²	68	62.3 Å²	62.3	41%	0.412	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-48	175.9	171.8	0	0	0	0	111.2	L28 C44 R45 Q50 I51 V52	L28-V48 HydrophobicContact CD1-CG2 4.19Å; L28-V48 HydrophobicContact CD2-CG2 3.71Å; C44-V48 WeakPolarHBondContact O-CG2 3.43Å; C44-V48 PolarHBondContact O-N 3.18Å; R45-V48 PolarHBondContact O-N 3.06Å; V48-Q50 VanDerWaalsContact C-N 3.26Å; V48-Q50 PolarHBondContact O-N 3.47Å; V48-I51 PolarHBondContact O-N 3.21Å; V48-V52 HydrophobicContact CG1-CG2 4.43Å; V48-V52 WeakPolarHBondContact O-CG2 3.46Å; V48-V52 PolarHBondContact O-N 3.1Å
49	H	93.2	Very high	89.8	Confident	137 Å²	137	61.3 Å²	61.3	63%	0.634	33%	0.331	S	S	*	.	H	α-helix	trans	-58.6	-39.1	176.7	-80.8	-67.3	0	0	0	112.4	R45 R46 L47 A53	R45-H49 PolarHBondContact O-CD2 3.22Å; R45-H49 PolarHBondContact O-N 3.27Å; R46-H49 PolarHBondContact O-N 3.01Å; L47-H49 PolarHBondContact O-N 3.42Å; H49-A53 VanDerWaalsContact O-CB 3.32Å; H49-A53 WeakPolarHBondContact O-CB 3.44Å; H49-A53 PolarHBondContact O-N 3.35Å
50	Q	93.9	Very high	90.4	Very high	64 Å²	64	59.7 Å²	59.7	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-39	178.2	-165.3	179.5	-29.1	0	0	112.3	L24 R46 L47 V48 L54	L24-Q50 HydrophobicContact CD1-CB 3.97Å; L24-Q50 HydrophobicContact CD1-CG 3.55Å; L24-Q50 HydrophobicContact CD2-CG 4.29Å; R46-Q50 WeakPolarHBondContact O-CB 3.39Å; R46-Q50 PolarHBondContact O-N 2.98Å; L47-Q50 PolarHBondContact O-N 2.88Å; V48-Q50 VanDerWaalsContact C-N 3.26Å; V48-Q50 PolarHBondContact O-N 3.47Å; Q50-L54 HydrophobicContact CG-CD1 4.24Å; Q50-L54 WeakPolarHBondContact O-CB 3.32Å; Q50-L54 WeakPolarHBondContact O-CG 3.27Å; Q50-L54 PolarHBondContact O-N 3.13Å
51	I	94.5	Very high	90.5	Very high	26 Å²	26	59.9 Å²	59.9	13%	0.133	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-49.4	174.6	-70.3	161.5	0	0	0	110.2	V21 L24 V25 L28 L47 V48 L54 T55	V21-I51 HydrophobicContact CG1-CG2 4.24Å; L24-I51 HydrophobicContact CB-CD1 3.99Å; L24-I51 HydrophobicContact CB-CG1 3.52Å; L24-I51 HydrophobicContact CD1-CG1 4.13Å; L24-I51 HydrophobicContact CG-CG1 4.48Å; V25-I51 HydrophobicContact CG2-CD1 3.86Å; V25-I51 HydrophobicContact CG2-CG1 4.35Å; L28-I51 HydrophobicContact CD2-CD1 4.12Å; L47-I51 VanDerWaalsContact O-CG1 3.28Å; L47-I51 WeakPolarHBondContact O-CG1 3.32Å; L47-I51 PolarHBondContact O-N 3.03Å; V48-I51 PolarHBondContact O-N 3.21Å; I51-L54 PolarHBondContact O-N 2.98Å; I51-T55 WeakPolarHBondContact O-CB 3.26Å; I51-T55 PolarHBondContact O-N 3.45Å; I51-T55 PolarHBondContact O-OG1 3.06Å
52	V	93.5	Very high	90.4	Very high	73 Å²	73	60.5 Å²	60.5	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-59.7	-49.9	178.8	173.1	0	0	0	0	110.4	V48 L54 T55 D56	V48-V52 HydrophobicContact CG1-CG2 4.43Å; V48-V52 WeakPolarHBondContact O-CG2 3.46Å; V48-V52 PolarHBondContact O-N 3.1Å; V52-L54 PolarHBondContact O-N 3.23Å; V52-T55 PolarHBondContact O-N 2.81Å; V52-D56 WeakPolarHBondContact O-CB 3.47Å; V52-D56 PolarHBondContact O-N 2.79Å
53	A	91.7	Very high	90.3	Very high	58 Å²	58	65.4 Å²	65.4	48%	0.479	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-41.7	-178.7	0	0	0	0	0	113.3	H49 S57	H49-A53 VanDerWaalsContact O-CB 3.32Å; H49-A53 WeakPolarHBondContact O-CB 3.44Å; H49-A53 PolarHBondContact O-N 3.35Å; A53-S57 WeakPolarHBondContact O-CB 3.44Å; A53-S57 PolarHBondContact O-N 3.37Å
54	L	91.5	Very high	89.6	Confident	17 Å²	17	67 Å²	67	9%	0.089	35%	0.35	C	S	.	.	H	α-helix	trans	-69.5	-37.3	176.9	-76	169.9	0	0	0	112.3	R20 V21 L24 Q50 I51 V52 S57 S58	R20-L54 HydrophobicContact CB-CD1 4.13Å; R20-L54 HydrophobicContact CG-CD1 3.67Å; V21-L54 HydrophobicContact CG2-CB 3.6Å; V21-L54 HydrophobicContact CG2-CD1 4.29Å; L24-L54 HydrophobicContact CD1-CD1 3.5Å; L24-L54 VanDerWaalsContact CD1-CD1 3.5Å; Q50-L54 HydrophobicContact CG-CD1 4.24Å; Q50-L54 WeakPolarHBondContact O-CB 3.32Å; Q50-L54 WeakPolarHBondContact O-CG 3.27Å; Q50-L54 PolarHBondContact O-N 3.13Å; I51-L54 PolarHBondContact O-N 2.98Å; V52-L54 PolarHBondContact O-N 3.23Å; L54-S57 PolarHBondContact O-N 3.48Å; L54-S58 WeakPolarHBondContact O-CB 3.44Å; L54-S58 PolarHBondContact O-N 2.91Å; L54-S58 PolarHBondContact O-OG 2.85Å
55	T	91.4	Very high	88.5	Confident	48 Å²	48	68.4 Å²	68.4	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-44.6	176.6	-54.9	0	0	0	0	110.3	I51 V52 S57 S58 I59	I51-T55 WeakPolarHBondContact O-CB 3.26Å; I51-T55 PolarHBondContact O-N 3.45Å; I51-T55 PolarHBondContact O-OG1 3.06Å; V52-T55 PolarHBondContact O-N 2.81Å; T55-S57 PolarHBondContact O-N 3.49Å; T55-S58 WeakPolarHBondContact O-CB 3.5Å; T55-S58 PolarHBondContact O-N 3.35Å; T55-I59 HydrophobicContact CG2-CD1 3.92Å; T55-I59 HydrophobicContact CG2-CG1 4.5Å; T55-I59 WeakPolarHBondContact O-CB 3.43Å; T55-I59 VanDerWaalsContact O-CG1 3.26Å; T55-I59 WeakPolarHBondContact O-CG1 3.41Å; T55-I59 PolarHBondContact O-N 2.87Å
56	D	90.1	Very high	87.1	Confident	101 Å²	101	67.3 Å²	67.3	54%	0.54	37%	0.371	S	S	.	.	H	α-helix	trans	-62.3	-42.3	175.3	-74.8	-24.3	0	0	0	112.1	V52 S58 I59 G60	V52-D56 WeakPolarHBondContact O-CB 3.47Å; V52-D56 PolarHBondContact O-N 2.79Å; D56-S58 PolarHBondContact O-N 3.39Å; D56-I59 PolarHBondContact O-N 3.21Å; D56-G60 PolarHBondContact O-N 3.48Å
57	S	88.7	Confident	85.4	Confident	43 Å²	43	66 Å²	66	30%	0.301	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-45	173.1	176.1	0	0	0	0	111.6	A53 L54 T55 G60 M61	A53-S57 WeakPolarHBondContact O-CB 3.44Å; A53-S57 PolarHBondContact O-N 3.37Å; L54-S57 PolarHBondContact O-N 3.48Å; T55-S57 PolarHBondContact O-N 3.49Å; S57-G60 PolarHBondContact O-N 3.5Å; S57-M61 WeakPolarHBondContact O-CG 3.35Å; S57-M61 PolarHBondContact O-N 2.95Å
58	S	90	Very high	83.5	Confident	4 Å²	4	70.9 Å²	70.9	3%	0.028	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-45	179.2	-62.5	0	0	0	0	112.2	L14 D17 L54 T55 D56 G60 M61 L62	L14-S58 WeakPolarHBondContact CD1-O 3.48Å; D17-S58 WeakPolarHBondContact CB-OG 3.44Å; L54-S58 WeakPolarHBondContact O-CB 3.44Å; L54-S58 PolarHBondContact O-N 2.91Å; L54-S58 PolarHBondContact O-OG 2.85Å; T55-S58 WeakPolarHBondContact O-CB 3.5Å; T55-S58 PolarHBondContact O-N 3.35Å; D56-S58 PolarHBondContact O-N 3.39Å; S58-G60 VanDerWaalsContact C-N 3.29Å; S58-G60 PolarHBondContact O-N 3.37Å; S58-M61 PolarHBondContact O-N 2.94Å; S58-L62 PolarHBondContact O-N 3.38Å
59	I	88.6	Confident	81.4	Confident	60 Å²	60	72.1 Å²	72.1	31%	0.308	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-40.4	173.9	-67.9	166.7	0	0	0	110.3	T55 D56 L62 R63	T55-I59 HydrophobicContact CG2-CD1 3.92Å; T55-I59 HydrophobicContact CG2-CG1 4.5Å; T55-I59 WeakPolarHBondContact O-CB 3.43Å; T55-I59 VanDerWaalsContact O-CG1 3.26Å; T55-I59 WeakPolarHBondContact O-CG1 3.41Å; T55-I59 PolarHBondContact O-N 2.87Å; D56-I59 PolarHBondContact O-N 3.21Å; I59-L62 PolarHBondContact O-N 3Å; I59-R63 HydrophobicContact CG2-CG 4.42Å; I59-R63 VanDerWaalsContact CG2-CZ 3.48Å; I59-R63 WeakPolarHBondContact O-CB 3.47Å; I59-R63 VanDerWaalsContact O-CG 3.3Å; I59-R63 WeakPolarHBondContact O-CG 3.27Å; I59-R63 PolarHBondContact O-N 3.02Å
60	G	87	Confident	79.2	Confident	35 Å²	35	70.3 Å²	70.3	36%	0.361	42%	0.42	S	S	.	.	H	α-helix	trans	-57.3	-48.5	173.8	0	0	0	0	0	112.5	D56 S57 S58 L62 R63 S64	D56-G60 PolarHBondContact O-N 3.48Å; S57-G60 PolarHBondContact O-N 3.5Å; S58-G60 VanDerWaalsContact C-N 3.29Å; S58-G60 PolarHBondContact O-N 3.37Å; G60-L62 VanDerWaalsContact C-N 3.34Å; G60-L62 PolarHBondContact O-N 3.21Å; G60-R63 PolarHBondContact O-N 3.43Å; G60-S64 PolarHBondContact O-N 3.06Å; G60-S64 PolarHBondContact O-OG 2.7Å
61	M	83.3	Confident	77	Confident	19 Å²	19	72.8 Å²	72.8	9%	0.094	44%	0.442	C	S	.	.	H	α-helix	trans	-62.6	-37.9	177.6	-72.2	-169	-68.7	0	0	113.2	R13 L14 D17 S57 S58 S64 S65	R13-M61 HydrophobicContact CB-SD 4.16Å; R13-M61 HydrophobicContact CG-CE 4.27Å; R13-M61 HydrophobicContact CG-SD 3.82Å; R13-M61 PolarHBondContact NH1-SD 3.41Å; L14-M61 HydrophobicContact CB-CE 4.15Å; L14-M61 HydrophobicContact CD1-CE 3.99Å; D17-M61 HydrophobicContact CB-CE 4.21Å; D17-M61 WeakPolarHBondContact OD2-CE 3.48Å; S57-M61 WeakPolarHBondContact O-CG 3.35Å; S57-M61 PolarHBondContact O-N 2.95Å; S58-M61 PolarHBondContact O-N 2.94Å; M61-S64 WeakPolarHBondContact CA-OG 3.41Å; M61-S64 PolarHBondContact O-OG 3.43Å; M61-S64 VanDerWaalsContact O-OG 3.07Å; M61-S65 WeakPolarHBondContact O-CB 3.33Å; M61-S65 PolarHBondContact O-N 2.89Å; M61-S65 PolarHBondContact O-OG 2.91Å
62	L	83.4	Confident	74.9	Confident	79 Å²	79	79.4 Å²	79.4	41%	0.414	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-41.1	175.1	-78.8	169.6	0	0	0	111.7	L14 S58 I59 G60 S65 L68	L14-L62 HydrophobicContact CD1-CD1 4.25Å; L14-L62 HydrophobicContact CD1-CG 4.03Å; L14-L62 HydrophobicContact CD2-CD1 4.19Å; L14-L62 HydrophobicContact CD2-CD2 3.43Å; L14-L62 VanDerWaalsContact CD2-CD2 3.43Å; L14-L62 HydrophobicContact CD2-CG 3.7Å; S58-L62 PolarHBondContact O-N 3.38Å; I59-L62 PolarHBondContact O-N 3Å; G60-L62 VanDerWaalsContact C-N 3.34Å; G60-L62 PolarHBondContact O-N 3.21Å; L62-S65 PolarHBondContact O-N 3.38Å; L62-L68 HydrophobicContact CD2-CD1 3.89Å
63	R	84.3	Confident	72.7	Confident	175 Å²	175	81.3 Å²	81.3	66%	0.66	49%	0.491	S	S	*	.	H	α-helix	trans	-70.5	-32.2	178.3	-72.6	175	177.2	165.8	2.6	113	I59 G60 S65	I59-R63 HydrophobicContact CG2-CG 4.42Å; I59-R63 VanDerWaalsContact CG2-CZ 3.48Å; I59-R63 WeakPolarHBondContact O-CB 3.47Å; I59-R63 VanDerWaalsContact O-CG 3.3Å; I59-R63 WeakPolarHBondContact O-CG 3.27Å; I59-R63 PolarHBondContact O-N 3.02Å; G60-R63 PolarHBondContact O-N 3.43Å; R63-S65 VanDerWaalsContact C-N 3.31Å
64	S	76.2	Confident	70.5	Confident	88 Å²	88	83.4 Å²	83.4	62%	0.615	51%	0.508	S	S	*	.	H	α-helix	trans	-79.4	-12.5	176.9	64.1	0	0	0	0	113.7	G60 M61 P66	G60-S64 PolarHBondContact O-N 3.06Å; G60-S64 PolarHBondContact O-OG 2.7Å; M61-S64 WeakPolarHBondContact CA-OG 3.41Å; M61-S64 PolarHBondContact O-OG 3.43Å; M61-S64 VanDerWaalsContact O-OG 3.07Å; S64-P66 WeakPolarHBondContact O-CD 3.35Å
65	S	66.5	Low	68.2	Low	47 Å²	47	88.8 Å²	88.8	33%	0.329	54%	0.542	S	S	.	.			trans	-102.3	92.7	177.6	-58.7	0	0	0	0	110.1	M61 L62 R63 D67	M61-S65 WeakPolarHBondContact O-CB 3.33Å; M61-S65 PolarHBondContact O-N 2.89Å; M61-S65 PolarHBondContact O-OG 2.91Å; L62-S65 PolarHBondContact O-N 3.38Å; R63-S65 VanDerWaalsContact C-N 3.31Å; S65-D67 PolarHBondContact O-N 3.13Å
66	P	60.7	Low	66.1	Low	119 Å²	119	89.8 Å²	89.8	77%	0.773	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-70.8	10	-177.5	29	-35.6	0	0	0	114.8	S64	S64-P66 WeakPolarHBondContact O-CD 3.35Å
67	D	57.6	Low	64	Low	119 Å²	119	91.7 Å²	91.7	64%	0.636	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-103.7	17.1	-166.7	-142.8	17.5	0	0	0	114.8	S65	S65-D67 PolarHBondContact O-N 3.13Å
68	L	53.1	Low	61.8	Low	109 Å²	109	93.3 Å²	93.3	57%	0.571	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-114.3	6.4	174.2	-72.4	168.1	0	0	0	113.7	L62	L62-L68 HydrophobicContact CD2-CD1 3.89Å
69	A	51	Low	59.8	Low	93 Å²	93	98.7 Å²	98.7	77%	0.769	64%	0.639	S	S	*	*			trans	-121.1	17.6	-178.2	0	0	0	0	0	114.1
70	S	45.4	Very low	57.7	Low	99 Å²	99	101.4 Å²	101.4	69%	0.692	66%	0.66	S	S	*	*			trans	-85.3	125.2	174.9	-128.5	0	0	0	0	110.3	L72	S70-L72 PolarHBondContact O-N 3.39Å
71	P	47.8	Very low	56.1	Low	117 Å²	117	107.4 Å²	107.4	76%	0.76	68%	0.682	S	S	*	*			trans	-63.7	130.7	175.5	-4.4	16.6	0	0	0	109.5
72	L	51.2	Low	54.3	Low	164 Å²	164	111.8 Å²	111.8	86%	0.859	72%	0.715	S	S	*	*			trans	-45.8	128.3	172.4	-69.3	155.8	0	0	0	110.9	S70 A74	S70-L72 PolarHBondContact O-N 3.39Å; L72-A74 PolarHBondContact O-N 2.99Å
73	P	46.4	Very low	53	Low	113 Å²	113	113.5 Å²	113.5	73%	0.734	73%	0.733	S	S	*	*			trans	-71.2	117.3	163.5	28	-28.2	0	0	0	107.8	T75	P73-T75 PolarHBondContact O-N 3.24Å; P73-T75 PolarHBondContact O-OG1 3.34Å
74	A	46.9	Very low	51.1	Low	103 Å²	103	112.9 Å²	112.9	85%	0.851	74%	0.743	S	S	*	*			trans	-62.8	96.2	171.1	0	0	0	0	0	109.3	L72 G76	L72-A74 PolarHBondContact O-N 2.99Å; A74-G76 VanDerWaalsContact C-N 3.3Å; A74-G76 PolarHBondContact O-N 3.46Å; A74-G76 VanDerWaalsContact O-N 3.16Å
75	T	42.5	Very low	49.9	Very low	129 Å²	129	113.3 Å²	113.3	79%	0.791	75%	0.752	S	S	*	*			trans	-81.7	81.9	166.9	-39.1	0	0	0	0	107.4	P73	P73-T75 PolarHBondContact O-N 3.24Å; P73-T75 PolarHBondContact O-OG1 3.34Å
76	G	47	Very low	49	Very low	70 Å²	70	115.5 Å²	115.5	72%	0.722	77%	0.773	S	S	*	*			trans	-107.1	90.7	170.5	0	0	0	0	0	109.5	A74	A74-G76 VanDerWaalsContact C-N 3.3Å; A74-G76 PolarHBondContact O-N 3.46Å; A74-G76 VanDerWaalsContact O-N 3.16Å
77	T	46	Very low	48.7	Very low	140 Å²	140	115.4 Å²	115.4	86%	0.859	78%	0.776	S	S	*	*			trans	-53.3	126.4	168	28	0	0	0	0	111.7
78	G	44.1	Very low	48.4	Very low	78 Å²	78	116.6 Å²	116.6	80%	0.804	78%	0.782	S	S	*	*			trans	-172.9	60.6	176.4	0	0	0	0	0	113.2
79	S	46.4	Very low	48.5	Very low	116 Å²	116	120.8 Å²	120.8	81%	0.811	80%	0.798	S	S	*	*			trans	-97.8	153.2	151.7	-66.7	0	0	0	0	106.1
80	P	45.6	Very low	48.5	Very low	117 Å²	117	121.9 Å²	121.9	76%	0.76	80%	0.797	S	S	*	*			cis	-155.1	-175.8	46.5	38.2	-14.5	0	0	0	116.9
81	I	52.1	Low	48.6	Very low	161 Å²	161	127.2 Å²	127.2	83%	0.826	81%	0.808	S	S	*	*			trans	118.1	109	139.2	-139.3	166.8	0	0	0	117.3
82	S	47.2	Very low	48.4	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	81%	0.814	S	S	*	*			trans	-70.6	145.3	166.1	-63.6	0	0	0	0	111.7
83	S	55.2	Low	47.9	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	81%	0.81	S	S	*	*			trans	-161.9	151.4	133.8	-24.2	0	0	0	0	111
84	D	44.8	Very low	47.7	Very low	162 Å²	162	128.7 Å²	128.7	87%	0.866	82%	0.815	S	S	*	*			trans	-54.8	151	-172.5	-54.6	-86.2	0	0	0	117.6
85	A	49.6	Very low	47.4	Very low	98 Å²	98	128.2 Å²	128.2	81%	0.81	81%	0.811	S	S	*	*				176.6	117.4	126.7	0	0	0	0	0	112.9
86	A	48.8	Very low	47.3	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	81%	0.811	S	S	*	*			trans	39.2	119.6	138.7	0	0	0	0	0	120.7
87	S	54.7	Low	47.3	Very low	118 Å²	118	128.4 Å²	128.4	83%	0.825	81%	0.811	S	S	*	*				170.6	147.1	102.7	-66.9	0	0	0	0	112.7
88	D	50.3	Low	47	Very low	143 Å²	143	127 Å²	127	77%	0.765	81%	0.808	S	S	*	*			trans	-50.6	142.3	-168.1	-61.3	-88.9	0	0	0	120.3
89	H	55.5	Low	47	Very low	197 Å²	197	128.3 Å²	128.3	91%	0.912	81%	0.811	S	S	*	*			trans	-170.6	119.3	135.7	-103.8	-68.4	0	0	0	110.8
90	P	50.6	Low	47.5	Very low	117 Å²	117	127.5 Å²	127.5	76%	0.76	81%	0.805	S	S	*	*			trans	-110.9	127.3	170.5	34.4	-22.7	0	0	0	112.2
91	F	49.1	Very low	47.9	Very low	210 Å²	210	128 Å²	128	92%	0.921	81%	0.808	S	S	*	*			trans	-133.5	122.4	153.7	-162.6	-99.1	0	0	0	109.8
92	R	43.5	Very low	47.8	Very low	231 Å²	231	130.1 Å²	130.1	87%	0.872	81%	0.811	S	S	*	*			trans	-79.1	143.6	-175.6	-74.8	-172.6	161.7	-143.3	-1	112.1
93	A	40.1	Very low	48.1	Very low	94 Å²	94	134.7 Å²	134.7	78%	0.777	82%	0.817	S	S	*	*			trans	161.1	103.3	130.2	0	0	0	0	0	107.6
94	A	41.2	Very low	48	Very low	101 Å²	101	140.9 Å²	140.9	84%	0.835	82%	0.823	S	S	*	*				97.6	144.3	89.7	0	0	0	0	0	112
95	A	40.8	Very low	48.4	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	82%	0.822	S	S	*	*			trans	85.8	84.9	171	0	0	0	0	0	118.1
96	S	40	Very low	48.4	Very low	114 Å²	114	142.5 Å²	142.5	80%	0.797	82%	0.822	S	S	*	*				3.9	138.3	125.4	56.4	0	0	0	0	119.1
97	A	46.9	Very low	48.7	Very low	88 Å²	88	144.4 Å²	144.4	73%	0.727	82%	0.824	S	S	*	*			trans	126.8	110.3	136.6	0	0	0	0	0	115
98	S	39.7	Very low	48.4	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	82%	0.823	S	S	*	*			trans	44.3	96.6	144.2	63.6	0	0	0	0	118.2
99	A	45.6	Very low	48.5	Very low	105 Å²	105	147.5 Å²	147.5	87%	0.868	83%	0.828	S	S	*	*			trans	-114	87.2	160.1	0	0	0	0	0	109.7
100	S	55.8	Low	48.6	Very low	99 Å²	99	144.9 Å²	144.9	69%	0.692	81%	0.81	S	S	*	*			trans	-52.6	140.4	168.1	-54.7	0	0	0	0	111	K102	S100-K102 PolarHBondContact O-N 3.02Å
101	P	54	Low	49.2	Very low	126 Å²	126	142.8 Å²	142.8	82%	0.818	80%	0.795	S	S	*	*			trans	-64.6	112.7	173.4	24.3	-29.9	0	0	0	109.2	K103	P101-K103 PolarHBondContact O-N 3.07Å
102	K	50.6	Low	50.6	Low	207 Å²	207	135.7 Å²	135.7	90%	0.9	77%	0.772	S	S	*	*			trans	-54.6	107.9	175.2	-82.5	164.6	172.5	165.1	0	109.2	S100 R104	S100-K102 PolarHBondContact O-N 3.02Å; K102-R104 PolarHBondContact O-N 3.11Å
103	K	52.7	Low	52.6	Low	207 Å²	207	131 Å²	131	90%	0.9	76%	0.76	S	S	*	*			trans	-49.7	105.3	164.3	-85.2	178.4	173.2	179.5	0	108.8	P101 K105	P101-K103 PolarHBondContact O-N 3.07Å; K103-K105 PolarHBondContact O-N 2.86Å; K103-K105 VanDerWaalsContact O-N 3.1Å
104	R	54.3	Low	54.8	Low	244 Å²	244	132.6 Å²	132.6	92%	0.921	75%	0.751	S	S	*	*			trans	-64.7	109.4	168.4	-134.3	169.2	70.8	175.4	2.5	106.7	K102 A106	K102-R104 PolarHBondContact O-N 3.11Å; R104-A106 PolarHBondContact O-N 2.86Å
105	K	52	Low	56.8	Low	198 Å²	198	129.3 Å²	129.3	86%	0.861	72%	0.724	S	S	*	*			trans	-59.6	108.4	175	-171.8	154.4	176.1	177.9	0	107.6	K103 T107	K103-K105 PolarHBondContact O-N 2.86Å; K103-K105 VanDerWaalsContact O-N 3.1Å; K105-T107 PolarHBondContact O-N 3.22Å
106	A	49.5	Very low	59	Low	97 Å²	97	131.7 Å²	131.7	80%	0.802	71%	0.713	S	S	*	*			trans	-60.2	106.4	174.1	0	0	0	0	0	107.8	R104 A108	R104-A106 PolarHBondContact O-N 2.86Å; A106-A108 PolarHBondContact O-N 2.85Å
107	T	55.5	Low	61.1	Low	131 Å²	131	127.4 Å²	127.4	80%	0.804	68%	0.682	S	S	*	*			trans	-60.9	127.9	170.1	46.7	0	0	0	0	107.5	K105 R109	K105-T107 PolarHBondContact O-N 3.22Å; T107-R109 PolarHBondContact O-N 3.31Å; T107-R109 VanDerWaalsContact O-N 3.14Å
108	A	48.2	Very low	62.7	Low	97 Å²	97	126.5 Å²	126.5	80%	0.802	67%	0.671	S	S	*	*			trans	-45.3	120.7	-179.3	0	0	0	0	0	110.5	A106 W110	A106-A108 PolarHBondContact O-N 2.85Å; A108-W110 PolarHBondContact O-N 3.49Å
109	R	52.3	Low	64.2	Low	230 Å²	230	123.4 Å²	123.4	87%	0.868	65%	0.651	S	S	*	*			trans	-61.9	104.5	177.4	-167.1	170	92.9	169	7.3	107.1	T107 T111	T107-R109 PolarHBondContact O-N 3.31Å; T107-R109 VanDerWaalsContact O-N 3.14Å; R109-T111 PolarHBondContact O-N 3.47Å
110	W	57.7	Low	64.7	Low	141 Å²	141	122.6 Å²	122.6	53%	0.534	65%	0.645	S	S	.	*			trans	-59.7	106.4	174.9	-178.1	-99.5	0	0	0	108.4	A108 S112 H184	A108-W110 PolarHBondContact O-N 3.49Å; W110-S112 PolarHBondContact O-N 2.9Å; W110-S112 VanDerWaalsContact O-N 3.12Å; W110-H184 AromaticContact CD1-ND1 3.6Å; W110-H184 HydrophobicContact CZ2-CB 3.55Å; W110-H184 VanDerWaalsContact NE1-CB 3.26Å; W110-H184 AromaticContact NE1-CE1 3.93Å; W110-H184 AromaticContact NE1-CG 3.3Å; W110-H184 VanDerWaalsContact NE1-CG 3.3Å; W110-H184 AromaticContact NE1-ND1 3.02Å; W110-H184 PolarHBondContact NE1-ND1 3.02Å
111	T	63	Low	64.1	Low	73 Å²	73	121.7 Å²	121.7	45%	0.448	65%	0.651	S	S	.	*			trans	-68.3	110.2	179.9	-45.8	0	0	0	0	108.2	R109	R109-T111 PolarHBondContact O-N 3.47Å
112	S	79.8	Confident	63.1	Low	62 Å²	62	119.7 Å²	119.7	43%	0.434	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.2	122.5	175.7	-167	0	0	0	0	108.4	W110 V182 Y183 H184	W110-S112 PolarHBondContact O-N 2.9Å; W110-S112 VanDerWaalsContact O-N 3.12Å; S112-V182 WeakPolarHBondContact OG-CG1 3.44Å; S112-Y183 WeakPolarHBondContact CA-O 3.37Å; S112-H184 PolarHBondContact OG-CE1 2.93Å; S112-H184 PolarHBondContact OG-ND1 2.81Å; S112-H184 VanDerWaalsContact OG-ND1 3.13Å
113	Q	84.4	Confident	62.3	Low	131 Å²	131	115.2 Å²	115.2	61%	0.612	65%	0.648	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.1	127.5	175.7	-65.3	-179.7	-2.7	0	0	108.7	V182 Y183	Q113-V182 CarbonylContact O-C 3.48Å; Q113-V182 WeakPolarHBondContact O-CA 3.46Å; Q113-Y183 PolarHBondContact N-O 2.99Å; Q113-Y183 PolarHBondContact O-N 2.84Å
114	Q	86.4	Confident	61.7	Low	128 Å²	128	109.9 Å²	109.9	60%	0.598	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.1	128.8	177.8	-175.7	171.7	2.4	0	0	109.7	V181 V182	Q114-V181 CarbonylContact C-O 3.58Å; Q114-V181 WeakPolarHBondContact CA-O 3.42Å; Q114-V182 HydrophobicContact CB-CG2 4.49Å; Q114-V182 HydrophobicContact CG-CG2 4.16Å
115	A	84.6	Confident	61.3	Low	33 Å²	33	102.3 Å²	102.3	27%	0.273	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.8	144.7	176.4	0	0	0	0	0	109.4	V117 V181	A115-V117 HydrophobicContact CB-CG2 4.23Å; A115-V181 PolarHBondContact N-O 3.06Å; A115-V181 PolarHBondContact O-N 2.97Å
116	R	86	Confident	61.2	Low	143 Å²	143	100 Å²	100	54%	0.54	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.1	124.2	169.2	-175	163.1	-71.3	171.3	-6.9	107.7	L178 F179 D180	R116-L178 HydrophobicContact CG-CB 4.31Å; R116-L178 HydrophobicContact CG-CD1 4.4Å; R116-F179 CarbonylContact C-O 3.47Å; R116-F179 WeakPolarHBondContact CA-O 3.48Å; R116-D180 IonicContact CZ-OD1 2.84Å; R116-D180 IonicContact NE-OD1 2.98Å; R116-D180 PolarHBondContact NE-OD1 2.9Å; R116-D180 IonicContact NH2-OD1 2.88Å; R116-D180 PolarHBondContact NH2-OD1 2.69Å; R116-D180 IonicContact NH2-OD2 2.81Å; R116-D180 PolarHBondContact NH2-OD2 2.73Å
117	V	83.6	Confident	61.5	Low	24 Å²	24	96.8 Å²	96.8	15%	0.145	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.5	131	-169.7	-171.1	0	0	0	0	108.9	A115 P128 V129 F179 V181	A115-V117 HydrophobicContact CB-CG2 4.23Å; V117-P128 HydrophobicContact CB-CB 4.17Å; V117-P128 HydrophobicContact CG1-CB 4.06Å; V117-P128 HydrophobicContact CG2-CB 4.5Å; V117-V129 HydrophobicContact CG1-CB 3.75Å; V117-V129 HydrophobicContact CG1-CG2 3.42Å; V117-V129 VanDerWaalsContact CG1-CG2 3.42Å; V117-F179 PolarHBondContact N-O 3.44Å; V117-F179 PolarHBondContact O-N 2.93Å; V117-V181 HydrophobicContact CB-CG2 4.46Å; V117-V181 HydrophobicContact CG2-CG2 3.97Å
118	S	82.2	Confident	61.7	Low	69 Å²	69	91.5 Å²	91.5	48%	0.483	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.2	140	172.8	-53.4	0	0	0	0	110.2	A120 A177 L178	S118-A120 VanDerWaalsContact C-N 3.31Å; S118-A120 PolarHBondContact O-N 2.87Å; S118-A177 CarbonylContact C-O 3.58Å; S118-A177 WeakPolarHBondContact CA-O 3.44Å; S118-L178 WeakPolarHBondContact OG-CD2 3.35Å
119	A	71.2	Confident	62.4	Low	46 Å²	46	91 Å²	91	38%	0.38	57%	0.566	S	S	.	*			trans	-67	93.6	163.6	0	0	0	0	0	108.5	G121 A177 F179	A119-G121 PolarHBondContact O-N 2.85Å; A119-A177 PolarHBondContact N-O 3.12Å; A119-F179 HydrophobicContact CB-CD2 4.33Å; A119-F179 HydrophobicContact CB-CE2 3.73Å
120	A	54.2	Low	63.6	Low	89 Å²	89	86.6 Å²	86.6	74%	0.736	56%	0.559	S	S	*	*			trans	-64.6	122.4	170.6	0	0	0	0	0	108.3	S118	S118-A120 VanDerWaalsContact C-N 3.31Å; S118-A120 PolarHBondContact O-N 2.87Å
121	G	43.7	Very low	64.9	Low	80 Å²	80	82 Å²	82	83%	0.825	55%	0.545	S	S	*	.	S	Bend	trans	-63.8	155.2	-166.2	0	0	0	0	0	115.3	A119	A119-G121 PolarHBondContact O-N 2.85Å
122	G	33.2	Very low	66.1	Low	84 Å²	84	79.6 Å²	79.6	87%	0.866	53%	0.534	S	S	*	.	S	Bend	trans	97.5	48.6	149	0	0	0	0	0	117.3
123	S	34.7	Very low	66.7	Low	112 Å²	112	79.9 Å²	79.9	78%	0.783	53%	0.526	S	S	*	.	S	Bend	trans	178.7	91.9	145.9	178.6	0	0	0	0	110.6	A125	S123-A125 PolarHBondContact O-N 2.81Å
124	G	40.1	Very low	67.2	Low	95 Å²	95	75.7 Å²	75.7	98%	0.979	51%	0.512	S	S	*	.	S	Bend	trans	53	1.2	150.5	0	0	0	0	0	121.4
125	A	44.6	Very low	67.6	Low	86 Å²	86	71.6 Å²	71.6	71%	0.711	49%	0.491	S	S	*	.			trans	-115.7	92	-178.4	0	0	0	0	0	108.2	S123 G127	S123-A125 PolarHBondContact O-N 2.81Å; A125-G127 PolarHBondContact O-N 2.92Å
126	E	50.6	Low	68.1	Low	148 Å²	148	77 Å²	77	69%	0.692	50%	0.504	S	S	*	.			trans	-62.9	79.5	171.2	-164.7	82.4	-175.5	0	0	109.1
127	G	56.2	Low	68.6	Low	31 Å²	31	75.4 Å²	75.4	32%	0.32	50%	0.501	S	S	.	.	S	Bend	trans	-162.6	144.6	-172.9	0	0	0	0	0	113.7	A125	A125-G127 PolarHBondContact O-N 2.92Å
128	P	58.1	Low	69.3	Low	20 Å²	20	79.9 Å²	79.9	13%	0.13	52%	0.516	C	S	.	.			trans	-56.3	152.4	172.2	-20.6	30.2	0	0	0	112.2	V117 V169 F179 V181	V117-P128 HydrophobicContact CB-CB 4.17Å; V117-P128 HydrophobicContact CG1-CB 4.06Å; V117-P128 HydrophobicContact CG2-CB 4.5Å; P128-V169 HydrophobicContact CG-CB 4.37Å; P128-V169 HydrophobicContact CG-CG1 3.42Å; P128-V169 VanDerWaalsContact CG-CG1 3.42Å; P128-V169 HydrophobicContact CG-CG2 3.99Å; P128-F179 HydrophobicContact CG-CB 4.13Å; P128-F179 HydrophobicContact CG-CG 4.36Å; P128-V181 HydrophobicContact CB-CG2 3.8Å; P128-V181 HydrophobicContact CG-CG2 3.57Å
129	V	64.7	Low	70	Confident	87 Å²	87	77.8 Å²	77.8	53%	0.527	51%	0.506	S	S	.	.			trans	-34.3	133.6	175.6	175.1	0	0	0	0	112.7	V117 D131	V117-V129 HydrophobicContact CG1-CB 3.75Å; V117-V129 HydrophobicContact CG1-CG2 3.42Å; V117-V129 VanDerWaalsContact CG1-CG2 3.42Å; V129-D131 PolarHBondContact O-N 2.98Å
130	D	77.4	Confident	71.3	Confident	137 Å²	137	80.6 Å²	80.6	73%	0.733	51%	0.511	S	S	*	.			trans	-62.1	114.4	178.4	-174.9	16.6	0	0	0	110.7	G132	D130-G132 VanDerWaalsContact C-N 3.29Å; D130-G132 PolarHBondContact OD1-N 2.86Å
131	D	84.6	Confident	73.4	Confident	45 Å²	45	82.5 Å²	82.5	24%	0.241	50%	0.503	C	S	.	.			trans	-90.5	10.1	-177.8	53.9	26.9	0	0	0	112.5	V129 Y133 W135 K167 Y183	V129-D131 PolarHBondContact O-N 2.98Å; D131-Y133 WeakPolarHBondContact O-CD2 3.49Å; D131-Y133 PolarHBondContact O-N 3.35Å; D131-Y133 PolarHBondContact OD1-N 3.48Å; D131-W135 PolarHBondContact OD1-NE1 2.92Å; D131-W135 PolarHBondContact OD2-NE1 3.07Å; D131-K167 IonicContact OD2-NZ 3.35Å; D131-K167 PolarHBondContact OD2-NZ 3.46Å; D131-Y183 VanDerWaalsContact OD2-CE1 3.24Å; D131-Y183 WeakPolarHBondContact OD2-CE1 3.35Å; D131-Y183 PolarHBondContact OD2-OH 2.72Å
132	G	88.7	Confident	76	Confident	21 Å²	21	84.7 Å²	84.7	22%	0.216	50%	0.496	C	S	.	.	S	Bend	trans	76.6	1.5	177.7	0	0	0	0	0	114.2	D130 A192	D130-G132 VanDerWaalsContact C-N 3.29Å; D130-G132 PolarHBondContact OD1-N 2.86Å; G132-A192 WeakPolarHBondContact O-CB 3.34Å; G132-A192 PolarHBondContact O-N 3.49Å
133	Y	92.4	Very high	79	Confident	68 Å²	68	82.6 Å²	82.6	27%	0.267	46%	0.464	S	S	.	.	S	Bend	trans	-106.7	147.4	172.5	-67.6	-78.5	0	0	0	111.4	D131 W135 H187 P191	D131-Y133 WeakPolarHBondContact O-CD2 3.49Å; D131-Y133 PolarHBondContact O-N 3.35Å; D131-Y133 PolarHBondContact OD1-N 3.48Å; Y133-W135 PolarHBondContact O-NE1 2.81Å; Y133-H187 HydrophobicContact CD1-CB 4.11Å; Y133-H187 AromaticContact CD1-CD2 3.88Å; Y133-H187 AromaticContact CD1-CE1 3.55Å; Y133-H187 AromaticContact CD1-CG 3.52Å; Y133-H187 AromaticContact CD1-ND1 3.3Å; Y133-H187 VanDerWaalsContact CD1-ND1 3.3Å; Y133-H187 WeakPolarHBondContact CD1-ND1 3.39Å; Y133-H187 AromaticContact CD1-NE2 3.92Å; Y133-H187 AromaticContact CD2-CD2 3.7Å; Y133-H187 AromaticContact CD2-NE2 3.63Å; Y133-H187 HydrophobicContact CE1-CB 3.46Å; Y133-H187 VanDerWaalsContact CE1-CB 3.46Å; Y133-H187 AromaticContact CE1-CD2 3.82Å; Y133-H187 AromaticContact CE1-CG 3.36Å; Y133-H187 AromaticContact CE1-ND1 3.63Å; Y133-H187 AromaticContact CE2-CD2 3.64Å; Y133-H187 AromaticContact CG-CD2 3.81Å; Y133-H187 AromaticContact CG-CE1 3.44Å; Y133-H187 VanDerWaalsContact CG-CE1 3.44Å; Y133-H187 AromaticContact CG-CG 3.93Å; Y133-H187 AromaticContact CG-ND1 3.7Å; Y133-H187 AromaticContact CG-NE2 3.52Å; Y133-H187 AromaticContact CZ-CD2 3.69Å; Y133-H187 AromaticContact CZ-CG 3.63Å; Y133-P191 HydrophobicContact CD1-CB 4.46Å; Y133-P191 HydrophobicContact CE1-CB 4.13Å; Y133-P191 HydrophobicContact CE1-CG 3.89Å
134	S	93.2	Very high	81.9	Confident	44 Å²	44	85.7 Å²	85.7	31%	0.308	47%	0.471	S	S	.	.			trans	-85.2	120.1	177.2	-70.9	0	0	0	0	110	T156 A192	S134-T156 WeakPolarHBondContact CB-OG1 3.31Å; S134-T156 WeakPolarHBondContact O-CG2 3.44Å; S134-T156 PolarHBondContact O-N 3.39Å; S134-T156 PolarHBondContact O-OG1 2.79Å; S134-T156 VanDerWaalsContact O-OG1 3.12Å; S134-A192 WeakPolarHBondContact OG-CB 3.48Å
135	W	95.2	Very high	84.5	Confident	41 Å²	41	85.3 Å²	85.3	16%	0.155	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.3	179.9	-60.5	95	0	0	0	112.1	D131 Y133 Y153 A165 K167 Y183 H187	D131-W135 PolarHBondContact OD1-NE1 2.92Å; D131-W135 PolarHBondContact OD2-NE1 3.07Å; Y133-W135 PolarHBondContact O-NE1 2.81Å; W135-Y153 HydrophobicContact CB-CD1 4.08Å; W135-A165 HydrophobicContact CH2-CB 4.19Å; W135-A165 HydrophobicContact CZ3-CB 4.44Å; W135-K167 VanDerWaalsContact CD1-CE 3.48Å; W135-K167 HydrophobicContact CD2-CD 3.74Å; W135-K167 VanDerWaalsContact CD2-CE 3.47Å; W135-K167 HydrophobicContact CD2-CG 3.96Å; W135-K167 HydrophobicContact CE3-CB 4.48Å; W135-K167 HydrophobicContact CE3-CD 4.08Å; W135-K167 HydrophobicContact CE3-CG 3.77Å; W135-K167 HydrophobicContact CG-CD 4.23Å; W135-K167 VanDerWaalsContact CG-CE 3.41Å; W135-K167 HydrophobicContact CH2-CB 4.11Å; W135-K167 HydrophobicContact CH2-CD 4.18Å; W135-K167 HydrophobicContact CH2-CG 4.12Å; W135-K167 HydrophobicContact CZ2-CD 3.85Å; W135-K167 HydrophobicContact CZ2-CG 4.31Å; W135-K167 HydrophobicContact CZ3-CB 4.08Å; W135-K167 HydrophobicContact CZ3-CD 4.29Å; W135-K167 HydrophobicContact CZ3-CG 3.86Å; W135-K167 VanDerWaalsContact NE1-NZ 3.13Å; W135-Y183 HydrophobicContact CH2-CD1 4.11Å; W135-Y183 HydrophobicContact CH2-CE1 4.31Å; W135-Y183 HydrophobicContact CZ2-CD1 4Å; W135-Y183 AromaticContact CZ2-CE1 3.76Å; W135-Y183 HydrophobicContact CZ2-CE1 3.76Å; W135-H187 AromaticContact CH2-CE1 3.53Å; W135-H187 AromaticContact CH2-NE2 3.2Å; W135-H187 WeakPolarHBondContact CH2-NE2 3.39Å; W135-H187 AromaticContact CZ2-CE1 3.56Å; W135-H187 AromaticContact CZ2-NE2 3.15Å; W135-H187 WeakPolarHBondContact CZ2-NE2 3.36Å
136	R	96	Very high	86.9	Confident	146 Å²	146	82.5 Å²	82.5	55%	0.551	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.9	170.4	-89.2	165.5	-172.1	136.5	7.1	109.7	Y138 Y153 R154 T156	R136-Y138 PolarHBondContact O-N 2.74Å; R136-Y153 WeakPolarHBondContact O-CA 3.45Å; R136-R154 PolarHBondContact N-O 2.99Å; R136-R154 PolarHBondContact O-N 2.98Å; R136-T156 HydrophobicContact CB-CG2 4.12Å; R136-T156 HydrophobicContact CG-CG2 3.48Å; R136-T156 VanDerWaalsContact CG-CG2 3.48Å; R136-T156 PolarHBondContact NH1-O 3.2Å; R136-T156 VanDerWaalsContact NH1-O 3.15Å
137	K	97.1	Very high	89	Confident	110 Å²	110	82.8 Å²	82.8	48%	0.478	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	129.9	172.4	-169.4	176.6	-178.4	179.3	0	108.8	Y152 Y153	K137-Y152 WeakPolarHBondContact CA-O 3.43Å; K137-Y153 HydrophobicContact CB-CD1 4Å; K137-Y153 HydrophobicContact CB-CE1 3.79Å; K137-Y153 HydrophobicContact CG-CE1 4.31Å
138	Y	97	Very high	90.8	Very high	118 Å²	118	83.7 Å²	83.7	46%	0.463	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-13	176.6	73.2	-93.4	0	0	0	113.4	R136 Y152 R154	R136-Y138 PolarHBondContact O-N 2.74Å; Y138-Y152 VanDerWaalsContact CD1-O 3.31Å; Y138-Y152 WeakPolarHBondContact CD1-O 3.29Å; Y138-Y152 VanDerWaalsContact CE1-CB 3.48Å; Y138-Y152 PolarHBondContact N-O 3.48Å; Y138-R154 VanDerWaalsContact CB-NH1 3.27Å; Y138-R154 HydrophobicContact CD1-CB 3.96Å; Y138-R154 HydrophobicContact CD1-CG 4.14Å; Y138-R154 HydrophobicContact CE1-CB 4.36Å
139	G	97.7	Very high	92.6	Very high	26 Å²	26	84.9 Å²	84.9	27%	0.268	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	167.7	178.6	0	0	0	0	0	112	Y152	G139-Y152 PolarHBondContact N-O 2.86Å; G139-Y152 PolarHBondContact O-N 3.46Å
140	Q	98.2	Very high	94.2	Very high	105 Å²	105	84.1 Å²	84.1	49%	0.491	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	141.3	169.9	-179.6	175.2	-57.2	0	0	107.2	P149 R150	Q140-P149 HydrophobicContact CG-CB 3.73Å; Q140-P149 HydrophobicContact CG-CG 4.29Å; Q140-R150 CarbonylContact C-O 3.52Å; Q140-R150 VanDerWaalsContact CA-O 3.3Å; Q140-R150 WeakPolarHBondContact CA-O 3.13Å
141	K	98	Very high	95.1	Very high	129 Å²	129	78.1 Å²	78.1	56%	0.561	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.6	128	177.3	-167.9	-177.4	177.5	-173.5	0	109.6	I143 R150 Y152	K141-I143 HydrophobicContact CB-CD1 4.33Å; K141-I143 HydrophobicContact CD-CD1 4.33Å; K141-I143 HydrophobicContact CG-CD1 4.33Å; K141-R150 PolarHBondContact N-O 2.83Å; K141-R150 PolarHBondContact O-N 2.89Å; K141-Y152 HydrophobicContact CB-CE2 3.68Å
142	D	97.9	Very high	95.8	Very high	125 Å²	125	77.9 Å²	77.9	67%	0.668	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-68	130	166.9	-59.8	-37.2	0	0	0	108.7	P149	D142-P149 WeakPolarHBondContact OD1-CB 3.3Å
143	I	96.7	Very high	96.2	Very high	40 Å²	40	79.1 Å²	79.1	21%	0.205	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-100.9	122.4	-175	-56.6	-55.8	0	0	0	108.2	K141 G145 A146 R150	K141-I143 HydrophobicContact CB-CD1 4.33Å; K141-I143 HydrophobicContact CD-CD1 4.33Å; K141-I143 HydrophobicContact CG-CD1 4.33Å; I143-G145 PolarHBondContact O-N 2.81Å; I143-A146 HydrophobicContact CB-CB 3.86Å; I143-A146 HydrophobicContact CG2-CB 4.03Å; I143-A146 PolarHBondContact O-N 2.76Å; I143-R150 HydrophobicContact CD1-CB 3.82Å; I143-R150 HydrophobicContact CG1-CB 3.72Å
144	L	96.5	Very high	96.4	Very high	178 Å²	178	80.2 Å²	80.2	93%	0.932	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	123.8	175.9	-66	173.9	0	0	0	109.5	A146	L144-A146 VanDerWaalsContact C-N 3.34Å
145	G	94.8	Very high	96.5	Very high	86 Å²	86	78.2 Å²	78.2	89%	0.887	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-7.3	-179.5	0	0	0	0	0	115.6	I143	I143-G145 PolarHBondContact O-N 2.81Å
146	A	94	Very high	96.6	Very high	28 Å²	28	77.2 Å²	77.2	23%	0.231	39%	0.386	C	S	.	.			trans	-98	148.7	174.2	0	0	0	0	0	111.5	I143 L144 H148 Q170 D173	I143-A146 HydrophobicContact CB-CB 3.86Å; I143-A146 HydrophobicContact CG2-CB 4.03Å; I143-A146 PolarHBondContact O-N 2.76Å; L144-A146 VanDerWaalsContact C-N 3.34Å; A146-H148 VanDerWaalsContact C-N 3.3Å; A146-Q170 VanDerWaalsContact CB-NE2 3.34Å; A146-D173 WeakPolarHBondContact CA-OD2 3.28Å
147	K	95.1	Very high	96.6	Very high	153 Å²	153	72.7 Å²	72.7	67%	0.665	37%	0.371	S	S	*	.	S	Bend	trans	-76.2	-23	175.5	-58.7	174.6	-172.6	163.3	0	112	D173	K147-D173 VanDerWaalsContact CB-OD1 3.3Å; K147-D173 WeakPolarHBondContact CB-OD1 3.32Å; K147-D173 HydrophobicContact CD-CB 4.13Å; K147-D173 HydrophobicContact CG-CB 4.3Å; K147-D173 PolarHBondContact N-OD1 3.44Å; K147-D173 PolarHBondContact NZ-O 2.68Å
148	H	93.7	Very high	96.5	Very high	51 Å²	51	73.4 Å²	73.4	24%	0.236	37%	0.371	C	S	.	.	S	Bend	trans	-124.7	141.5	-174	-59.1	-57.7	0	0	0	112.8	A146 Q170 R171 D173	A146-H148 VanDerWaalsContact C-N 3.3Å; H148-Q170 PolarHBondContact O-NE2 3.27Å; H148-R171 HydrophobicContact CB-CB 3.87Å; H148-D173 IonicContact CD2-OD1 3.34Å
149	P	96.8	Very high	96.4	Very high	45 Å²	45	74.1 Å²	74.1	29%	0.292	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-69.3	157.4	178.3	30	-35.8	0	0	0	111.7	Q140 D142	Q140-P149 HydrophobicContact CG-CB 3.73Å; Q140-P149 HydrophobicContact CG-CG 4.29Å; D142-P149 WeakPolarHBondContact OD1-CB 3.3Å
150	R	97.2	Very high	96.3	Very high	71 Å²	71	76.8 Å²	76.8	27%	0.268	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.8	170.4	-172.2	173.5	-60.9	164.8	5.6	110.4	Q140 K141 I143 Y152 Q168 Q170	Q140-R150 CarbonylContact C-O 3.52Å; Q140-R150 VanDerWaalsContact CA-O 3.3Å; Q140-R150 WeakPolarHBondContact CA-O 3.13Å; K141-R150 PolarHBondContact N-O 2.83Å; K141-R150 PolarHBondContact O-N 2.89Å; I143-R150 HydrophobicContact CD1-CB 3.82Å; I143-R150 HydrophobicContact CG1-CB 3.72Å; R150-Y152 HydrophobicContact CB-CE2 4.21Å; R150-Y152 HydrophobicContact CG-CE2 4.09Å; R150-Y152 WeakPolarHBondContact O-CD2 3.43Å; R150-Y152 WeakPolarHBondContact O-CE2 3.19Å; R150-Q168 VanDerWaalsContact CD-OE1 3.24Å; R150-Q168 HydrophobicContact CG-CB 4.28Å; R150-Q170 HydrophobicContact CB-CB 4.36Å; R150-Q170 HydrophobicContact CB-CG 4.47Å; R150-Q170 HydrophobicContact CG-CB 4.23Å; R150-Q170 VanDerWaalsContact CZ-OE1 3.31Å
151	A	97.2	Very high	96.2	Very high	11 Å²	11	75.5 Å²	75.5	9%	0.091	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	140	174	0	0	0	0	0	110.9	Y153 Q168 V169	A151-Y153 HydrophobicContact CB-CD2 4.45Å; A151-Y153 HydrophobicContact CB-CE2 3.55Å; A151-Q168 WeakPolarHBondContact O-CA 3.4Å; A151-V169 PolarHBondContact N-O 3.48Å; A151-V169 PolarHBondContact O-N 2.89Å
152	Y	97.8	Very high	96.1	Very high	40 Å²	40	75.8 Å²	75.8	16%	0.157	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.1	-178.3	-61.5	-98.8	0	0	0	111.1	K137 Y138 G139 K141 R150 Q168	K137-Y152 WeakPolarHBondContact CA-O 3.43Å; Y138-Y152 VanDerWaalsContact CD1-O 3.31Å; Y138-Y152 WeakPolarHBondContact CD1-O 3.29Å; Y138-Y152 VanDerWaalsContact CE1-CB 3.48Å; Y138-Y152 PolarHBondContact N-O 3.48Å; G139-Y152 PolarHBondContact N-O 2.86Å; G139-Y152 PolarHBondContact O-N 3.46Å; K141-Y152 HydrophobicContact CB-CE2 3.68Å; R150-Y152 HydrophobicContact CB-CE2 4.21Å; R150-Y152 HydrophobicContact CG-CE2 4.09Å; R150-Y152 WeakPolarHBondContact O-CD2 3.43Å; R150-Y152 WeakPolarHBondContact O-CE2 3.19Å; Y152-Q168 HydrophobicContact CD1-CG 3.86Å; Y152-Q168 HydrophobicContact CE1-CG 3.94Å
153	Y	97.5	Very high	96	Very high	47 Å²	47	69.8 Å²	69.8	18%	0.184	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.5	-175.9	-61.8	-99.7	0	0	0	111.2	W135 R136 K137 A151 T166 K167 V169	W135-Y153 HydrophobicContact CB-CD1 4.08Å; R136-Y153 WeakPolarHBondContact O-CA 3.45Å; K137-Y153 HydrophobicContact CB-CD1 4Å; K137-Y153 HydrophobicContact CB-CE1 3.79Å; K137-Y153 HydrophobicContact CG-CE1 4.31Å; A151-Y153 HydrophobicContact CB-CD2 4.45Å; A151-Y153 HydrophobicContact CB-CE2 3.55Å; Y153-T166 CarbonylContact O-C 3.58Å; Y153-T166 VanDerWaalsContact O-CA 3.29Å; Y153-T166 WeakPolarHBondContact O-CA 3.48Å; Y153-T166 WeakPolarHBondContact O-CB 3.39Å; Y153-K167 HydrophobicContact CD2-CG 4.28Å; Y153-K167 HydrophobicContact CG-CG 4.28Å; Y153-K167 PolarHBondContact N-O 3.37Å; Y153-K167 PolarHBondContact O-N 3.34Å; Y153-V169 HydrophobicContact CD2-CG2 3.94Å; Y153-V169 HydrophobicContact CE2-CB 4.01Å; Y153-V169 HydrophobicContact CE2-CG2 3.75Å
154	R	96.9	Very high	95.9	Very high	91 Å²	91	70.7 Å²	70.7	34%	0.343	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	151	171.2	66.2	-174.5	-174.6	-130.5	-0.3	109.2	R136 Y138 T156 T166	R136-R154 PolarHBondContact N-O 2.99Å; R136-R154 PolarHBondContact O-N 2.98Å; Y138-R154 VanDerWaalsContact CB-NH1 3.27Å; Y138-R154 HydrophobicContact CD1-CB 3.96Å; Y138-R154 HydrophobicContact CD1-CG 4.14Å; Y138-R154 HydrophobicContact CE1-CB 4.36Å; R154-T156 PolarHBondContact O-N 3.42Å; R154-T166 HydrophobicContact CB-CG2 4.3Å
155	C	96.3	Very high	95.9	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	136	172.9	-176.9	0	0	0	0	110.4	H157 R158 C163 A165 C189	C155-H157 PolarHBondContact O-N 3.24Å; C155-H157 PolarHBondContact SG-N 2.91Å; C155-H157 VanDerWaalsContact SG-N 3.44Å; C155-R158 VanDerWaalsContact O-CB 3.29Å; C155-R158 WeakPolarHBondContact O-CB 3.39Å; C155-R158 PolarHBondContact O-N 2.99Å; C155-R158 VanDerWaalsContact O-N 3.11Å; C155-C163 HydrophobicContact CB-CB 4.16Å; C155-C163 VanDerWaalsContact SG-SG 3.69Å; C155-A165 HydrophobicContact CB-CB 4.32Å; C155-A165 PolarHBondContact N-O 2.98Å; C155-C189 PolarHBondContact SG-SG 2.94Å
156	T	96.2	Very high	96	Very high	21 Å²	21	59.5 Å²	59.5	13%	0.129	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.4	176.2	53.3	0	0	0	0	112.9	S134 R136 R154 R158	S134-T156 WeakPolarHBondContact CB-OG1 3.31Å; S134-T156 WeakPolarHBondContact O-CG2 3.44Å; S134-T156 PolarHBondContact O-N 3.39Å; S134-T156 PolarHBondContact O-OG1 2.79Å; S134-T156 VanDerWaalsContact O-OG1 3.12Å; R136-T156 HydrophobicContact CB-CG2 4.12Å; R136-T156 HydrophobicContact CG-CG2 3.48Å; R136-T156 VanDerWaalsContact CG-CG2 3.48Å; R136-T156 PolarHBondContact NH1-O 3.2Å; R136-T156 VanDerWaalsContact NH1-O 3.15Å; R154-T156 PolarHBondContact O-N 3.42Å; T156-R158 VanDerWaalsContact C-N 3.29Å; T156-R158 PolarHBondContact O-N 3.31Å
157	H	95.6	Very high	96.1	Very high	50 Å²	50	58.9 Å²	58.9	23%	0.231	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	13	-179.9	-59	-63	0	0	0	113.7	C155 N159 S160 Q161 N162 C163 C189	C155-H157 PolarHBondContact O-N 3.24Å; C155-H157 PolarHBondContact SG-N 2.91Å; C155-H157 VanDerWaalsContact SG-N 3.44Å; H157-N159 VanDerWaalsContact C-N 3.27Å; H157-N159 PolarHBondContact O-N 3.36Å; H157-S160 WeakPolarHBondContact CA-OG 3.37Å; H157-S160 PolarHBondContact ND1-OG 3.48Å; H157-S160 PolarHBondContact O-N 3.47Å; H157-Q161 HydrophobicContact CB-CB 4.16Å; H157-Q161 HydrophobicContact CB-CG 4.29Å; H157-Q161 PolarHBondContact O-N 3.17Å; H157-N162 PolarHBondContact O-N 3.39Å; H157-C163 HydrophobicContact CB-CB 4.5Å; H157-C163 PolarHBondContact O-N 2.89Å; H157-C189 HydrophobicContact CB-CB 3.77Å
158	R	95.5	Very high	96.1	Very high	125 Å²	125	53.5 Å²	53.5	47%	0.472	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-42.3	177.9	-177.2	174.1	-170.2	-135.2	5.9	113.1	C155 T156 N162 C163	C155-R158 VanDerWaalsContact O-CB 3.29Å; C155-R158 WeakPolarHBondContact O-CB 3.39Å; C155-R158 PolarHBondContact O-N 2.99Å; C155-R158 VanDerWaalsContact O-N 3.11Å; T156-R158 VanDerWaalsContact C-N 3.29Å; T156-R158 PolarHBondContact O-N 3.31Å; R158-N162 CarbonylContact O-C 3.58Å; R158-N162 WeakPolarHBondContact O-CA 3.2Å; R158-N162 PolarHBondContact O-N 2.94Å; R158-C163 WeakPolarHBondContact CA-O 3.32Å; R158-C163 WeakPolarHBondContact CG-O 3.24Å; R158-C163 PolarHBondContact O-N 3.06Å
159	N	95.2	Very high	96.2	Very high	134 Å²	134	51.5 Å²	51.5	72%	0.717	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-30.1	-178.1	-63.2	4.3	0	0	0	112.5	H157	H157-N159 VanDerWaalsContact C-N 3.27Å; H157-N159 PolarHBondContact O-N 3.36Å
160	S	96	Very high	96.2	Very high	81 Å²	81	50.7 Å²	50.7	57%	0.566	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-28.6	-175.5	62	0	0	0	0	114.1	H157	H157-S160 WeakPolarHBondContact CA-OG 3.37Å; H157-S160 PolarHBondContact ND1-OG 3.48Å; H157-S160 PolarHBondContact O-N 3.47Å
161	Q	94.9	Very high	96	Very high	78 Å²	78	50.8 Å²	50.8	36%	0.364	25%	0.25	S	S	.	.	S	Bend	trans	-131.5	16.6	-178.3	-60.9	177.9	28.9	0	0	111.4	H157 C163 T188 C189	H157-Q161 HydrophobicContact CB-CB 4.16Å; H157-Q161 HydrophobicContact CB-CG 4.29Å; H157-Q161 PolarHBondContact O-N 3.17Å; Q161-C163 PolarHBondContact O-N 3.27Å; Q161-C163 VanDerWaalsContact O-N 3.07Å; Q161-T188 PolarHBondContact O-OG1 3.24Å; Q161-C189 HydrophobicContact CB-CB 4.24Å
162	N	95.4	Very high	95.7	Very high	135 Å²	135	50.7 Å²	50.7	72%	0.722	25%	0.248	S	C	*	.			trans	52.6	32.4	179.6	-61.9	85.9	0	0	0	114	H157 R158 P164	H157-N162 PolarHBondContact O-N 3.39Å; R158-N162 CarbonylContact O-C 3.58Å; R158-N162 WeakPolarHBondContact O-CA 3.2Å; R158-N162 PolarHBondContact O-N 2.94Å; N162-P164 WeakPolarHBondContact O-CD 3.37Å
163	C	96.2	Very high	95.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.254	C	S	.	.			trans	-72.9	119.8	-175.7	-176	0	0	0	0	112.3	C155 H157 R158 Q161 A165 T188 C189	C155-C163 HydrophobicContact CB-CB 4.16Å; C155-C163 VanDerWaalsContact SG-SG 3.69Å; H157-C163 HydrophobicContact CB-CB 4.5Å; H157-C163 PolarHBondContact O-N 2.89Å; R158-C163 WeakPolarHBondContact CA-O 3.32Å; R158-C163 WeakPolarHBondContact CG-O 3.24Å; R158-C163 PolarHBondContact O-N 3.06Å; Q161-C163 PolarHBondContact O-N 3.27Å; Q161-C163 VanDerWaalsContact O-N 3.07Å; C163-A165 VanDerWaalsContact C-N 3.34Å; C163-T188 VanDerWaalsContact CA-OG1 3.31Å; C163-T188 WeakPolarHBondContact CA-OG1 3.15Å; C163-C189 HydrophobicContact CB-CB 4.03Å
164	P	96	Very high	95	Very high	59 Å²	59	55.3 Å²	55.3	38%	0.383	28%	0.279	S	S	.	.			trans	-83.8	-6	-176.5	34.2	-35.1	0	0	0	113.9	N162 T166 E186 T188	N162-P164 WeakPolarHBondContact O-CD 3.37Å; P164-T166 PolarHBondContact O-N 3.2Å; P164-E186 WeakPolarHBondContact CD-O 3.49Å; P164-E186 WeakPolarHBondContact CG-O 3.3Å; P164-T188 HydrophobicContact CG-CG2 4.49Å
165	A	96.2	Very high	94.5	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.			trans	-62.7	133.3	-174.3	0	0	0	0	0	113.4	W135 C155 C163 H187	W135-A165 HydrophobicContact CH2-CB 4.19Å; W135-A165 HydrophobicContact CZ3-CB 4.44Å; C155-A165 HydrophobicContact CB-CB 4.32Å; C155-A165 PolarHBondContact N-O 2.98Å; C163-A165 VanDerWaalsContact C-N 3.34Å; A165-H187 VanDerWaalsContact CB-CE1 3.45Å; A165-H187 WeakPolarHBondContact CB-CE1 3.28Å
166	T	96.9	Very high	93.9	Very high	29 Å²	29	59.7 Å²	59.7	18%	0.178	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.7	176.6	56	0	0	0	0	109.8	Y153 R154 P164 H184	Y153-T166 CarbonylContact O-C 3.58Å; Y153-T166 VanDerWaalsContact O-CA 3.29Å; Y153-T166 WeakPolarHBondContact O-CA 3.48Å; Y153-T166 WeakPolarHBondContact O-CB 3.39Å; R154-T166 HydrophobicContact CB-CG2 4.3Å; P164-T166 PolarHBondContact O-N 3.2Å; T166-H184 PolarHBondContact N-O 3.4Å; T166-H184 WeakPolarHBondContact O-CB 3.31Å; T166-H184 PolarHBondContact O-N 3.13Å; T166-H184 WeakPolarHBondContact OG1-CB 3.43Å; T166-H184 PolarHBondContact OG1-O 3.25Å
167	K	95.6	Very high	93.4	Very high	14 Å²	14	61.4 Å²	61.4	6%	0.061	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150	170.1	70.8	178.8	179.5	-172.4	0	112.3	D131 W135 Y153 V169 V181 V182 Y183	D131-K167 IonicContact OD2-NZ 3.35Å; D131-K167 PolarHBondContact OD2-NZ 3.46Å; W135-K167 VanDerWaalsContact CD1-CE 3.48Å; W135-K167 HydrophobicContact CD2-CD 3.74Å; W135-K167 VanDerWaalsContact CD2-CE 3.47Å; W135-K167 HydrophobicContact CD2-CG 3.96Å; W135-K167 HydrophobicContact CE3-CB 4.48Å; W135-K167 HydrophobicContact CE3-CD 4.08Å; W135-K167 HydrophobicContact CE3-CG 3.77Å; W135-K167 HydrophobicContact CG-CD 4.23Å; W135-K167 VanDerWaalsContact CG-CE 3.41Å; W135-K167 HydrophobicContact CH2-CB 4.11Å; W135-K167 HydrophobicContact CH2-CD 4.18Å; W135-K167 HydrophobicContact CH2-CG 4.12Å; W135-K167 HydrophobicContact CZ2-CD 3.85Å; W135-K167 HydrophobicContact CZ2-CG 4.31Å; W135-K167 HydrophobicContact CZ3-CB 4.08Å; W135-K167 HydrophobicContact CZ3-CD 4.29Å; W135-K167 HydrophobicContact CZ3-CG 3.86Å; W135-K167 VanDerWaalsContact NE1-NZ 3.13Å; Y153-K167 HydrophobicContact CD2-CG 4.28Å; Y153-K167 HydrophobicContact CG-CG 4.28Å; Y153-K167 PolarHBondContact N-O 3.37Å; Y153-K167 PolarHBondContact O-N 3.34Å; K167-V169 HydrophobicContact CD-CG2 4.48Å; K167-V181 HydrophobicContact CD-CG1 4.21Å; K167-V182 CarbonylContact C-O 3.54Å; K167-V182 WeakPolarHBondContact CA-O 3.3Å; K167-Y183 HydrophobicContact CB-CD1 3.86Å; K167-Y183 HydrophobicContact CB-CE1 4.13Å; K167-Y183 HydrophobicContact CB-CG 4.42Å; K167-Y183 HydrophobicContact CD-CD1 4.2Å; K167-Y183 HydrophobicContact CD-CE1 3.6Å; K167-Y183 HydrophobicContact CG-CE1 4.5Å
168	Q	96.1	Very high	93	Very high	41 Å²	41	60.6 Å²	60.6	19%	0.192	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.6	171.6	-49.1	-175.1	15.5	0	0	108	R150 A151 Y152 V181 V182 H184	R150-Q168 VanDerWaalsContact CD-OE1 3.24Å; R150-Q168 HydrophobicContact CG-CB 4.28Å; A151-Q168 WeakPolarHBondContact O-CA 3.4Å; Y152-Q168 HydrophobicContact CD1-CG 3.86Å; Y152-Q168 HydrophobicContact CE1-CG 3.94Å; Q168-V181 CarbonylContact O-C 3.57Å; Q168-V181 VanDerWaalsContact O-CA 3.28Å; Q168-V181 WeakPolarHBondContact O-CA 3.32Å; Q168-V182 HydrophobicContact CB-CB 4.31Å; Q168-V182 PolarHBondContact N-O 2.82Å; Q168-V182 PolarHBondContact O-N 2.9Å; Q168-H184 PolarHBondContact NE2-CD2 2.83Å; Q168-H184 PolarHBondContact NE2-NE2 2.82Å
169	V	95.5	Very high	92.8	Very high	9 Å²	9	55.3 Å²	55.3	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.4	178.3	179.4	0	0	0	0	107.8	P128 A151 Y153 K167 F179 V181	P128-V169 HydrophobicContact CG-CB 4.37Å; P128-V169 HydrophobicContact CG-CG1 3.42Å; P128-V169 VanDerWaalsContact CG-CG1 3.42Å; P128-V169 HydrophobicContact CG-CG2 3.99Å; A151-V169 PolarHBondContact N-O 3.48Å; A151-V169 PolarHBondContact O-N 2.89Å; Y153-V169 HydrophobicContact CD2-CG2 3.94Å; Y153-V169 HydrophobicContact CE2-CB 4.01Å; Y153-V169 HydrophobicContact CE2-CG2 3.75Å; K167-V169 HydrophobicContact CD-CG2 4.48Å; V169-F179 HydrophobicContact CG1-CB 4.37Å; V169-F179 HydrophobicContact CG1-CD1 3.83Å; V169-F179 HydrophobicContact CG1-CG 4.48Å; V169-V181 HydrophobicContact CG1-CG2 4.42Å; V169-V181 HydrophobicContact CG2-CG1 4.15Å; V169-V181 HydrophobicContact CG2-CG2 4.31Å
170	Q	95.1	Very high	92.7	Very high	28 Å²	28	50.7 Å²	50.7	13%	0.131	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.7	174.7	-172.5	171	7.4	0	0	109.3	A146 H148 R150 F179 D180	A146-Q170 VanDerWaalsContact CB-NE2 3.34Å; H148-Q170 PolarHBondContact O-NE2 3.27Å; R150-Q170 HydrophobicContact CB-CB 4.36Å; R150-Q170 HydrophobicContact CB-CG 4.47Å; R150-Q170 HydrophobicContact CG-CB 4.23Å; R150-Q170 VanDerWaalsContact CZ-OE1 3.31Å; Q170-F179 CarbonylContact O-C 3.55Å; Q170-F179 WeakPolarHBondContact O-CA 3.37Å; Q170-D180 PolarHBondContact N-O 3.48Å; Q170-D180 PolarHBondContact O-N 3.45Å
171	R	94.4	Very high	92.6	Very high	73 Å²	73	46.9 Å²	46.9	28%	0.275	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	137.6	172.2	-168.3	178.8	-168.9	173.6	8.7	109.2	H148 P176 F179	H148-R171 HydrophobicContact CB-CB 3.87Å; R171-P176 PolarHBondContact NE-O 2.88Å; R171-P176 VanDerWaalsContact NH2-CB 3.26Å; R171-P176 PolarHBondContact NH2-O 3.38Å; R171-F179 HydrophobicContact CB-CD1 3.97Å; R171-F179 HydrophobicContact CB-CE1 3.77Å; R171-F179 HydrophobicContact CB-CZ 4.35Å; R171-F179 HydrophobicContact CG-CD1 4.41Å; R171-F179 HydrophobicContact CG-CE1 4.04Å; R171-F179 HydrophobicContact CG-CZ 4.11Å
172	T	91.3	Very high	92.6	Very high	8 Å²	8	44.4 Å²	44.4	5%	0.049	24%	0.243	C	C	.	.			trans	-72.2	145.1	178.1	65.1	0	0	0	0	110.8	D174 H175 L178	T172-D174 VanDerWaalsContact C-N 3.33Å; T172-H175 PolarHBondContact OG1-N 3.47Å; T172-H175 PolarHBondContact OG1-O 3.27Å; T172-L178 HydrophobicContact CG2-CB 4.07Å; T172-L178 PolarHBondContact N-O 2.92Å; T172-L178 PolarHBondContact OG1-O 3.11Å
173	D	90.4	Very high	92.6	Very high	50 Å²	50	40.3 Å²	40.3	27%	0.267	22%	0.217	S	C	.	.	S	Bend	trans	-76.9	-21.7	-178.3	-67	-30.4	0	0	0	113.4	A146 K147 H148	A146-D173 WeakPolarHBondContact CA-OD2 3.28Å; K147-D173 VanDerWaalsContact CB-OD1 3.3Å; K147-D173 WeakPolarHBondContact CB-OD1 3.32Å; K147-D173 HydrophobicContact CD-CB 4.13Å; K147-D173 HydrophobicContact CG-CB 4.3Å; K147-D173 PolarHBondContact N-OD1 3.44Å; K147-D173 PolarHBondContact NZ-O 2.68Å; H148-D173 IonicContact CD2-OD1 3.34Å
174	D	89.5	Confident	92.5	Very high	134 Å²	134	41.7 Å²	41.7	72%	0.717	22%	0.224	S	C	*	.	S	Bend	trans	-85.6	-37.8	-178.9	-53	-48.6	0	0	0	111.8	T172	T172-D174 VanDerWaalsContact C-N 3.33Å
175	H	85.4	Confident	92.4	Very high	107 Å²	107	40 Å²	40	50%	0.495	22%	0.217	S	C	.	.			trans	-129.6	107	-175	-62.7	-55	0	0	0	111.4	T172 A177 L178	T172-H175 PolarHBondContact OG1-N 3.47Å; T172-H175 PolarHBondContact OG1-O 3.27Å; H175-A177 PolarHBondContact O-N 3.22Å; H175-L178 HydrophobicContact CB-CB 4.05Å; H175-L178 HydrophobicContact CB-CD1 3.63Å; H175-L178 HydrophobicContact CB-CG 3.71Å; H175-L178 PolarHBondContact O-N 3.38Å
176	P	84.3	Confident	92.2	Very high	78 Å²	78	46.8 Å²	46.8	51%	0.506	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.2	-179.5	23.1	-32	0	0	0	112.9	R171 L178	R171-P176 PolarHBondContact NE-O 2.88Å; R171-P176 VanDerWaalsContact NH2-CB 3.26Å; R171-P176 PolarHBondContact NH2-O 3.38Å; P176-L178 VanDerWaalsContact C-N 3.34Å
177	A	85.8	Confident	92.1	Very high	56 Å²	56	47.5 Å²	47.5	46%	0.463	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.5	175.6	0	0	0	0	0	113.5	S118 A119 H175	S118-A177 CarbonylContact C-O 3.58Å; S118-A177 WeakPolarHBondContact CA-O 3.44Å; A119-A177 PolarHBondContact N-O 3.12Å; H175-A177 PolarHBondContact O-N 3.22Å
178	L	88.2	Confident	92	Very high	33 Å²	33	51.3 Å²	51.3	17%	0.173	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	144.2	-171.4	-57.3	-178.9	0	0	0	112.5	R116 S118 T172 H175 P176	R116-L178 HydrophobicContact CG-CB 4.31Å; R116-L178 HydrophobicContact CG-CD1 4.4Å; S118-L178 WeakPolarHBondContact OG-CD2 3.35Å; T172-L178 HydrophobicContact CG2-CB 4.07Å; T172-L178 PolarHBondContact N-O 2.92Å; T172-L178 PolarHBondContact OG1-O 3.11Å; H175-L178 HydrophobicContact CB-CB 4.05Å; H175-L178 HydrophobicContact CB-CD1 3.63Å; H175-L178 HydrophobicContact CB-CG 3.71Å; H175-L178 PolarHBondContact O-N 3.38Å; P176-L178 VanDerWaalsContact C-N 3.34Å
179	F	91.6	Very high	91.9	Very high	15 Å²	15	49.7 Å²	49.7	7%	0.066	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.6	176.8	-66.4	-98.3	0	0	0	109.9	R116 V117 A119 P128 V169 Q170 R171 V181	R116-F179 CarbonylContact C-O 3.47Å; R116-F179 WeakPolarHBondContact CA-O 3.48Å; V117-F179 PolarHBondContact N-O 3.44Å; V117-F179 PolarHBondContact O-N 2.93Å; A119-F179 HydrophobicContact CB-CD2 4.33Å; A119-F179 HydrophobicContact CB-CE2 3.73Å; P128-F179 HydrophobicContact CG-CB 4.13Å; P128-F179 HydrophobicContact CG-CG 4.36Å; V169-F179 HydrophobicContact CG1-CB 4.37Å; V169-F179 HydrophobicContact CG1-CD1 3.83Å; V169-F179 HydrophobicContact CG1-CG 4.48Å; Q170-F179 CarbonylContact O-C 3.55Å; Q170-F179 WeakPolarHBondContact O-CA 3.37Å; R171-F179 HydrophobicContact CB-CD1 3.97Å; R171-F179 HydrophobicContact CB-CE1 3.77Å; R171-F179 HydrophobicContact CB-CZ 4.35Å; R171-F179 HydrophobicContact CG-CD1 4.41Å; R171-F179 HydrophobicContact CG-CE1 4.04Å; R171-F179 HydrophobicContact CG-CZ 4.11Å; F179-V181 HydrophobicContact CB-CG2 4.39Å
180	D	92.1	Very high	91.6	Very high	37 Å²	37	58.6 Å²	58.6	20%	0.198	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119.2	165	-71	-27.5	0	0	0	108.7	R116 Q170	R116-D180 IonicContact CZ-OD1 2.84Å; R116-D180 IonicContact NE-OD1 2.98Å; R116-D180 PolarHBondContact NE-OD1 2.9Å; R116-D180 IonicContact NH2-OD1 2.88Å; R116-D180 PolarHBondContact NH2-OD1 2.69Å; R116-D180 IonicContact NH2-OD2 2.81Å; R116-D180 PolarHBondContact NH2-OD2 2.73Å; Q170-D180 PolarHBondContact N-O 3.48Å; Q170-D180 PolarHBondContact O-N 3.45Å
181	V	94.2	Very high	91	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.2	-179.9	-172.5	0	0	0	0	109.1	Q114 A115 V117 P128 K167 Q168 V169 F179 Y183	Q114-V181 CarbonylContact C-O 3.58Å; Q114-V181 WeakPolarHBondContact CA-O 3.42Å; A115-V181 PolarHBondContact N-O 3.06Å; A115-V181 PolarHBondContact O-N 2.97Å; V117-V181 HydrophobicContact CB-CG2 4.46Å; V117-V181 HydrophobicContact CG2-CG2 3.97Å; P128-V181 HydrophobicContact CB-CG2 3.8Å; P128-V181 HydrophobicContact CG-CG2 3.57Å; K167-V181 HydrophobicContact CD-CG1 4.21Å; Q168-V181 CarbonylContact O-C 3.57Å; Q168-V181 VanDerWaalsContact O-CA 3.28Å; Q168-V181 WeakPolarHBondContact O-CA 3.32Å; V169-V181 HydrophobicContact CG1-CG2 4.42Å; V169-V181 HydrophobicContact CG2-CG1 4.15Å; V169-V181 HydrophobicContact CG2-CG2 4.31Å; F179-V181 HydrophobicContact CB-CG2 4.39Å; V181-Y183 HydrophobicContact CB-CE2 4.13Å; V181-Y183 HydrophobicContact CG1-CD2 3.99Å; V181-Y183 HydrophobicContact CG1-CE1 4.41Å; V181-Y183 HydrophobicContact CG1-CE2 3.39Å
182	V	94.7	Very high	90.1	Very high	27 Å²	27	57.7 Å²	57.7	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114.1	177.4	-173.6	0	0	0	0	109.2	S112 Q113 Q114 K167 Q168 H184	S112-V182 WeakPolarHBondContact OG-CG1 3.44Å; Q113-V182 CarbonylContact O-C 3.48Å; Q113-V182 WeakPolarHBondContact O-CA 3.46Å; Q114-V182 HydrophobicContact CB-CG2 4.49Å; Q114-V182 HydrophobicContact CG-CG2 4.16Å; K167-V182 CarbonylContact C-O 3.54Å; K167-V182 WeakPolarHBondContact CA-O 3.3Å; Q168-V182 HydrophobicContact CB-CB 4.31Å; Q168-V182 PolarHBondContact N-O 2.82Å; Q168-V182 PolarHBondContact O-N 2.9Å; V182-H184 VanDerWaalsContact CG1-CE1 3.44Å; V182-H184 WeakPolarHBondContact CG1-CE1 3.29Å
183	Y	95.5	Very high	88.9	Confident	48 Å²	48	60.9 Å²	60.9	19%	0.188	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	143.5	175.2	-65.4	-90.6	0	0	0	110.8	S112 Q113 D131 W135 K167 V181	S112-Y183 WeakPolarHBondContact CA-O 3.37Å; Q113-Y183 PolarHBondContact N-O 2.99Å; Q113-Y183 PolarHBondContact O-N 2.84Å; D131-Y183 VanDerWaalsContact OD2-CE1 3.24Å; D131-Y183 WeakPolarHBondContact OD2-CE1 3.35Å; D131-Y183 PolarHBondContact OD2-OH 2.72Å; W135-Y183 HydrophobicContact CH2-CD1 4.11Å; W135-Y183 HydrophobicContact CH2-CE1 4.31Å; W135-Y183 HydrophobicContact CZ2-CD1 4Å; W135-Y183 AromaticContact CZ2-CE1 3.76Å; W135-Y183 HydrophobicContact CZ2-CE1 3.76Å; K167-Y183 HydrophobicContact CB-CD1 3.86Å; K167-Y183 HydrophobicContact CB-CE1 4.13Å; K167-Y183 HydrophobicContact CB-CG 4.42Å; K167-Y183 HydrophobicContact CD-CD1 4.2Å; K167-Y183 HydrophobicContact CD-CE1 3.6Å; K167-Y183 HydrophobicContact CG-CE1 4.5Å; V181-Y183 HydrophobicContact CB-CE2 4.13Å; V181-Y183 HydrophobicContact CG1-CD2 3.99Å; V181-Y183 HydrophobicContact CG1-CE1 4.41Å; V181-Y183 HydrophobicContact CG1-CE2 3.39Å
184	H	94.6	Very high	87.3	Confident	29 Å²	29	61.7 Å²	61.7	13%	0.134	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	118.3	-167.1	-81.2	-39.1	0	0	0	109.7	W110 S112 T166 Q168 V182	W110-H184 AromaticContact CD1-ND1 3.6Å; W110-H184 HydrophobicContact CZ2-CB 3.55Å; W110-H184 VanDerWaalsContact NE1-CB 3.26Å; W110-H184 AromaticContact NE1-CE1 3.93Å; W110-H184 AromaticContact NE1-CG 3.3Å; W110-H184 VanDerWaalsContact NE1-CG 3.3Å; W110-H184 AromaticContact NE1-ND1 3.02Å; W110-H184 PolarHBondContact NE1-ND1 3.02Å; S112-H184 PolarHBondContact OG-CE1 2.93Å; S112-H184 PolarHBondContact OG-ND1 2.81Å; S112-H184 VanDerWaalsContact OG-ND1 3.13Å; T166-H184 PolarHBondContact N-O 3.4Å; T166-H184 WeakPolarHBondContact O-CB 3.31Å; T166-H184 PolarHBondContact O-N 3.13Å; T166-H184 WeakPolarHBondContact OG1-CB 3.43Å; T166-H184 PolarHBondContact OG1-O 3.25Å; Q168-H184 PolarHBondContact NE2-CD2 2.83Å; Q168-H184 PolarHBondContact NE2-NE2 2.82Å; V182-H184 VanDerWaalsContact CG1-CE1 3.44Å; V182-H184 WeakPolarHBondContact CG1-CE1 3.29Å
185	G	92.4	Very high	85.5	Confident	23 Å²	23	59.2 Å²	59.2	24%	0.237	35%	0.348	C	S	.	.	S	Bend	trans	75.4	161.2	-173.5	0	0	0	0	0	112.5
186	E	93.1	Very high	84	Confident	144 Å²	144	58 Å²	58	67%	0.673	36%	0.357	S	S	*	.			trans	-97.9	150	-177.5	-66.7	178.6	-179.2	0	0	111.6	P164 T188	P164-E186 WeakPolarHBondContact CD-O 3.49Å; P164-E186 WeakPolarHBondContact CG-O 3.3Å; E186-T188 PolarHBondContact O-N 3.2Å
187	H	94.7	Very high	82.1	Confident	44 Å²	44	58 Å²	58	20%	0.204	37%	0.37	C	S	.	.			trans	-75.1	118.7	173.3	-75.4	-86.6	0	0	0	110.5	Y133 W135 A165 C189	Y133-H187 HydrophobicContact CD1-CB 4.11Å; Y133-H187 AromaticContact CD1-CD2 3.88Å; Y133-H187 AromaticContact CD1-CE1 3.55Å; Y133-H187 AromaticContact CD1-CG 3.52Å; Y133-H187 AromaticContact CD1-ND1 3.3Å; Y133-H187 VanDerWaalsContact CD1-ND1 3.3Å; Y133-H187 WeakPolarHBondContact CD1-ND1 3.39Å; Y133-H187 AromaticContact CD1-NE2 3.92Å; Y133-H187 AromaticContact CD2-CD2 3.7Å; Y133-H187 AromaticContact CD2-NE2 3.63Å; Y133-H187 HydrophobicContact CE1-CB 3.46Å; Y133-H187 VanDerWaalsContact CE1-CB 3.46Å; Y133-H187 AromaticContact CE1-CD2 3.82Å; Y133-H187 AromaticContact CE1-CG 3.36Å; Y133-H187 AromaticContact CE1-ND1 3.63Å; Y133-H187 AromaticContact CE2-CD2 3.64Å; Y133-H187 AromaticContact CG-CD2 3.81Å; Y133-H187 AromaticContact CG-CE1 3.44Å; Y133-H187 VanDerWaalsContact CG-CE1 3.44Å; Y133-H187 AromaticContact CG-CG 3.93Å; Y133-H187 AromaticContact CG-ND1 3.7Å; Y133-H187 AromaticContact CG-NE2 3.52Å; Y133-H187 AromaticContact CZ-CD2 3.69Å; Y133-H187 AromaticContact CZ-CG 3.63Å; W135-H187 AromaticContact CH2-CE1 3.53Å; W135-H187 AromaticContact CH2-NE2 3.2Å; W135-H187 WeakPolarHBondContact CH2-NE2 3.39Å; W135-H187 AromaticContact CZ2-CE1 3.56Å; W135-H187 AromaticContact CZ2-NE2 3.15Å; W135-H187 WeakPolarHBondContact CZ2-NE2 3.36Å; A165-H187 VanDerWaalsContact CB-CE1 3.45Å; A165-H187 WeakPolarHBondContact CB-CE1 3.28Å; H187-C189 PolarHBondContact ND1-SG 3.27Å; H187-C189 VanDerWaalsContact ND1-SG 3.44Å
188	T	94	Very high	79.8	Confident	93 Å²	93	58.4 Å²	58.4	57%	0.571	38%	0.38	S	S	*	.			trans	-92.2	-7.2	166.7	61.2	0	0	0	0	112.2	Q161 C163 P164 E186	Q161-T188 PolarHBondContact O-OG1 3.24Å; C163-T188 VanDerWaalsContact CA-OG1 3.31Å; C163-T188 WeakPolarHBondContact CA-OG1 3.15Å; P164-T188 HydrophobicContact CG-CG2 4.49Å; E186-T188 PolarHBondContact O-N 3.2Å
189	C	93.1	Very high	77.1	Confident	8 Å²	8	60 Å²	60	5%	0.054	40%	0.404	C	S	.	.	S	Bend	trans	-89.4	157	179.6	62.6	0	0	0	0	112.4	C155 H157 Q161 C163 H187	C155-C189 PolarHBondContact SG-SG 2.94Å; H157-C189 HydrophobicContact CB-CB 3.77Å; Q161-C189 HydrophobicContact CB-CB 4.24Å; C163-C189 HydrophobicContact CB-CB 4.03Å; H187-C189 PolarHBondContact ND1-SG 3.27Å; H187-C189 VanDerWaalsContact ND1-SG 3.44Å
190	R	88.9	Confident	74.5	Confident	196 Å²	196	65.4 Å²	65.4	74%	0.74	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-66.7	137.4	170.6	-66.4	-174	177	174	-0.6	110.6
191	P	83.9	Confident	72.1	Confident	47 Å²	47	72.9 Å²	72.9	31%	0.305	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-55.3	147.3	171.6	-23.2	32.3	0	0	0	111.2	Y133 A193 A194 A195	Y133-P191 HydrophobicContact CD1-CB 4.46Å; Y133-P191 HydrophobicContact CE1-CB 4.13Å; Y133-P191 HydrophobicContact CE1-CG 3.89Å; P191-A193 PolarHBondContact O-N 3.36Å; P191-A194 WeakPolarHBondContact O-CB 3.17Å; P191-A194 PolarHBondContact O-N 3.5Å; P191-A195 PolarHBondContact O-N 3.39Å
192	A	74.4	Confident	69.5	Low	35 Å²	35	84.3 Å²	84.3	29%	0.289	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-35.2	-178.5	0	0	0	0	0	111.5	G132 S134 A194 A195 A196	G132-A192 WeakPolarHBondContact O-CB 3.34Å; G132-A192 PolarHBondContact O-N 3.49Å; S134-A192 WeakPolarHBondContact OG-CB 3.48Å; A192-A194 VanDerWaalsContact C-N 3.3Å; A192-A194 PolarHBondContact O-N 3.48Å; A192-A195 PolarHBondContact O-N 3.47Å; A192-A196 PolarHBondContact O-N 3.08Å
193	A	66.5	Low	66.8	Low	75 Å²	75	87.5 Å²	87.5	62%	0.62	55%	0.547	S	S	*	.	H	α-helix	trans	-63.7	-32.3	176.1	0	0	0	0	0	113.1	P191 A195 A196	P191-A193 PolarHBondContact O-N 3.36Å; A193-A195 VanDerWaalsContact C-N 3.32Å; A193-A195 PolarHBondContact O-N 3.42Å; A193-A196 PolarHBondContact O-N 2.95Å
194	A	56.5	Low	64.2	Low	67 Å²	67	89.5 Å²	89.5	55%	0.554	57%	0.574	S	S	*	*	H	α-helix	trans	-73.8	-25	178.4	0	0	0	0	0	112.5	P191 A192 A196	P191-A194 WeakPolarHBondContact O-CB 3.17Å; P191-A194 PolarHBondContact O-N 3.5Å; A192-A194 VanDerWaalsContact C-N 3.3Å; A192-A194 PolarHBondContact O-N 3.48Å; A194-A196 VanDerWaalsContact C-N 3.32Å
195	A	52.7	Low	61.7	Low	82 Å²	82	96.9 Å²	96.9	68%	0.678	61%	0.608	S	S	*	*	H	α-helix	trans	-78	-17.8	174.7	0	0	0	0	0	113	P191 A192 A193 G197	P191-A195 PolarHBondContact O-N 3.39Å; A192-A195 PolarHBondContact O-N 3.47Å; A193-A195 VanDerWaalsContact C-N 3.32Å; A193-A195 PolarHBondContact O-N 3.42Å; A195-G197 VanDerWaalsContact C-N 3.31Å
196	A	53.9	Low	59.4	Low	82 Å²	82	104.7 Å²	104.7	68%	0.678	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-9.3	177	0	0	0	0	0	113.7	A192 A193 A194 G198	A192-A196 PolarHBondContact O-N 3.08Å; A193-A196 PolarHBondContact O-N 2.95Å; A194-A196 VanDerWaalsContact C-N 3.32Å; A196-G198 VanDerWaalsContact C-N 3.29Å; A196-G198 PolarHBondContact O-N 3.14Å
197	G	44.3	Very low	57	Low	76 Å²	76	103.1 Å²	103.1	78%	0.784	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	7	-178	0	0	0	0	0	116.3	A195	A195-G197 VanDerWaalsContact C-N 3.31Å
198	G	37	Very low	55.3	Low	66 Å²	66	105.7 Å²	105.7	68%	0.68	65%	0.646	S	S	*	*	S	Bend	trans	-135.9	84.9	-177.7	0	0	0	0	0	112.1	A196	A196-G198 VanDerWaalsContact C-N 3.29Å; A196-G198 PolarHBondContact O-N 3.14Å
199	G	31.2	Very low	54	Low	65 Å²	65	105.8 Å²	105.8	67%	0.67	65%	0.648	S	S	*	*			trans	87.6	107.2	168.3	0	0	0	0	0	114.4	K201	G199-K201 PolarHBondContact O-N 2.93Å
200	S	37.9	Very low	52.8	Low	129 Å²	129	112.2 Å²	112.2	90%	0.902	68%	0.677	S	S	*	*			trans	-53.4	80	157	-69.6	0	0	0	0	111
201	K	41.7	Very low	51.6	Low	194 Å²	194	105.1 Å²	105.1	84%	0.843	66%	0.661	S	S	*	*			trans	-105.8	89.9	150.1	-64.2	-145.7	-178.8	-169.6	0	105.6	G199 A203	G199-K201 PolarHBondContact O-N 2.93Å; K201-A203 PolarHBondContact O-N 3.35Å
202	R	39	Very low	50.9	Low	241 Å²	241	107.1 Å²	107.1	91%	0.909	67%	0.666	S	S	*	*			trans	-43.8	97.3	160.8	-73.2	178.6	169.2	-145.3	-2.2	106.7	A204	R202-A204 PolarHBondContact O-N 3.44Å
203	A	38.5	Very low	50.8	Low	94 Å²	94	108.1 Å²	108.1	78%	0.777	68%	0.675	S	S	*	*			trans	-61.2	111.5	164.4	0	0	0	0	0	104.1	K201 Q205	K201-A203 PolarHBondContact O-N 3.35Å; A203-Q205 VanDerWaalsContact C-N 3.34Å; A203-Q205 PolarHBondContact O-N 2.9Å
204	A	40.1	Very low	51.1	Low	90 Å²	90	107.4 Å²	107.4	74%	0.744	67%	0.668	S	S	*	*			trans	-50.6	97.3	-176.8	0	0	0	0	0	109.6	R202 Q206	R202-A204 PolarHBondContact O-N 3.44Å; A204-Q206 VanDerWaalsContact C-N 3.34Å; A204-Q206 PolarHBondContact O-N 3.25Å
205	Q	43	Very low	51.9	Low	183 Å²	183	109.9 Å²	109.9	86%	0.855	67%	0.672	S	S	*	*			trans	-60.5	108.2	156	-170.9	160.2	2	0	0	104	A203 H207	A203-Q205 VanDerWaalsContact C-N 3.34Å; A203-Q205 PolarHBondContact O-N 2.9Å; Q205-H207 PolarHBondContact O-N 3.43Å
206	Q	42.8	Very low	52.7	Low	188 Å²	188	111.7 Å²	111.7	88%	0.879	67%	0.666	S	S	*	*			trans	-47.5	105.9	-176.4	-70.7	-177.6	-1.7	0	0	108.4	A204 N208	A204-Q206 VanDerWaalsContact C-N 3.34Å; A204-Q206 PolarHBondContact O-N 3.25Å; Q206-N208 PolarHBondContact O-N 3.21Å; Q206-N208 VanDerWaalsContact O-N 3.1Å
207	H	43.3	Very low	53.6	Low	111 Å²	111	109.6 Å²	109.6	51%	0.514	65%	0.652	S	S	.	*			trans	-70.7	105.8	-177.1	-179	65.6	0	0	0	106.6	Q205 P209 Q212	Q205-H207 PolarHBondContact O-N 3.43Å; H207-P209 WeakPolarHBondContact O-CD 3.19Å; H207-Q212 VanDerWaalsContact CE1-CB 3.49Å; H207-Q212 WeakPolarHBondContact CE1-CB 3.39Å; H207-Q212 PolarHBondContact CE1-OE1 3.36Å; H207-Q212 WeakPolarHBondContact NE2-CB 3.33Å; H207-Q212 PolarHBondContact NE2-OE1 3.15Å
208	N	58.6	Low	54.8	Low	97 Å²	97	111 Å²	111	52%	0.519	64%	0.641	S	S	.	*			trans	-71.1	106.2	175.7	-175.4	-9.9	0	0	0	108	Q206 H210 A211 Q212	Q206-N208 PolarHBondContact O-N 3.21Å; Q206-N208 VanDerWaalsContact O-N 3.1Å; N208-H210 PolarHBondContact O-N 3.17Å; N208-H210 VanDerWaalsContact O-N 3.1Å; N208-H210 WeakPolarHBondContact OD1-CB 3.45Å; N208-H210 PolarHBondContact OD1-N 2.85Å; N208-A211 HydrophobicContact CB-CB 4.16Å; N208-A211 PolarHBondContact O-N 2.99Å; N208-Q212 PolarHBondContact O-N 2.88Å
209	P	65.8	Low	56.1	Low	96 Å²	96	110.6 Å²	110.6	62%	0.623	63%	0.631	S	S	*	*	H	α-helix	trans	-62.6	-23.3	-174.8	27.5	-34.7	0	0	0	111.8	H207 A213	H207-P209 WeakPolarHBondContact O-CD 3.19Å; P209-A213 WeakPolarHBondContact O-CB 3.45Å; P209-A213 PolarHBondContact O-N 2.88Å; P209-A213 VanDerWaalsContact O-N 3.1Å
210	H	68.6	Low	57.6	Low	142 Å²	142	111.1 Å²	111.1	66%	0.657	63%	0.629	S	S	*	*	H	α-helix	trans	-71.7	-32.7	176.5	-163.5	-61.9	0	0	0	112.6	N208 A214	N208-H210 PolarHBondContact O-N 3.17Å; N208-H210 VanDerWaalsContact O-N 3.1Å; N208-H210 WeakPolarHBondContact OD1-CB 3.45Å; N208-H210 PolarHBondContact OD1-N 2.85Å; H210-A214 WeakPolarHBondContact O-CB 3.33Å; H210-A214 PolarHBondContact O-N 3.48Å; H210-A214 VanDerWaalsContact O-N 3.08Å
211	A	64.7	Low	58.6	Low	48 Å²	48	115.6 Å²	115.6	40%	0.397	63%	0.626	S	S	.	*	H	α-helix	trans	-73.1	-36.8	177.4	0	0	0	0	0	111.5	N208 A214 L215	N208-A211 HydrophobicContact CB-CB 4.16Å; N208-A211 PolarHBondContact O-N 2.99Å; A211-A214 PolarHBondContact O-N 3.39Å; A211-L215 WeakPolarHBondContact O-CG 3.44Å; A211-L215 PolarHBondContact O-N 2.77Å; A211-L215 VanDerWaalsContact O-N 3.08Å
212	Q	68.6	Low	58.8	Low	88 Å²	88	112.4 Å²	112.4	41%	0.411	62%	0.618	S	S	.	*	H	α-helix	trans	-71.6	-38.2	176.8	-149.1	-178.1	-94.3	0	0	112	H207 N208 L215 Q216	H207-Q212 VanDerWaalsContact CE1-CB 3.49Å; H207-Q212 WeakPolarHBondContact CE1-CB 3.39Å; H207-Q212 PolarHBondContact CE1-OE1 3.36Å; H207-Q212 WeakPolarHBondContact NE2-CB 3.33Å; H207-Q212 PolarHBondContact NE2-OE1 3.15Å; N208-Q212 PolarHBondContact O-N 2.88Å; Q212-L215 PolarHBondContact O-N 3.29Å; Q212-Q216 WeakPolarHBondContact O-CB 3.01Å; Q212-Q216 VanDerWaalsContact O-CG 3.28Å; Q212-Q216 WeakPolarHBondContact O-CG 3.47Å; Q212-Q216 PolarHBondContact O-N 3.23Å
213	A	72.5	Confident	59	Low	57 Å²	57	106.2 Å²	106.2	47%	0.471	61%	0.607	S	S	.	*	H	α-helix	trans	-63.8	-39.7	173.3	0	0	0	0	0	112.2	P209 Q216 G217	P209-A213 WeakPolarHBondContact O-CB 3.45Å; P209-A213 PolarHBondContact O-N 2.88Å; P209-A213 VanDerWaalsContact O-N 3.1Å; A213-Q216 PolarHBondContact O-N 2.86Å; A213-G217 PolarHBondContact O-N 3.39Å
214	A	73.4	Confident	59.2	Low	59 Å²	59	107.6 Å²	107.6	49%	0.488	61%	0.606	S	S	.	*	H	α-helix	trans	-65.4	-40.7	175.9	0	0	0	0	0	112.6	H210 A211 G217 L218	H210-A214 WeakPolarHBondContact O-CB 3.33Å; H210-A214 PolarHBondContact O-N 3.48Å; H210-A214 VanDerWaalsContact O-N 3.08Å; A211-A214 PolarHBondContact O-N 3.39Å; A214-G217 PolarHBondContact O-N 3.04Å; A214-L218 WeakPolarHBondContact O-CB 3.43Å; A214-L218 PolarHBondContact O-N 3.49Å
215	L	71.4	Confident	59.6	Low	120 Å²	120	107.7 Å²	107.7	63%	0.628	61%	0.606	S	S	*	*	H	α-helix	trans	-67.4	-40.3	175.5	-76.8	166.8	0	0	0	112.5	A211 Q212 L218 A219	A211-L215 WeakPolarHBondContact O-CG 3.44Å; A211-L215 PolarHBondContact O-N 2.77Å; A211-L215 VanDerWaalsContact O-N 3.08Å; Q212-L215 PolarHBondContact O-N 3.29Å; L215-L218 PolarHBondContact O-N 3.23Å; L215-A219 WeakPolarHBondContact O-CB 3.27Å; L215-A219 PolarHBondContact O-N 3.48Å
216	Q	70.2	Confident	59.5	Low	120 Å²	120	104.9 Å²	104.9	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-65.4	-38.8	174.9	-73.5	174.8	-6.8	0	0	111.8	Q212 A213 A219 A220	Q212-Q216 WeakPolarHBondContact O-CB 3.01Å; Q212-Q216 VanDerWaalsContact O-CG 3.28Å; Q212-Q216 WeakPolarHBondContact O-CG 3.47Å; Q212-Q216 PolarHBondContact O-N 3.23Å; A213-Q216 PolarHBondContact O-N 2.86Å; Q216-A219 PolarHBondContact O-N 2.84Å; Q216-A220 WeakPolarHBondContact O-CB 3.38Å; Q216-A220 PolarHBondContact O-N 3.34Å
217	G	74	Confident	59.7	Low	37 Å²	37	100.3 Å²	100.3	38%	0.381	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-36.8	173.1	0	0	0	0	0	113.2	A213 A214 R221	A213-G217 PolarHBondContact O-N 3.39Å; A214-G217 PolarHBondContact O-N 3.04Å; G217-R221 VanDerWaalsContact O-CG 3.28Å; G217-R221 WeakPolarHBondContact O-CG 3.5Å; G217-R221 PolarHBondContact O-N 3.27Å
218	L	67.9	Low	59.6	Low	106 Å²	106	101.7 Å²	101.7	56%	0.555	61%	0.613	S	S	*	*	H	α-helix	trans	-68.5	-43.7	175.3	-154	88.1	0	0	0	111.4	A214 L215 A220 R221 L222	A214-L218 WeakPolarHBondContact O-CB 3.43Å; A214-L218 PolarHBondContact O-N 3.49Å; L215-L218 PolarHBondContact O-N 3.23Å; L218-A220 PolarHBondContact O-N 3.45Å; L218-R221 PolarHBondContact O-N 3.49Å; L218-R221 VanDerWaalsContact O-N 3.15Å; L218-L222 HydrophobicContact CD2-CD1 4.11Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 WeakPolarHBondContact O-CD1 3.49Å; L218-L222 PolarHBondContact O-N 2.58Å
219	A	64.3	Low	58.8	Low	57 Å²	57	104.7 Å²	104.7	47%	0.471	63%	0.629	S	S	.	*	H	α-helix	trans	-62.7	-40.6	177.7	0	0	0	0	0	112.2	L215 Q216 R221 L222 T223	L215-A219 WeakPolarHBondContact O-CB 3.27Å; L215-A219 PolarHBondContact O-N 3.48Å; Q216-A219 PolarHBondContact O-N 2.84Å; A219-R221 PolarHBondContact O-N 3.23Å; A219-L222 PolarHBondContact O-N 3.35Å; A219-T223 PolarHBondContact O-OG1 3.47Å
220	A	63.2	Low	57.7	Low	76 Å²	76	104.4 Å²	104.4	63%	0.628	63%	0.634	S	S	*	*	H	α-helix	trans	-65.9	-24.5	175.6	0	0	0	0	0	113.5	Q216 L218	Q216-A220 WeakPolarHBondContact O-CB 3.38Å; Q216-A220 PolarHBondContact O-N 3.34Å; L218-A220 PolarHBondContact O-N 3.45Å
221	R	59.3	Low	56.3	Low	223 Å²	223	102.7 Å²	102.7	84%	0.842	64%	0.644	S	S	*	*	H	α-helix	trans	-89.8	-10.7	178.3	-68.4	-178.7	75.6	-172.6	3.3	114.1	G217 L218 A219	G217-R221 VanDerWaalsContact O-CG 3.28Å; G217-R221 WeakPolarHBondContact O-CG 3.5Å; G217-R221 PolarHBondContact O-N 3.27Å; L218-R221 PolarHBondContact O-N 3.49Å; L218-R221 VanDerWaalsContact O-N 3.15Å; A219-R221 PolarHBondContact O-N 3.23Å
222	L	45.7	Very low	55.2	Low	128 Å²	128	105.3 Å²	105.3	67%	0.67	67%	0.666	S	S	*	*	H	α-helix	trans	-101.9	-5.1	-179.7	-81.9	156.1	0	0	0	113.5	L218 A219 V224	L218-L222 HydrophobicContact CD2-CD1 4.11Å; L218-L222 HydrophobicContact CG-CD1 4.06Å; L218-L222 WeakPolarHBondContact O-CD1 3.49Å; L218-L222 PolarHBondContact O-N 2.58Å; A219-L222 PolarHBondContact O-N 3.35Å; L222-V224 PolarHBondContact O-N 2.85Å; L222-V224 VanDerWaalsContact O-N 3.08Å
223	T	43	Very low	54	Low	111 Å²	111	109 Å²	109	68%	0.681	69%	0.688	S	S	*	*			trans	-79	92.5	176.5	-47.8	0	0	0	0	110.3	A219 A225	A219-T223 PolarHBondContact O-OG1 3.47Å; T223-A225 PolarHBondContact O-N 3.36Å
224	V	43.7	Very low	53.3	Low	123 Å²	123	111.4 Å²	111.4	75%	0.745	70%	0.699	S	S	*	*			trans	-72.4	114.4	166.6	176.8	0	0	0	0	108.2	L222 T226	L222-V224 PolarHBondContact O-N 2.85Å; L222-V224 VanDerWaalsContact O-N 3.08Å; V224-T226 PolarHBondContact O-N 3.06Å; V224-T226 VanDerWaalsContact O-N 3.13Å
225	A	48.3	Very low	52.2	Low	91 Å²	91	113.6 Å²	113.6	75%	0.752	71%	0.708	S	S	*	*			trans	-71.5	101.2	174.7	0	0	0	0	0	109.9	T223 A227	T223-A225 PolarHBondContact O-N 3.36Å; A225-A227 VanDerWaalsContact C-N 3.28Å; A225-A227 PolarHBondContact O-N 3.08Å; A225-A227 VanDerWaalsContact O-N 3.11Å
226	T	41	Very low	50.8	Low	125 Å²	125	116 Å²	116	77%	0.767	72%	0.718	S	S	*	*			trans	-80.7	79.4	166.3	53.9	0	0	0	0	108.7	V224 T228	V224-T226 PolarHBondContact O-N 3.06Å; V224-T226 VanDerWaalsContact O-N 3.13Å; T226-T228 PolarHBondContact O-N 3.32Å
227	A	47	Very low	50	Low	91 Å²	91	117.1 Å²	117.1	75%	0.752	73%	0.733	S	S	*	*			trans	-79.9	99.3	164	0	0	0	0	0	107.9	A225 D229	A225-A227 VanDerWaalsContact C-N 3.28Å; A225-A227 PolarHBondContact O-N 3.08Å; A225-A227 VanDerWaalsContact O-N 3.11Å; A227-D229 PolarHBondContact O-N 3.45Å; A227-D229 VanDerWaalsContact O-N 3.14Å
228	T	39.9	Very low	48.9	Very low	141 Å²	141	121 Å²	121	87%	0.865	75%	0.752	S	S	*	*			trans	-67.6	97.3	162	40.8	0	0	0	0	107.9	T226	T226-T228 PolarHBondContact O-N 3.32Å
229	D	42.8	Very low	47.8	Very low	160 Å²	160	125.2 Å²	125.2	86%	0.856	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-88.2	123.8	169.3	-152.5	-4	0	0	0	109.3	A227	A227-D229 PolarHBondContact O-N 3.45Å; A227-D229 VanDerWaalsContact O-N 3.14Å
230	A	41.8	Very low	47.1	Very low	89 Å²	89	127.6 Å²	127.6	74%	0.736	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-83.2	134.8	-175.8	0	0	0	0	0	109.7	A232	A230-A232 PolarHBondContact O-N 2.66Å
231	A	38.6	Very low	46.1	Very low	106 Å²	106	129.8 Å²	129.8	88%	0.876	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-48.3	126.3	180	0	0	0	0	0	115
232	A	42	Very low	45.8	Very low	103 Å²	103	124.6 Å²	124.6	85%	0.851	79%	0.786	S	S	*	*			trans	-161.2	110.7	145.6	0	0	0	0	0	110.9	A230	A230-A232 PolarHBondContact O-N 2.66Å
233	L	43.3	Very low	46	Very low	166 Å²	166	123.7 Å²	123.7	87%	0.869	79%	0.786	S	S	*	*			trans	-80.1	-178.4	167.4	-75.3	174	0	0	0	111
234	P	58.9	Low	46.3	Very low	107 Å²	107	129.5 Å²	129.5	70%	0.695	80%	0.795	S	S	*	*			cis	-136	-145	-36.9	36.5	-14	0	0	0	110
235	P	50.2	Low	46.2	Very low	106 Å²	106	126.9 Å²	126.9	69%	0.688	79%	0.793	S	S	*	*			cis	-134.9	163.4	-22.5	27	-3.5	0	0	0	117.2
236	M	42.2	Very low	46.1	Very low	170 Å²	170	127.3 Å²	127.3	84%	0.837	80%	0.797	S	S	*	*			trans	46.8	125.1	137.6	-52.2	-84	97.1	0	0	123.1
237	T	53	Low	46.5	Very low	144 Å²	144	126.4 Å²	126.4	88%	0.883	80%	0.795	S	S	*	*				-171.5	152.2	112.5	45	0	0	0	0	112.8
238	P	50.3	Low	46.3	Very low	119 Å²	119	127.9 Å²	127.9	77%	0.773	80%	0.8	S	S	*	*			trans	-127.6	129.6	-177.5	37.1	-19.2	0	0	0	115.4
239	E	45.8	Very low	47	Very low	194 Å²	194	126.4 Å²	126.4	91%	0.907	79%	0.793	S	S	*	*			trans	-159.2	146	165.6	-65.3	-171.8	88.5	0	0	107.2
240	S	49.4	Very low	47.2	Very low	107 Å²	107	130 Å²	130	75%	0.748	80%	0.795	S	S	*	*			cis	-174.7	137.9	-8.6	38.4	0	0	0	0	105.3
241	C	41.1	Very low	47.4	Very low	122 Å²	122	130.4 Å²	130.4	82%	0.824	79%	0.792	S	S	*	*			trans	-82.3	-168.6	170.5	-52.6	0	0	0	0	109.7
242	P	54.8	Low	47.7	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	79%	0.793	S	S	*	*			cis	-147.4	-171.8	1.9	32.1	-5.8	0	0	0	116.6
243	V	49.9	Very low	47.8	Very low	109 Å²	109	133.2 Å²	133.2	66%	0.661	79%	0.791	S	S	*	*				111.6	129.6	126.1	103	0	0	0	0	121.8
244	R	48.6	Very low	47.6	Very low	233 Å²	233	130.7 Å²	130.7	88%	0.879	79%	0.787	S	S	*	*			trans	62	138.9	151.9	-83.8	158.8	-140.9	-97.4	0.9	119.3
245	G	41.8	Very low	46.8	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	79%	0.788	S	S	*	*			cis	179.3	172.9	6.1	0	0	0	0	0	112.2
246	A	45.2	Very low	46.9	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	80%	0.797	S	S	*	*			trans	36.7	137.1	147.2	0	0	0	0	0	119
247	S	49.2	Very low	47	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	79%	0.794	S	S	*	*			cis	176.6	134.6	22.8	25	0	0	0	0	108.9
248	S	44	Very low	46.6	Very low	122 Å²	122	126.7 Å²	126.7	85%	0.853	79%	0.786	S	S	*	*			trans	55.7	156	133.2	-71.4	0	0	0	0	125.1
249	P	54	Low	46.3	Very low	111 Å²	111	128 Å²	128	72%	0.721	79%	0.787	S	S	*	*			trans	-124.5	165.3	-142.3	42.5	-28.5	0	0	0	115.2
250	W	47.7	Very low	46	Very low	236 Å²	236	123.5 Å²	123.5	89%	0.894	78%	0.776	S	S	*	*			trans	-176.6	135.2	151.1	47.5	-52.8	0	0	0	112.4
251	S	46.1	Very low	45.8	Very low	97 Å²	97	127 Å²	127	68%	0.678	79%	0.787	S	S	*	*			trans	54.1	137.6	130.2	-62.5	0	0	0	0	119.5
252	L	44.8	Very low	45.6	Very low	169 Å²	169	124.8 Å²	124.8	89%	0.885	79%	0.785	S	S	*	*			cis	-171.2	166.8	13.4	-98.2	157.4	0	0	0	107
253	A	42.8	Very low	44.9	Very low	98 Å²	98	125.4 Å²	125.4	81%	0.81	79%	0.79	S	S	*	*			trans	114.9	110.8	147.8	0	0	0	0	0	118.5
254	S	39.2	Very low	44.7	Very low	114 Å²	114	127.4 Å²	127.4	80%	0.797	79%	0.794	S	S	*	*			trans	-41.1	154.4	168.9	-50.3	0	0	0	0	118.7
255	S	43.4	Very low	44	Very low	102 Å²	102	124.4 Å²	124.4	71%	0.713	79%	0.79	S	S	*	*				179	129.6	99.9	-74	0	0	0	0	113.2
256	V	52.6	Low	43.8	Very low	145 Å²	145	129.8 Å²	129.8	88%	0.879	80%	0.797	S	S	*	*			trans	54.8	135.8	143	-47.8	0	0	0	0	119
257	A	43	Very low	43.2	Very low	92 Å²	92	132.8 Å²	132.8	76%	0.76	80%	0.799	S	S	*	*			cis	-159.2	159.3	23.8	0	0	0	0	0	112
258	S	45.5	Very low	42.8	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	80%	0.799	S	S	*	*			trans	-1.6	140.7	155.9	-45.7	0	0	0	0	119.2
259	D	42.6	Very low	42.8	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	80%	0.795	S	S	*	*			cis	-154.9	138.2	47.1	-99.2	-45	0	0	0	113.6
260	S	41	Very low	42.4	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	79%	0.792	S	S	*	*			trans	41.3	100	149.1	56.3	0	0	0	0	121
261	N	44.1	Very low	42	Very low	180 Å²	180	126.3 Å²	126.3	96%	0.963	78%	0.784	S	S	*	*			trans	-166.4	123.3	143.7	-89.2	-30.8	0	0	0	110.1
262	G	37.4	Very low	41.8	Very low	77 Å²	77	127.4 Å²	127.4	79%	0.794	79%	0.788	S	S	*	*			trans	122.4	97	159.6	0	0	0	0	0	117.3
263	C	39.4	Very low	41.8	Very low	125 Å²	125	125.7 Å²	125.7	85%	0.845	78%	0.784	S	S	*	*			trans	-125.6	97.4	149.6	-169.6	0	0	0	0	105
264	M	45.7	Very low	41.6	Very low	151 Å²	151	127 Å²	127	74%	0.744	79%	0.785	S	S	*	*				57.4	105.7	104.6	-64.3	-64.2	102	0	0	114.4
265	H	33.9	Very low	41.6	Very low	171 Å²	171	125.1 Å²	125.1	79%	0.792	78%	0.784	S	S	*	*			trans	29	111	138.7	-98	-116.7	0	0	0	117.2
266	Q	38.9	Very low	41.2	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	79%	0.786	S	S	*	*			trans	-166.2	128	131.7	-102.3	151.3	94.8	0	0	110.3	V268	Q266-V268 PolarHBondContact O-N 3.31Å
267	D	32.2	Very low	40.9	Very low	162 Å²	162	133.2 Å²	133.2	87%	0.866	78%	0.784	S	S	*	*			trans	-35.8	120.2	164	-82.2	-82.4	0	0	0	112.9
268	V	41.6	Very low	40.7	Very low	121 Å²	121	135.1 Å²	135.1	73%	0.733	78%	0.777	S	S	*	*			trans	-137.9	94.4	160.6	-171.1	0	0	0	0	108.2	Q266 P270	Q266-V268 PolarHBondContact O-N 3.31Å; V268-P270 HydrophobicContact CG1-CG 4.37Å; V268-P270 WeakPolarHBondContact O-CD 3.34Å
269	S	43.6	Very low	40.6	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	78%	0.782	S	S	*	*			trans	-64.9	135.5	153	174.4	0	0	0	0	109
270	P	44.2	Very low	40.4	Very low	103 Å²	103	138.6 Å²	138.6	67%	0.669	78%	0.775	S	S	*	*			trans	-133.9	108.4	145.7	13.6	9.3	0	0	0	112.7	V268	V268-P270 HydrophobicContact CG1-CG 4.37Å; V268-P270 WeakPolarHBondContact O-CD 3.34Å
271	C	40.9	Very low	40.9	Very low	106 Å²	106	138.8 Å²	138.8	72%	0.716	78%	0.776	S	S	*	*			trans	71.3	122.4	133.1	-54.3	0	0	0	0	119.9
272	P	41.9	Very low	41.5	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-72.9	132.8	167.1	31.3	-29.5	0	0	0	109.5	P274	P272-P274 WeakPolarHBondContact O-CD 3.43Å
273	V	44.7	Very low	42.8	Very low	132 Å²	132	135.1 Å²	135.1	80%	0.8	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-71.8	118.9	171.6	-165.4	0	0	0	0	107.9	G275	V273-G275 PolarHBondContact O-N 3.32Å
274	P	37.7	Very low	43.8	Very low	127 Å²	127	132.5 Å²	132.5	83%	0.825	73%	0.726	S	S	*	*	S	Bend	trans	-76.8	120.9	173.4	2.4	14.4	0	0	0	108	P272	P272-P274 WeakPolarHBondContact O-CD 3.43Å
275	G	39.6	Very low	44.4	Very low	74 Å²	74	130.1 Å²	130.1	76%	0.763	72%	0.716	S	S	*	*			trans	164.7	-11.7	173	0	0	0	0	0	117.4	V273 R277	V273-G275 PolarHBondContact O-N 3.32Å; G275-R277 PolarHBondContact O-N 3.11Å
276	Y	35.5	Very low	45.7	Very low	196 Å²	196	128.7 Å²	128.7	77%	0.769	71%	0.71	S	S	*	*			trans	-85.6	101.6	169.3	95.1	-81.3	0	0	0	108.4	E278	Y276-E278 HydrophobicContact CD2-CB 4.27Å; Y276-E278 HydrophobicContact CE2-CB 4.14Å
277	R	45.4	Very low	47	Very low	220 Å²	220	126.7 Å²	126.7	83%	0.83	70%	0.7	S	S	*	*			trans	-88	101.5	153.5	-94.6	-167.5	174.6	177	-0.6	106.1	G275 W279	G275-R277 PolarHBondContact O-N 3.11Å; R277-W279 PolarHBondContact O-N 3.23Å
278	E	38.2	Very low	48.7	Very low	133 Å²	133	123.6 Å²	123.6	62%	0.621	69%	0.688	S	S	*	*			trans	-52.9	116.6	157	-163.8	85	165.7	0	0	107	Y276 T280	Y276-E278 HydrophobicContact CD2-CB 4.27Å; Y276-E278 HydrophobicContact CE2-CB 4.14Å; E278-T280 VanDerWaalsContact C-N 3.33Å; E278-T280 HydrophobicContact CB-CG2 4.39Å; E278-T280 HydrophobicContact CG-CG2 3.95Å; E278-T280 PolarHBondContact O-N 2.81Å; E278-T280 PolarHBondContact O-OG1 2.88Å; E278-T280 VanDerWaalsContact O-OG1 3.11Å
279	W	44.2	Very low	50	Low	219 Å²	219	119.2 Å²	119.2	83%	0.83	66%	0.661	S	S	*	*			trans	-60.9	96.5	178.3	-70.1	82.4	0	0	0	108.8	R277 D284	R277-W279 PolarHBondContact O-N 3.23Å; W279-D284 HydrophobicContact CE3-CB 4.45Å; W279-D284 HydrophobicContact CZ3-CB 4.08Å
280	T	37.8	Very low	51.3	Low	104 Å²	104	117.1 Å²	117.1	64%	0.638	65%	0.646	S	S	*	*			trans	-137.8	92.2	-179.9	49.3	0	0	0	0	106.6	E278	E278-T280 VanDerWaalsContact C-N 3.33Å; E278-T280 HydrophobicContact CB-CG2 4.39Å; E278-T280 HydrophobicContact CG-CG2 3.95Å; E278-T280 PolarHBondContact O-N 2.81Å; E278-T280 PolarHBondContact O-OG1 2.88Å; E278-T280 VanDerWaalsContact O-OG1 3.11Å
281	S	52.3	Low	52.5	Low	102 Å²	102	116 Å²	116	71%	0.713	64%	0.641	S	S	*	*			trans	156.5	130.7	151.2	-72	0	0	0	0	110.2	G283 D284	S281-G283 PolarHBondContact O-N 2.72Å; S281-D284 PolarHBondContact O-N 3.03Å
282	D	55.7	Low	53.6	Low	137 Å²	137	113.1 Å²	113.1	73%	0.733	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.7	-14.7	175.1	-86.6	-90.1	0	0	0	116.3
283	G	64.6	Low	54.6	Low	43 Å²	43	112.4 Å²	112.4	44%	0.443	61%	0.609	S	S	.	*	H	α-helix	trans	-65.3	-36.6	-178.3	0	0	0	0	0	115.1	S281 L285 Q286 E287	S281-G283 PolarHBondContact O-N 2.72Å; G283-L285 VanDerWaalsContact C-N 3.31Å; G283-L285 PolarHBondContact O-N 2.78Å; G283-Q286 PolarHBondContact O-N 3Å; G283-E287 PolarHBondContact O-N 2.77Å
284	D	60.4	Low	55.8	Low	70 Å²	70	108.9 Å²	108.9	37%	0.374	59%	0.594	S	S	.	*	H	α-helix	trans	-70.1	-28.3	-176.4	-77.9	-28.3	0	0	0	112.3	W279 S281 E287 V288	W279-D284 HydrophobicContact CE3-CB 4.45Å; W279-D284 HydrophobicContact CZ3-CB 4.08Å; S281-D284 PolarHBondContact O-N 3.03Å; D284-E287 PolarHBondContact O-N 3.1Å; D284-V288 WeakPolarHBondContact O-CG2 3.34Å; D284-V288 PolarHBondContact O-N 3.08Å
285	L	59.4	Low	56.9	Low	102 Å²	102	106.1 Å²	106.1	53%	0.534	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-38.1	174.8	-88.3	166.9	0	0	0	111.7	G283 E287 V288 V289	G283-L285 VanDerWaalsContact C-N 3.31Å; G283-L285 PolarHBondContact O-N 2.78Å; L285-E287 VanDerWaalsContact C-N 3.31Å; L285-E287 PolarHBondContact O-N 2.8Å; L285-V288 PolarHBondContact O-N 3.43Å; L285-V289 WeakPolarHBondContact O-CB 3.12Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.99Å
286	Q	61.9	Low	57.9	Low	140 Å²	140	104.7 Å²	104.7	65%	0.654	56%	0.558	S	S	*	*	H	α-helix	trans	-65.1	-36.6	178.5	-169	-179.5	5.4	0	0	111.5	G283 S290	G283-Q286 PolarHBondContact O-N 3Å; Q286-S290 VanDerWaalsContact O-CB 3.27Å; Q286-S290 WeakPolarHBondContact O-CB 3.44Å; Q286-S290 PolarHBondContact O-N 3.1Å; Q286-S290 PolarHBondContact O-OG 2.97Å
287	E	66	Low	59	Low	139 Å²	139	98.3 Å²	98.3	65%	0.65	54%	0.542	S	S	*	.	H	α-helix	trans	-67.6	-44.5	177.4	-164.4	-176.9	154.6	0	0	111.7	G283 D284 L285 V289 S290 S291	G283-E287 PolarHBondContact O-N 2.77Å; D284-E287 PolarHBondContact O-N 3.1Å; L285-E287 VanDerWaalsContact C-N 3.31Å; L285-E287 PolarHBondContact O-N 2.8Å; E287-V289 PolarHBondContact O-N 3.2Å; E287-S290 PolarHBondContact O-N 3.08Å; E287-S291 WeakPolarHBondContact O-CB 3.36Å; E287-S291 PolarHBondContact O-N 2.7Å
288	V	67.6	Low	59.6	Low	98 Å²	98	92.5 Å²	92.5	59%	0.594	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-42.4	176.9	176.2	0	0	0	0	111.3	D284 L285 S291 A292	D284-V288 WeakPolarHBondContact O-CG2 3.34Å; D284-V288 PolarHBondContact O-N 3.08Å; L285-V288 PolarHBondContact O-N 3.43Å; V288-S291 PolarHBondContact O-N 3.35Å; V288-A292 WeakPolarHBondContact O-CB 3.49Å; V288-A292 PolarHBondContact O-N 3.48Å
289	V	67.6	Low	60.1	Low	29 Å²	29	91.3 Å²	91.3	18%	0.176	54%	0.537	C	S	.	.	H	α-helix	trans	-65.4	-40.9	176.3	172.8	0	0	0	0	111	E29 L32 L285 E287 A292 F293	E29-V289 HydrophobicContact CG-CG1 4.21Å; L32-V289 HydrophobicContact CD1-CG2 3.59Å; L285-V289 WeakPolarHBondContact O-CB 3.12Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.99Å; E287-V289 PolarHBondContact O-N 3.2Å; V289-A292 PolarHBondContact O-N 3.1Å; V289-F293 WeakPolarHBondContact O-CB 3.5Å; V289-F293 PolarHBondContact O-N 3.32Å
290	S	71.2	Confident	60.2	Low	66 Å²	66	84.4 Å²	84.4	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-39	176.5	-59	0	0	0	0	112	Q286 E287 F293 A294	Q286-S290 VanDerWaalsContact O-CB 3.27Å; Q286-S290 WeakPolarHBondContact O-CB 3.44Å; Q286-S290 PolarHBondContact O-N 3.1Å; Q286-S290 PolarHBondContact O-OG 2.97Å; E287-S290 PolarHBondContact O-N 3.08Å; S290-F293 PolarHBondContact O-N 3.4Å; S290-A294 WeakPolarHBondContact O-CB 3.42Å; S290-A294 PolarHBondContact O-N 2.91Å
291	S	69.4	Low	60.6	Low	79 Å²	79	85.3 Å²	85.3	55%	0.552	53%	0.534	S	S	*	.	H	α-helix	trans	-66.8	-42	175.6	-173.7	0	0	0	0	111.9	E287 V288 F293 A294 A295	E287-S291 WeakPolarHBondContact O-CB 3.36Å; E287-S291 PolarHBondContact O-N 2.7Å; V288-S291 PolarHBondContact O-N 3.35Å; S291-F293 VanDerWaalsContact C-N 3.35Å; S291-F293 PolarHBondContact O-N 2.95Å; S291-A294 PolarHBondContact O-N 3.45Å; S291-A295 PolarHBondContact O-N 2.95Å
292	A	64.4	Low	60.2	Low	45 Å²	45	87.9 Å²	87.9	37%	0.372	54%	0.539	S	S	.	.	H	α-helix	trans	-62.1	-41.6	173	0	0	0	0	0	111.8	V288 V289 A295 V296	V288-A292 WeakPolarHBondContact O-CB 3.49Å; V288-A292 PolarHBondContact O-N 3.48Å; V289-A292 PolarHBondContact O-N 3.1Å; A292-A295 PolarHBondContact O-N 3.29Å; A292-V296 VanDerWaalsContact O-CG2 3.32Å; A292-V296 WeakPolarHBondContact O-CG2 3.5Å; A292-V296 PolarHBondContact O-N 3.48Å
293	F	63.9	Low	59.8	Low	106 Å²	106	86.4 Å²	86.4	47%	0.465	54%	0.537	S	S	.	.	H	α-helix	trans	-64.3	-41.5	176.1	-175.5	-92.7	0	0	0	112.4	E29 V289 S290 S291 A295 V296 S297	E29-F293 WeakPolarHBondContact OE1-CD2 3.28Å; V289-F293 WeakPolarHBondContact O-CB 3.5Å; V289-F293 PolarHBondContact O-N 3.32Å; S290-F293 PolarHBondContact O-N 3.4Å; S291-F293 VanDerWaalsContact C-N 3.35Å; S291-F293 PolarHBondContact O-N 2.95Å; F293-A295 VanDerWaalsContact C-N 3.33Å; F293-A295 PolarHBondContact O-N 3.22Å; F293-V296 PolarHBondContact O-N 3.33Å; F293-S297 VanDerWaalsContact CE1-OG 3.27Å; F293-S297 WeakPolarHBondContact CE1-OG 3.43Å; F293-S297 WeakPolarHBondContact CZ-OG 3.28Å; F293-S297 WeakPolarHBondContact O-CB 3.43Å; F293-S297 PolarHBondContact O-N 3.02Å; F293-S297 PolarHBondContact O-OG 3.44Å
294	A	69.1	Low	58.9	Low	58 Å²	58	90.3 Å²	90.3	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-62.7	-40.8	175.2	0	0	0	0	0	111.7	S290 S291 S298	S290-A294 WeakPolarHBondContact O-CB 3.42Å; S290-A294 PolarHBondContact O-N 2.91Å; S291-A294 PolarHBondContact O-N 3.45Å; A294-S298 VanDerWaalsContact O-CB 3.24Å; A294-S298 WeakPolarHBondContact O-CB 3.45Å; A294-S298 PolarHBondContact O-N 3.16Å
295	A	60.7	Low	58.2	Low	68 Å²	68	94.7 Å²	94.7	56%	0.562	57%	0.574	S	S	*	*	H	α-helix	trans	-65.7	-39.2	177.2	0	0	0	0	0	112.7	S291 A292 F293	S291-A295 PolarHBondContact O-N 2.95Å; A292-A295 PolarHBondContact O-N 3.29Å; F293-A295 VanDerWaalsContact C-N 3.33Å; F293-A295 PolarHBondContact O-N 3.22Å
296	V	60.2	Low	57.5	Low	44 Å²	44	96.8 Å²	96.8	27%	0.267	59%	0.586	S	S	.	*	H	α-helix	trans	-78.3	-36	179.9	177.2	0	0	0	0	111.8	Q22 A292 F293 V299	Q22-V296 HydrophobicContact CG-CG1 3.77Å; A292-V296 VanDerWaalsContact O-CG2 3.32Å; A292-V296 WeakPolarHBondContact O-CG2 3.5Å; A292-V296 PolarHBondContact O-N 3.48Å; F293-V296 PolarHBondContact O-N 3.33Å; V296-V299 PolarHBondContact O-N 3.48Å
297	S	59.5	Low	56.7	Low	63 Å²	63	98.2 Å²	98.2	44%	0.441	60%	0.598	S	S	.	*	H	α-helix	trans	-79	-19.8	178.9	-57.8	0	0	0	0	113.3	F293 V299	F293-S297 VanDerWaalsContact CE1-OG 3.27Å; F293-S297 WeakPolarHBondContact CE1-OG 3.43Å; F293-S297 WeakPolarHBondContact CZ-OG 3.28Å; F293-S297 WeakPolarHBondContact O-CB 3.43Å; F293-S297 PolarHBondContact O-N 3.02Å; F293-S297 PolarHBondContact O-OG 3.44Å; S297-V299 PolarHBondContact O-N 3.32Å
298	S	57.5	Low	56.1	Low	98 Å²	98	100.2 Å²	100.2	69%	0.685	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-9.5	170.3	-179.7	0	0	0	0	113	A294 A300	A294-S298 VanDerWaalsContact O-CB 3.24Å; A294-S298 WeakPolarHBondContact O-CB 3.45Å; A294-S298 PolarHBondContact O-N 3.16Å; S298-A300 PolarHBondContact O-N 2.94Å
299	V	49.3	Very low	55	Low	108 Å²	108	104.2 Å²	104.2	66%	0.655	62%	0.618	S	S	*	*	S	Bend	trans	-78.3	81.8	166.3	-172.4	0	0	0	0	107.2	V296 S297	V296-V299 PolarHBondContact O-N 3.48Å; S297-V299 PolarHBondContact O-N 3.32Å
300	A	46.8	Very low	54.3	Low	73 Å²	73	111.1 Å²	111.1	60%	0.603	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-50.6	132.1	173.8	0	0	0	0	0	109.4	S298 L302	S298-A300 PolarHBondContact O-N 2.94Å; A300-L302 PolarHBondContact O-N 3.15Å
301	P	45.6	Very low	52.9	Low	124 Å²	124	112.4 Å²	112.4	81%	0.805	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-58.6	116.7	173.5	-18.4	29.9	0	0	0	108.3
302	L	42.7	Very low	51.5	Low	155 Å²	155	116.4 Å²	116.4	81%	0.812	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-59.8	130.9	167.3	-71.7	172.4	0	0	0	107.4	A300 V304	A300-L302 PolarHBondContact O-N 3.15Å; L302-V304 PolarHBondContact O-N 3.36Å; L302-V304 VanDerWaalsContact O-N 3.12Å
303	P	49	Very low	50.5	Low	106 Å²	106	123.1 Å²	123.1	69%	0.688	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-60	121.2	175.6	24.4	-31.7	0	0	0	108.7	L305	P303-L305 PolarHBondContact O-N 3.08Å; P303-L305 VanDerWaalsContact O-N 3.17Å
304	V	44.4	Very low	49.8	Very low	126 Å²	126	123.1 Å²	123.1	76%	0.764	71%	0.707	S	S	*	*			trans	-63.2	110.7	162.9	175.6	0	0	0	0	105.2	L302 D306	L302-V304 PolarHBondContact O-N 3.36Å; L302-V304 VanDerWaalsContact O-N 3.12Å; V304-D306 PolarHBondContact O-N 3.13Å
305	L	46.4	Very low	48.7	Very low	161 Å²	161	129.9 Å²	129.9	84%	0.843	73%	0.725	S	S	*	*			trans	-77.8	111.6	171	-70.9	174.5	0	0	0	107.6	P303	P303-L305 PolarHBondContact O-N 3.08Å; P303-L305 VanDerWaalsContact O-N 3.17Å
306	D	43.9	Very low	48.1	Very low	147 Å²	147	130.5 Å²	130.5	79%	0.786	74%	0.739	S	S	*	*			trans	-60.6	137.9	171.6	-71.8	-69.9	0	0	0	111.7	V304 E308	V304-D306 PolarHBondContact O-N 3.13Å; D306-E308 PolarHBondContact O-N 3.11Å
307	D	46.5	Very low	47.5	Very low	169 Å²	169	136.9 Å²	136.9	90%	0.904	76%	0.763	S	S	*	*			trans	-88.7	78.8	170	-158.3	-75	0	0	0	107.8
308	E	51.8	Low	47.1	Very low	181 Å²	181	140.5 Å²	140.5	85%	0.846	78%	0.778	S	S	*	*			trans	-147.8	99.4	162	-83.1	-148.8	105.8	0	0	111.5	D306 M310	D306-E308 PolarHBondContact O-N 3.11Å; E308-M310 PolarHBondContact O-N 3.31Å
309	F	44.9	Very low	46.9	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.803	78%	0.781	S	S	*	*			trans	10.5	101.5	140.5	-161.6	-95.5	0	0	0	118
310	M	53.6	Low	47.3	Very low	173 Å²	173	143.8 Å²	143.8	85%	0.852	78%	0.783	S	S	*	*			trans	-144.9	123.9	152.9	-96.5	-68.4	126.6	0	0	109.5	E308	E308-M310 PolarHBondContact O-N 3.31Å
311	P	42.1	Very low	47.3	Very low	93 Å²	93	149 Å²	149	60%	0.604	79%	0.792	S	S	*	*			trans	-87.8	143.4	-174.7	33.3	-31.5	0	0	0	113.5
312	L	39.7	Very low	47.7	Very low	164 Å²	164	150 Å²	150	86%	0.859	79%	0.79	S	S	*	*			trans	25.1	113.5	145.6	-78.2	155.3	0	0	0	118.4
313	E	44.2	Very low	48.2	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	79%	0.787	S	S	*	*				158.7	148.5	124.9	-84.5	-179.6	165.6	0	0	109.5
314	C	48.2	Very low	48.2	Very low	106 Å²	106	151.3 Å²	151.3	72%	0.716	79%	0.791	S	S	*	*			trans	77.8	111.2	-171.4	-123.6	0	0	0	0	112.3
315	F	46.1	Very low	48.7	Very low	199 Å²	199	151.7 Å²	151.7	87%	0.873	79%	0.794	S	S	*	*				-149.5	138.5	57.7	-63.3	-84.2	0	0	0	110.9
316	G	48.9	Very low	48.9	Very low	82 Å²	82	148.3 Å²	148.3	85%	0.845	79%	0.789	S	S	*	*			trans	-71.5	145.2	-179.7	0	0	0	0	0	113.5
317	F	46.3	Very low	49.3	Very low	178 Å²	178	150.1 Å²	150.1	78%	0.781	80%	0.795	S	S	*	*			trans	-79	126.5	172	-135.6	-96.9	0	0	0	109	H319	F317-H319 AromaticContact CD1-CD2 3.97Å; F317-H319 AromaticContact CD1-NE2 3.79Å
318	D	52.3	Low	50.2	Low	139 Å²	139	147.1 Å²	147.1	74%	0.743	79%	0.785	S	S	*	*			trans	-84.2	111.6	165.6	-152.3	-49.7	0	0	0	108.3	T320	D318-T320 PolarHBondContact O-N 3.14Å
319	H	51.5	Low	50.4	Low	161 Å²	161	143.7 Å²	143.7	75%	0.745	78%	0.781	S	S	*	*			trans	-93.1	72.1	178.8	-88.6	-84.5	0	0	0	110	F317	F317-H319 AromaticContact CD1-CD2 3.97Å; F317-H319 AromaticContact CD1-NE2 3.79Å
320	T	58.1	Low	51.1	Low	113 Å²	113	143.2 Å²	143.2	69%	0.693	79%	0.786	S	S	*	*			trans	-151.4	79.7	166.9	-37.1	0	0	0	0	111.1	D318	D318-T320 PolarHBondContact O-N 3.14Å
321	F	48.4	Very low	51.6	Low	184 Å²	184	144 Å²	144	81%	0.807	78%	0.781	S	S	*	*			trans	-134.9	102.5	158.6	-129.7	-81.9	0	0	0	109.4	I323	F321-I323 HydrophobicContact CD1-CD1 3.68Å; F321-I323 HydrophobicContact CD1-CG1 3.87Å; F321-I323 HydrophobicContact CE1-CD1 3.61Å; F321-I323 HydrophobicContact CE1-CG1 3.96Å
322	D	52.3	Low	52.3	Low	143 Å²	143	150.2 Å²	150.2	77%	0.765	79%	0.793	S	S	*	*			trans	-87.6	109.6	170.6	-145.3	-60.1	0	0	0	106.7
323	I	54.1	Low	53.9	Low	146 Å²	146	149.9 Å²	149.9	75%	0.749	80%	0.801	S	S	*	*			trans	-120.3	71.8	167.4	-88	168.8	0	0	0	106.3	F321	F321-I323 HydrophobicContact CD1-CD1 3.68Å; F321-I323 HydrophobicContact CD1-CG1 3.87Å; F321-I323 HydrophobicContact CE1-CD1 3.61Å; F321-I323 HydrophobicContact CE1-CG1 3.96Å
324	D	49.1	Very low	54.4	Low	143 Å²	143	148.1 Å²	148.1	77%	0.765	80%	0.798	S	S	*	*			trans	-124.3	70.8	160.6	-140.5	-33.1	0	0	0	107.5
325	T	54.8	Low	54.7	Low	134 Å²	134	150.3 Å²	150.3	82%	0.822	80%	0.802	S	S	*	*			trans	-155.7	125.2	169.8	-61.3	0	0	0	0	109.4
326	A	49.8	Very low	55.2	Low	90 Å²	90	147.6 Å²	147.6	74%	0.744	80%	0.798	S	S	*	*			trans	82	73	168.1	0	0	0	0	0	118
327	M	51.8	Low	55.6	Low	185 Å²	185	151.5 Å²	151.5	91%	0.911	80%	0.796	S	S	*	*			trans	-97.7	115.3	143	-100.3	-78	173	0	0	109
328	P	65.7	Low	56.1	Low	107 Å²	107	149.8 Å²	149.8	70%	0.695	80%	0.797	S	S	*	*			trans	-88.6	116.9	162.8	0.5	18.6	0	0	0	109.5	L330	P328-L330 PolarHBondContact O-N 3.46Å
329	S	57.1	Low	56.4	Low	108 Å²	108	150.5 Å²	150.5	76%	0.755	80%	0.8	S	S	*	*			trans	-56.7	125.4	165.3	176.3	0	0	0	0	110.7
330	L	59.4	Low	56.7	Low	173 Å²	173	149.8 Å²	149.8	91%	0.906	80%	0.804	S	S	*	*			trans	-108.8	99.6	162.1	-72.2	-179.4	0	0	0	108.7	P328	P328-L330 PolarHBondContact O-N 3.46Å
331	Y	63.2	Low	56.6	Low	191 Å²	191	152.6 Å²	152.6	75%	0.749	81%	0.813	S	S	*	*			trans	-91.4	127.6	164.1	-168.7	-96	0	0	0	107.7
332	Y	57.7	Low	57.3	Low	222 Å²	222	150 Å²	150	87%	0.871	81%	0.813	S	S	*	*			trans	-131.7	150	160.6	-122.6	-104.8	0	0	0	106.9
333	P	72.8	Confident	57.8	Low	158 Å²	158	150.6 Å²	150.6	100%	1.026	82%	0.817	S	S	*	*			trans	-69.2	0	-136.6	30.1	-37.3	0	0	0	116.8

Retrieved 333 of 333 residues in 135.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).