A0A5K4FBR0_SCHMA Loading...

DUF5730 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBR0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 389 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	29	Very low	240 Å²	240	133 Å²	133	100%	1.182	77%	0.77	S	S	*	*				0	77	0	-80.8	177.3	168.2	0	0	104.9
2	D	30.1	Very low	29	Very low	144 Å²	144	133.1 Å²	133.1	77%	0.77	76%	0.763	S	S	*	*			trans	-102.9	117.1	-172.1	-66.5	-25.9	0	0	0	108.1
3	N	31.1	Very low	29	Very low	168 Å²	168	131.9 Å²	131.9	90%	0.898	75%	0.753	S	S	*	*			trans	-148.5	70.7	143	-110.8	1.2	0	0	0	107
4	S	31.6	Very low	29	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	76%	0.76	S	S	*	*			trans	-76.2	108.7	153.3	52.4	0	0	0	0	107.9
5	G	28.5	Very low	29.1	Very low	54 Å²	54	136.9 Å²	136.9	56%	0.557	76%	0.758	S	S	*	*			trans	156.9	105.7	177.9	0	0	0	0	0	106.5
6	D	29.8	Very low	29.1	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	74%	0.744	S	S	*	*			cis	-145.8	113.7	34.9	-65.5	-46.1	0	0	0	110.1	I8	D6-I8 HydrophobicContact CB-CD1 4.49Å; D6-I8 HydrophobicContact CB-CG1 3.79Å; D6-I8 PolarHBondContact O-N 2.86Å
7	T	26.1	Very low	29.6	Very low	132 Å²	132	131.8 Å²	131.8	81%	0.81	75%	0.748	S	S	*	*			trans	-64.2	82.5	145	20.1	0	0	0	0	107	T9	T7-T9 PolarHBondContact O-N 3.18Å
8	I	27.4	Very low	29.7	Very low	139 Å²	139	134.4 Å²	134.4	71%	0.713	75%	0.75	S	S	*	*			trans	-70.8	80.3	155.2	-54.3	-179.2	0	0	0	104.6	D6 S10	D6-I8 HydrophobicContact CB-CD1 4.49Å; D6-I8 HydrophobicContact CB-CG1 3.79Å; D6-I8 PolarHBondContact O-N 2.86Å; I8-S10 PolarHBondContact O-N 2.78Å
9	T	26.6	Very low	30.3	Very low	106 Å²	106	133.9 Å²	133.9	65%	0.65	74%	0.742	S	S	*	*			trans	-54.5	93.8	151.6	29.3	0	0	0	0	105.2	T7 N11	T7-T9 PolarHBondContact O-N 3.18Å; T9-N11 PolarHBondContact O-N 3.19Å
10	S	28.4	Very low	31.2	Very low	83 Å²	83	129.8 Å²	129.8	58%	0.58	72%	0.721	S	S	*	*			trans	-63.9	75.6	162.7	61.3	0	0	0	0	106.6	I8 I12	I8-S10 PolarHBondContact O-N 2.78Å; S10-I12 PolarHBondContact O-N 3.07Å
11	N	24.4	Very low	32	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	71%	0.712	S	S	*	*			trans	-64.5	63.1	146.3	-74.5	-13.1	0	0	0	105.7	T9 N13	T9-N11 PolarHBondContact O-N 3.19Å; N11-N13 PolarHBondContact O-N 2.79Å
12	I	29.3	Very low	32.8	Very low	134 Å²	134	123.3 Å²	123.3	69%	0.687	68%	0.68	S	S	*	*			trans	-62.8	90.4	148	-65	164.7	0	0	0	100.5	S10 E14	S10-I12 PolarHBondContact O-N 3.07Å; I12-E14 PolarHBondContact O-N 2.98Å
13	N	29.2	Very low	34.1	Very low	118 Å²	118	118.5 Å²	118.5	63%	0.631	65%	0.652	S	S	*	*			trans	-42.6	96.5	149.2	-94.8	-22.9	0	0	0	104.2	N11 Q15	N11-N13 PolarHBondContact O-N 2.79Å; N13-Q15 HydrophobicContact CB-CB 4.41Å; N13-Q15 HydrophobicContact CB-CG 4.14Å; N13-Q15 PolarHBondContact O-N 3.32Å
14	E	29	Very low	35.8	Very low	183 Å²	183	113.9 Å²	113.9	86%	0.855	63%	0.628	S	S	*	*			trans	-56.5	60	137.9	-69.4	-176.5	151.6	0	0	106.5	I12 G16	I12-E14 PolarHBondContact O-N 2.98Å; E14-G16 PolarHBondContact O-N 3.2Å
15	Q	30.3	Very low	37.9	Very low	156 Å²	156	115 Å²	115	73%	0.729	62%	0.616	S	S	*	*			trans	-60.2	82.7	138.3	-85.6	177.2	-19.7	0	0	102.4	N13 V17	N13-Q15 HydrophobicContact CB-CB 4.41Å; N13-Q15 HydrophobicContact CB-CG 4.14Å; N13-Q15 PolarHBondContact O-N 3.32Å; Q15-V17 PolarHBondContact O-N 3.22Å
16	G	29.6	Very low	40.2	Very low	52 Å²	52	113.6 Å²	113.6	54%	0.536	60%	0.595	S	S	.	*			trans	-39.3	116.7	172.5	0	0	0	0	0	104.1	E14 K18	E14-G16 PolarHBondContact O-N 3.2Å; G16-K18 WeakPolarHBondContact O-CA 2.87Å; G16-K18 PolarHBondContact O-N 2.67Å
17	V	36.5	Very low	42.3	Very low	134 Å²	134	110.9 Å²	110.9	81%	0.812	58%	0.577	S	S	*	*			trans	-45.5	97.3	-175.9	173.9	0	0	0	0	104.2	Q15 E19	Q15-V17 PolarHBondContact O-N 3.22Å; V17-E19 PolarHBondContact O-N 3.25Å
18	K	32.6	Very low	45	Very low	180 Å²	180	108.7 Å²	108.7	78%	0.783	56%	0.563	S	S	*	*			trans	-67.4	97.5	178.2	-81.3	-174.7	178.6	-179.9	0	99.8	G16	G16-K18 WeakPolarHBondContact O-CA 2.87Å; G16-K18 PolarHBondContact O-N 2.67Å
19	E	40.8	Very low	47.6	Very low	125 Å²	125	108.1 Å²	108.1	58%	0.584	56%	0.556	S	S	*	*			trans	-40.3	119.8	167.8	-75.2	-173.7	143.1	0	0	104.4	V17 L21	V17-E19 PolarHBondContact O-N 3.25Å; E19-L21 PolarHBondContact O-N 2.92Å
20	P	48.5	Very low	50.3	Low	51 Å²	51	103.6 Å²	103.6	33%	0.331	53%	0.527	S	S	.	.			trans	-54.9	118.4	-164.8	18.7	-30.7	0	0	0	106.3	Y22 K23	P20-Y22 CarbonylContact O-C 3.56Å; P20-Y22 WeakPolarHBondContact O-CA 3.35Å; P20-Y22 PolarHBondContact O-N 3.08Å; P20-K23 HydrophobicContact CG-CG 4.5Å; P20-K23 PolarHBondContact O-N 3.36Å
21	L	48.4	Very low	52.9	Low	100 Å²	100	102.8 Å²	102.8	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-41.6	-29.6	-175.7	-95.9	129.1	0	0	0	112.7	E19 K23 N24 Y25	E19-L21 PolarHBondContact O-N 2.92Å; L21-K23 PolarHBondContact O-N 3.4Å; L21-N24 WeakPolarHBondContact O-CB 3.37Å; L21-N24 PolarHBondContact O-N 3.36Å; L21-N24 VanDerWaalsContact O-N 3.15Å; L21-Y25 HydrophobicContact CB-CD2 4.39Å; L21-Y25 HydrophobicContact CB-CE2 4.05Å; L21-Y25 HydrophobicContact CD2-CE2 3.64Å; L21-Y25 WeakPolarHBondContact O-CD2 3.44Å; L21-Y25 PolarHBondContact O-N 3.07Å
22	Y	51.2	Low	55.9	Low	134 Å²	134	98.3 Å²	98.3	53%	0.525	50%	0.498	S	S	.	.	H	α-helix	trans	-48.6	-48	169	-171.4	-102.7	0	0	0	115.8	P20 N24 Y25 L26	P20-Y22 CarbonylContact O-C 3.56Å; P20-Y22 WeakPolarHBondContact O-CA 3.35Å; P20-Y22 PolarHBondContact O-N 3.08Å; Y22-N24 VanDerWaalsContact C-N 3.3Å; Y22-N24 PolarHBondContact O-N 3.21Å; Y22-Y25 PolarHBondContact O-N 3.39Å; Y22-L26 HydrophobicContact CD1-CD1 4.02Å; Y22-L26 HydrophobicContact CE1-CD1 3.36Å; Y22-L26 HydrophobicContact CE1-CG 4.37Å; Y22-L26 HydrophobicContact CE2-CD1 4.2Å; Y22-L26 VanDerWaalsContact CZ-CD1 3.46Å; Y22-L26 PolarHBondContact O-N 3.42Å; Y22-L26 VanDerWaalsContact O-N 3.16Å
23	K	57.3	Low	58.6	Low	42 Å²	42	92.3 Å²	92.3	18%	0.183	47%	0.47	C	S	.	.	H	α-helix	trans	-59.4	-43.9	175.1	-87.3	-175.2	173.7	179.8	0	109.8	P20 L21 F27 P84 D86	P20-K23 HydrophobicContact CG-CG 4.5Å; P20-K23 PolarHBondContact O-N 3.36Å; L21-K23 PolarHBondContact O-N 3.4Å; K23-F27 WeakPolarHBondContact O-CB 3.42Å; K23-F27 PolarHBondContact O-N 2.88Å; K23-P84 HydrophobicContact CD-CG 4.37Å; K23-P84 WeakPolarHBondContact CE-O 3Å; K23-P84 HydrophobicContact CG-CG 4.27Å; K23-P84 PolarHBondContact NZ-O 2.68Å; K23-P84 VanDerWaalsContact NZ-O 3.13Å; K23-D86 IonicContact NZ-OD2 2.65Å; K23-D86 PolarHBondContact NZ-OD2 3.02Å
24	N	66.7	Low	61.2	Low	72 Å²	72	90.8 Å²	90.8	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-43.7	-178.2	-68.5	-9.8	0	0	0	112.4	L21 Y22 V28	L21-N24 WeakPolarHBondContact O-CB 3.37Å; L21-N24 PolarHBondContact O-N 3.36Å; L21-N24 VanDerWaalsContact O-N 3.15Å; Y22-N24 VanDerWaalsContact C-N 3.3Å; Y22-N24 PolarHBondContact O-N 3.21Å; N24-V28 WeakPolarHBondContact O-CB 3.45Å; N24-V28 WeakPolarHBondContact O-CG2 3.46Å; N24-V28 PolarHBondContact O-N 3.02Å
25	Y	75.9	Confident	64.1	Low	138 Å²	138	87.3 Å²	87.3	54%	0.541	45%	0.447	S	S	.	.	H	α-helix	trans	-66.2	-49	178.2	-71.4	-64.6	0	0	0	112.6	L21 Y22 F27 V28 F29	L21-Y25 HydrophobicContact CB-CD2 4.39Å; L21-Y25 HydrophobicContact CB-CE2 4.05Å; L21-Y25 HydrophobicContact CD2-CE2 3.64Å; L21-Y25 WeakPolarHBondContact O-CD2 3.44Å; L21-Y25 PolarHBondContact O-N 3.07Å; Y22-Y25 PolarHBondContact O-N 3.39Å; Y25-F27 VanDerWaalsContact C-N 3.27Å; Y25-F27 PolarHBondContact O-N 3.18Å; Y25-V28 PolarHBondContact O-N 3.4Å; Y25-F29 HydrophobicContact CD1-CE2 4.47Å; Y25-F29 WeakPolarHBondContact O-CB 3.31Å; Y25-F29 WeakPolarHBondContact O-CD2 3.5Å; Y25-F29 PolarHBondContact O-N 3.08Å
26	L	75.6	Confident	66.7	Low	23 Å²	23	83.1 Å²	83.1	12%	0.12	43%	0.432	C	S	.	.	H	α-helix	trans	-58.9	-42.5	178.4	-77.2	178.1	0	0	0	111.6	Y22 F29 M30 L75 T78	Y22-L26 HydrophobicContact CD1-CD1 4.02Å; Y22-L26 HydrophobicContact CE1-CD1 3.36Å; Y22-L26 HydrophobicContact CE1-CG 4.37Å; Y22-L26 HydrophobicContact CE2-CD1 4.2Å; Y22-L26 VanDerWaalsContact CZ-CD1 3.46Å; Y22-L26 PolarHBondContact O-N 3.42Å; Y22-L26 VanDerWaalsContact O-N 3.16Å; L26-F29 PolarHBondContact O-N 3.07Å; L26-M30 VanDerWaalsContact O-CB 3.28Å; L26-M30 WeakPolarHBondContact O-CB 3.41Å; L26-M30 PolarHBondContact O-N 3.17Å; L26-L75 HydrophobicContact CD2-CD2 3.5Å; L26-L75 VanDerWaalsContact CD2-CD2 3.5Å; L26-T78 HydrophobicContact CD1-CG2 4.31Å
27	F	75.4	Confident	69.4	Low	85 Å²	85	81.7 Å²	81.7	37%	0.373	41%	0.412	S	S	.	.	H	α-helix	trans	-63.1	-46	177.1	-174.1	-107.2	0	0	0	112.1	K23 Y25 M30 I31 H79	K23-F27 WeakPolarHBondContact O-CB 3.42Å; K23-F27 PolarHBondContact O-N 2.88Å; Y25-F27 VanDerWaalsContact C-N 3.27Å; Y25-F27 PolarHBondContact O-N 3.18Å; F27-M30 HydrophobicContact CD2-CE 3.59Å; F27-M30 HydrophobicContact CE2-CE 3.85Å; F27-M30 PolarHBondContact O-N 3.31Å; F27-I31 HydrophobicContact CD1-CD1 3.7Å; F27-I31 HydrophobicContact CE1-CD1 3.22Å; F27-I31 HydrophobicContact CE1-CG1 4.37Å; F27-I31 HydrophobicContact CE2-CD1 4.17Å; F27-I31 HydrophobicContact CG-CD1 4.37Å; F27-I31 HydrophobicContact CZ-CD1 3.49Å; F27-I31 VanDerWaalsContact CZ-CD1 3.49Å; F27-I31 HydrophobicContact CZ-CG1 4.4Å; F27-I31 WeakPolarHBondContact O-CG1 3.32Å; F27-I31 PolarHBondContact O-N 2.9Å; F27-H79 AromaticContact CD2-NE2 3.73Å
28	V	81.3	Confident	71.8	Confident	86 Å²	86	80.3 Å²	80.3	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-44.5	176.6	169.8	0	0	0	0	111.3	N24 Y25 M30 I31 A32	N24-V28 WeakPolarHBondContact O-CB 3.45Å; N24-V28 WeakPolarHBondContact O-CG2 3.46Å; N24-V28 PolarHBondContact O-N 3.02Å; Y25-V28 PolarHBondContact O-N 3.4Å; V28-M30 VanDerWaalsContact C-N 3.35Å; V28-M30 PolarHBondContact O-N 3.47Å; V28-I31 PolarHBondContact O-N 2.96Å; V28-A32 WeakPolarHBondContact O-CB 3.27Å; V28-A32 PolarHBondContact O-N 2.74Å
29	F	82.7	Confident	74.4	Confident	128 Å²	128	74.6 Å²	74.6	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-37.7	176.9	-76.8	-60.7	0	0	0	112.3	Y25 L26 G33 L75	Y25-F29 HydrophobicContact CD1-CE2 4.47Å; Y25-F29 WeakPolarHBondContact O-CB 3.31Å; Y25-F29 WeakPolarHBondContact O-CD2 3.5Å; Y25-F29 PolarHBondContact O-N 3.08Å; L26-F29 PolarHBondContact O-N 3.07Å; F29-G33 PolarHBondContact O-N 3.12Å; F29-L75 HydrophobicContact CB-CD1 4.23Å
30	M	82.7	Confident	76.6	Confident	11 Å²	11	70.6 Å²	70.6	5%	0.054	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-46.3	173.9	-179.7	-174	67.5	0	0	111.1	L26 F27 V28 G33 L34 V72 A76 Y80	L26-M30 VanDerWaalsContact O-CB 3.28Å; L26-M30 WeakPolarHBondContact O-CB 3.41Å; L26-M30 PolarHBondContact O-N 3.17Å; F27-M30 HydrophobicContact CD2-CE 3.59Å; F27-M30 HydrophobicContact CE2-CE 3.85Å; F27-M30 PolarHBondContact O-N 3.31Å; V28-M30 VanDerWaalsContact C-N 3.35Å; V28-M30 PolarHBondContact O-N 3.47Å; M30-G33 PolarHBondContact O-N 2.9Å; M30-L34 HydrophobicContact CG-CD1 4.25Å; M30-L34 WeakPolarHBondContact O-CG 3.45Å; M30-L34 PolarHBondContact O-N 2.89Å; M30-V72 HydrophobicContact CG-CG1 4.48Å; M30-A76 HydrophobicContact SD-CB 3.87Å; M30-Y80 HydrophobicContact CE-CE2 4.04Å; M30-Y80 HydrophobicContact SD-CE2 3.81Å
31	I	84.5	Confident	78.3	Confident	65 Å²	65	71.7 Å²	71.7	33%	0.333	37%	0.365	S	S	.	.	H	α-helix	trans	-63.4	-49.1	177	-71	174.5	0	0	0	111	F27 V28 G33 L34 I35	F27-I31 HydrophobicContact CD1-CD1 3.7Å; F27-I31 HydrophobicContact CE1-CD1 3.22Å; F27-I31 HydrophobicContact CE1-CG1 4.37Å; F27-I31 HydrophobicContact CE2-CD1 4.17Å; F27-I31 HydrophobicContact CG-CD1 4.37Å; F27-I31 HydrophobicContact CZ-CD1 3.49Å; F27-I31 VanDerWaalsContact CZ-CD1 3.49Å; F27-I31 HydrophobicContact CZ-CG1 4.4Å; F27-I31 WeakPolarHBondContact O-CG1 3.32Å; F27-I31 PolarHBondContact O-N 2.9Å; V28-I31 PolarHBondContact O-N 2.96Å; I31-G33 VanDerWaalsContact C-N 3.26Å; I31-G33 PolarHBondContact O-N 2.88Å; I31-L34 PolarHBondContact O-N 2.9Å; I31-L34 VanDerWaalsContact O-N 3.14Å; I31-I35 HydrophobicContact CG2-CD1 3.63Å; I31-I35 HydrophobicContact CG2-CG1 4.28Å; I31-I35 VanDerWaalsContact O-CG1 3.31Å; I31-I35 WeakPolarHBondContact O-CG1 3.41Å; I31-I35 PolarHBondContact O-N 3.22Å
32	A	87.5	Confident	80.1	Confident	48 Å²	48	72 Å²	72	40%	0.397	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-39.3	177.8	0	0	0	0	0	111.5	V28 I35 T36	V28-A32 WeakPolarHBondContact O-CB 3.27Å; V28-A32 PolarHBondContact O-N 2.74Å; A32-I35 PolarHBondContact O-N 2.92Å; A32-T36 WeakPolarHBondContact O-CB 3.11Å; A32-T36 VanDerWaalsContact O-CG2 3.32Å; A32-T36 WeakPolarHBondContact O-CG2 3.31Å; A32-T36 PolarHBondContact O-N 3.32Å; A32-T36 PolarHBondContact O-OG1 2.85Å
33	G	84.7	Confident	81.8	Confident	8 Å²	8	69.9 Å²	69.9	8%	0.082	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-44.4	172.9	0	0	0	0	0	112.9	F29 M30 I31 T36 M37	F29-G33 PolarHBondContact O-N 3.12Å; M30-G33 PolarHBondContact O-N 2.9Å; I31-G33 VanDerWaalsContact C-N 3.26Å; I31-G33 PolarHBondContact O-N 2.88Å; G33-T36 WeakPolarHBondContact CA-OG1 3.41Å; G33-T36 PolarHBondContact O-N 2.89Å; G33-T36 PolarHBondContact O-OG1 3.35Å; G33-M37 VanDerWaalsContact O-CB 3.29Å; G33-M37 WeakPolarHBondContact O-CB 3.24Å; G33-M37 WeakPolarHBondContact O-CG 3.48Å; G33-M37 PolarHBondContact O-N 3.44Å
34	L	85.4	Confident	83	Confident	86 Å²	86	68.6 Å²	68.6	45%	0.45	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-44.7	175.6	-75	167.7	0	0	0	111.8	M30 I31 T36 M37 I38 V72	M30-L34 HydrophobicContact CG-CD1 4.25Å; M30-L34 WeakPolarHBondContact O-CG 3.45Å; M30-L34 PolarHBondContact O-N 2.89Å; I31-L34 PolarHBondContact O-N 2.9Å; I31-L34 VanDerWaalsContact O-N 3.14Å; L34-T36 VanDerWaalsContact C-N 3.32Å; L34-T36 PolarHBondContact O-N 3.36Å; L34-M37 PolarHBondContact O-N 2.93Å; L34-I38 WeakPolarHBondContact O-CG1 3.23Å; L34-I38 PolarHBondContact O-N 3.16Å; L34-V72 HydrophobicContact CD2-CG1 3.85Å; L34-V72 HydrophobicContact CG-CG1 3.87Å
35	I	88.8	Confident	83.8	Confident	110 Å²	110	70.1 Å²	70.1	56%	0.564	37%	0.365	S	S	*	.	H	α-helix	trans	-61.9	-40	178.4	-68.5	170.2	0	0	0	111.1	I31 A32 P39	I31-I35 HydrophobicContact CG2-CD1 3.63Å; I31-I35 HydrophobicContact CG2-CG1 4.28Å; I31-I35 VanDerWaalsContact O-CG1 3.31Å; I31-I35 WeakPolarHBondContact O-CG1 3.41Å; I31-I35 PolarHBondContact O-N 3.22Å; A32-I35 PolarHBondContact O-N 2.92Å; I35-P39 WeakPolarHBondContact O-CD 3.43Å
36	T	85.8	Confident	84.2	Confident	68 Å²	68	65.9 Å²	65.9	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-76	-29.2	177.8	51.1	0	0	0	0	112.9	A32 G33 L34 P39 L40	A32-T36 WeakPolarHBondContact O-CB 3.11Å; A32-T36 VanDerWaalsContact O-CG2 3.32Å; A32-T36 WeakPolarHBondContact O-CG2 3.31Å; A32-T36 PolarHBondContact O-N 3.32Å; A32-T36 PolarHBondContact O-OG1 2.85Å; G33-T36 WeakPolarHBondContact CA-OG1 3.41Å; G33-T36 PolarHBondContact O-N 2.89Å; G33-T36 PolarHBondContact O-OG1 3.35Å; L34-T36 VanDerWaalsContact C-N 3.32Å; L34-T36 PolarHBondContact O-N 3.36Å; T36-P39 WeakPolarHBondContact O-CD 3.5Å; T36-P39 WeakPolarHBondContact O-CG 3.41Å; T36-L40 WeakPolarHBondContact O-CD1 3.28Å; T36-L40 WeakPolarHBondContact O-CG 3.47Å; T36-L40 PolarHBondContact O-N 3.36Å
37	M	85.6	Confident	84.5	Confident	22 Å²	22	65.7 Å²	65.7	11%	0.108	36%	0.358	C	S	.	.	H	α-helix	trans	-66.8	-39.5	175.7	-83.3	-69	-68	0	0	113.1	G33 L34 L40 I41 C65 L68 G69 V72	G33-M37 VanDerWaalsContact O-CB 3.29Å; G33-M37 WeakPolarHBondContact O-CB 3.24Å; G33-M37 WeakPolarHBondContact O-CG 3.48Å; G33-M37 PolarHBondContact O-N 3.44Å; L34-M37 PolarHBondContact O-N 2.93Å; M37-L40 PolarHBondContact O-N 3.29Å; M37-I41 HydrophobicContact CE-CD1 4.09Å; M37-I41 HydrophobicContact CE-CG1 4.25Å; M37-I41 VanDerWaalsContact O-CG1 3.25Å; M37-I41 WeakPolarHBondContact O-CG1 3.49Å; M37-I41 PolarHBondContact O-N 2.85Å; M37-C65 WeakPolarHBondContact CE-O 3.47Å; M37-L68 HydrophobicContact CG-CB 4.47Å; M37-L68 HydrophobicContact CG-CD2 3.69Å; M37-L68 HydrophobicContact CG-CG 3.76Å; M37-L68 HydrophobicContact SD-CB 3.54Å; M37-L68 VanDerWaalsContact SD-CB 3.54Å; M37-L68 HydrophobicContact SD-CD2 3.5Å; M37-L68 VanDerWaalsContact SD-CD2 3.5Å; M37-L68 HydrophobicContact SD-CG 3.48Å; M37-L68 WeakPolarHBondContact SD-CG 3.49Å; M37-G69 PolarHBondContact SD-N 3.08Å; M37-G69 VanDerWaalsContact SD-N 3.42Å; M37-V72 HydrophobicContact CG-CG2 4.34Å
38	I	87.4	Confident	84.5	Confident	105 Å²	105	66.3 Å²	66.3	54%	0.538	36%	0.363	S	S	.	.	H	α-helix	trans	-54.9	-55.8	-178.9	-67.3	164.5	0	0	0	112.7	L34 L40 I41 I42	L34-I38 WeakPolarHBondContact O-CG1 3.23Å; L34-I38 PolarHBondContact O-N 3.16Å; I38-L40 VanDerWaalsContact C-N 3.32Å; I38-L40 PolarHBondContact O-N 2.86Å; I38-I41 PolarHBondContact O-N 2.84Å; I38-I42 HydrophobicContact CG2-CD1 4.11Å; I38-I42 WeakPolarHBondContact O-CG1 3.42Å; I38-I42 PolarHBondContact O-N 3.33Å; I38-I42 VanDerWaalsContact O-N 3.11Å
39	P	87.1	Confident	84.4	Confident	60 Å²	60	69.4 Å²	69.4	39%	0.39	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-34.5	178.1	25.8	-33.1	0	0	0	111.9	I35 T36 I41 I42 I43	I35-P39 WeakPolarHBondContact O-CD 3.43Å; T36-P39 WeakPolarHBondContact O-CD 3.5Å; T36-P39 WeakPolarHBondContact O-CG 3.41Å; P39-I41 VanDerWaalsContact C-N 3.34Å; P39-I41 PolarHBondContact O-N 3.27Å; P39-I42 PolarHBondContact O-N 2.9Å; P39-I43 WeakPolarHBondContact O-CB 3.32Å; P39-I43 WeakPolarHBondContact O-CG1 3.29Å; P39-I43 PolarHBondContact O-N 3.24Å
40	L	86.4	Confident	84.1	Confident	41 Å²	41	70 Å²	70	22%	0.215	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-41.5	175.1	-80.5	168.4	0	0	0	112.1	T36 M37 I38 I43 N44 L61 L68	T36-L40 WeakPolarHBondContact O-CD1 3.28Å; T36-L40 WeakPolarHBondContact O-CG 3.47Å; T36-L40 PolarHBondContact O-N 3.36Å; M37-L40 PolarHBondContact O-N 3.29Å; I38-L40 VanDerWaalsContact C-N 3.32Å; I38-L40 PolarHBondContact O-N 2.86Å; L40-I43 PolarHBondContact O-N 3.37Å; L40-N44 WeakPolarHBondContact O-CB 3.18Å; L40-N44 PolarHBondContact O-N 3.3Å; L40-L61 HydrophobicContact CD2-CD1 4.24Å; L40-L68 HydrophobicContact CD1-CD2 3.44Å; L40-L68 VanDerWaalsContact CD1-CD2 3.44Å
41	I	84.7	Confident	83.4	Confident	73 Å²	73	78.9 Å²	78.9	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-46.5	175.2	-69.2	163.6	0	0	0	110.3	M37 I38 P39 I43 N44 I45	M37-I41 HydrophobicContact CE-CD1 4.09Å; M37-I41 HydrophobicContact CE-CG1 4.25Å; M37-I41 VanDerWaalsContact O-CG1 3.25Å; M37-I41 WeakPolarHBondContact O-CG1 3.49Å; M37-I41 PolarHBondContact O-N 2.85Å; I38-I41 PolarHBondContact O-N 2.84Å; P39-I41 VanDerWaalsContact C-N 3.34Å; P39-I41 PolarHBondContact O-N 3.27Å; I41-I43 PolarHBondContact O-N 2.85Å; I41-N44 PolarHBondContact O-N 3.39Å; I41-I45 HydrophobicContact CG2-CD1 3.81Å; I41-I45 HydrophobicContact CG2-CG1 4.44Å; I41-I45 VanDerWaalsContact O-CG1 3.31Å; I41-I45 WeakPolarHBondContact O-CG1 3.4Å; I41-I45 PolarHBondContact O-N 3.02Å
42	I	86.7	Confident	82.8	Confident	108 Å²	108	87.9 Å²	87.9	55%	0.554	44%	0.444	S	S	*	.	H	α-helix	trans	-60.8	-46.9	179	-65.1	167.1	0	0	0	110.8	I38 P39 N44 I45 A46	I38-I42 HydrophobicContact CG2-CD1 4.11Å; I38-I42 WeakPolarHBondContact O-CG1 3.42Å; I38-I42 PolarHBondContact O-N 3.33Å; I38-I42 VanDerWaalsContact O-N 3.11Å; P39-I42 PolarHBondContact O-N 2.9Å; I42-N44 VanDerWaalsContact C-N 3.31Å; I42-N44 PolarHBondContact O-N 2.87Å; I42-I45 PolarHBondContact O-N 3.43Å; I42-A46 WeakPolarHBondContact O-CB 3.35Å; I42-A46 PolarHBondContact O-N 3.41Å
43	I	86.6	Confident	82	Confident	89 Å²	89	88.3 Å²	88.3	46%	0.456	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-42.1	177	-65.4	165.7	0	0	0	109.9	P39 L40 I41 A46 V47 L61	P39-I43 WeakPolarHBondContact O-CB 3.32Å; P39-I43 WeakPolarHBondContact O-CG1 3.29Å; P39-I43 PolarHBondContact O-N 3.24Å; L40-I43 PolarHBondContact O-N 3.37Å; I41-I43 PolarHBondContact O-N 2.85Å; I43-A46 PolarHBondContact O-N 2.89Å; I43-V47 HydrophobicContact CG2-CG2 4.06Å; I43-V47 VanDerWaalsContact O-CB 3.25Å; I43-V47 WeakPolarHBondContact O-CB 3.19Å; I43-V47 VanDerWaalsContact O-CG2 3.22Å; I43-V47 WeakPolarHBondContact O-CG2 3.46Å; I43-V47 PolarHBondContact O-N 2.98Å; I43-L61 HydrophobicContact CG2-CD2 3.98Å
44	N	82.9	Confident	81.4	Confident	15 Å²	15	91.4 Å²	91.4	8%	0.08	46%	0.46	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178.1	-166.1	16.6	0	0	0	111.8	L40 I41 I42 A46 V47 M48 L61	L40-N44 WeakPolarHBondContact O-CB 3.18Å; L40-N44 PolarHBondContact O-N 3.3Å; I41-N44 PolarHBondContact O-N 3.39Å; I42-N44 VanDerWaalsContact C-N 3.31Å; I42-N44 PolarHBondContact O-N 2.87Å; N44-A46 PolarHBondContact O-N 3.46Å; N44-V47 PolarHBondContact O-N 3.35Å; N44-M48 WeakPolarHBondContact O-CB 3.46Å; N44-M48 WeakPolarHBondContact O-CG 3.46Å; N44-M48 PolarHBondContact O-N 3.3Å; N44-L61 VanDerWaalsContact CA-CD2 3.5Å; N44-L61 HydrophobicContact CB-CD2 3.98Å; N44-L61 HydrophobicContact CB-CG 4.08Å
45	I	82.5	Confident	80.9	Confident	104 Å²	104	94.9 Å²	94.9	53%	0.533	47%	0.467	S	S	.	.	H	α-helix	trans	-58.6	-49.5	174.3	-66.6	165.8	0	0	0	110.3	I41 I42 V47 M48 M49	I41-I45 HydrophobicContact CG2-CD1 3.81Å; I41-I45 HydrophobicContact CG2-CG1 4.44Å; I41-I45 VanDerWaalsContact O-CG1 3.31Å; I41-I45 WeakPolarHBondContact O-CG1 3.4Å; I41-I45 PolarHBondContact O-N 3.02Å; I42-I45 PolarHBondContact O-N 3.43Å; I45-V47 VanDerWaalsContact C-N 3.33Å; I45-V47 PolarHBondContact O-N 3.47Å; I45-M48 PolarHBondContact O-N 3.49Å; I45-M49 HydrophobicContact CG2-CG 4.48Å; I45-M49 VanDerWaalsContact O-CG 3.25Å; I45-M49 WeakPolarHBondContact O-CG 3.45Å; I45-M49 PolarHBondContact O-N 2.86Å
46	A	84	Confident	80.2	Confident	49 Å²	49	95.2 Å²	95.2	41%	0.405	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-40.8	179.8	0	0	0	0	0	112.8	I42 I43 N44 M49 K50	I42-A46 WeakPolarHBondContact O-CB 3.35Å; I42-A46 PolarHBondContact O-N 3.41Å; I43-A46 PolarHBondContact O-N 2.89Å; N44-A46 PolarHBondContact O-N 3.46Å; A46-M49 PolarHBondContact O-N 3.11Å; A46-K50 PolarHBondContact O-N 3.41Å
47	V	81.7	Confident	79.8	Confident	19 Å²	19	94.6 Å²	94.6	12%	0.115	47%	0.467	C	S	.	.	H	α-helix	trans	-69.9	-36.2	178.6	162.5	0	0	0	0	111.7	I43 N44 I45 L53 R58 L61	I43-V47 HydrophobicContact CG2-CG2 4.06Å; I43-V47 VanDerWaalsContact O-CB 3.25Å; I43-V47 WeakPolarHBondContact O-CB 3.19Å; I43-V47 VanDerWaalsContact O-CG2 3.22Å; I43-V47 WeakPolarHBondContact O-CG2 3.46Å; I43-V47 PolarHBondContact O-N 2.98Å; N44-V47 PolarHBondContact O-N 3.35Å; I45-V47 VanDerWaalsContact C-N 3.33Å; I45-V47 PolarHBondContact O-N 3.47Å; V47-L53 HydrophobicContact CB-CD1 4.4Å; V47-L53 HydrophobicContact CG1-CD1 4.18Å; V47-L53 HydrophobicContact CG1-CD2 4.48Å; V47-L53 HydrophobicContact CG2-CD1 4.16Å; V47-R58 HydrophobicContact CG1-CB 4.43Å; V47-R58 HydrophobicContact CG1-CG 3.75Å; V47-R58 PolarHBondContact O-NE 3.42Å; V47-L61 HydrophobicContact CB-CD2 3.83Å; V47-L61 HydrophobicContact CG1-CD2 3.91Å; V47-L61 HydrophobicContact CG2-CD2 3.89Å
48	M	76.3	Confident	79.4	Confident	97 Å²	97	95.9 Å²	95.9	48%	0.478	47%	0.47	S	S	.	.	H	α-helix	trans	-66.8	-37.6	173.7	-72.6	-65.4	-72.8	0	0	111.9	N44 I45 R58	N44-M48 WeakPolarHBondContact O-CB 3.46Å; N44-M48 WeakPolarHBondContact O-CG 3.46Å; N44-M48 PolarHBondContact O-N 3.3Å; I45-M48 PolarHBondContact O-N 3.49Å; M48-R58 HydrophobicContact SD-CB 3.91Å; M48-R58 HydrophobicContact SD-CG 4.27Å
49	M	79	Confident	78.8	Confident	152 Å²	152	93.2 Å²	93.2	75%	0.749	46%	0.457	S	S	*	.	H	α-helix	trans	-72.3	-33.7	176.7	-66.3	-63	-77.5	0	0	113	I45 A46 K51	I45-M49 HydrophobicContact CG2-CG 4.48Å; I45-M49 VanDerWaalsContact O-CG 3.25Å; I45-M49 WeakPolarHBondContact O-CG 3.45Å; I45-M49 PolarHBondContact O-N 2.86Å; A46-M49 PolarHBondContact O-N 3.11Å; M49-K51 PolarHBondContact O-N 2.84Å; M49-K51 VanDerWaalsContact O-N 3.11Å
50	K	76.3	Confident	78.4	Confident	141 Å²	141	95.3 Å²	95.3	61%	0.613	46%	0.464	S	S	*	.			trans	-77.2	96.9	-179.5	-81.4	-175.1	176	179.5	0	112.4	A46 R52 L53 R58	A46-K50 PolarHBondContact O-N 3.41Å; K50-R52 PolarHBondContact O-N 3.26Å; K50-L53 HydrophobicContact CB-CD1 3.95Å; K50-L53 HydrophobicContact CD-CD1 4.44Å; K50-L53 PolarHBondContact O-N 3.16Å; K50-R58 PolarHBondContact O-NH2 2.92Å
51	K	68.5	Low	78.2	Confident	196 Å²	196	94.6 Å²	94.6	85%	0.852	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-27.8	178.8	-75.5	-174.6	-179.2	177.5	0	115.6	M49 L53 R58	M49-K51 PolarHBondContact O-N 2.84Å; M49-K51 VanDerWaalsContact O-N 3.11Å; K51-L53 PolarHBondContact O-N 3.35Å; K51-R58 PolarHBondContact O-NH2 3.43Å
52	R	72.2	Confident	78.1	Confident	254 Å²	254	93.7 Å²	93.7	96%	0.958	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.8	-174.8	-68.4	-173.8	-177.6	174.6	1.2	116.2	K50	K50-R52 PolarHBondContact O-N 3.26Å
53	L	68.8	Low	77.8	Confident	57 Å²	57	89.4 Å²	89.4	30%	0.298	44%	0.435	S	S	.	.	S	Bend	trans	-74.9	142.1	178.5	-88.5	126.5	0	0	0	112.2	V47 K50 K51 R55 C57 R58	V47-L53 HydrophobicContact CB-CD1 4.4Å; V47-L53 HydrophobicContact CG1-CD1 4.18Å; V47-L53 HydrophobicContact CG1-CD2 4.48Å; V47-L53 HydrophobicContact CG2-CD1 4.16Å; K50-L53 HydrophobicContact CB-CD1 3.95Å; K50-L53 HydrophobicContact CD-CD1 4.44Å; K50-L53 PolarHBondContact O-N 3.16Å; K51-L53 PolarHBondContact O-N 3.35Å; L53-R55 PolarHBondContact O-N 3.48Å; L53-C57 HydrophobicContact CD2-CB 4.2Å; L53-R58 PolarHBondContact O-NH2 2.68Å
54	S	73.3	Confident	77.6	Confident	73 Å²	73	89.3 Å²	89.3	51%	0.51	44%	0.435	S	S	.	.			trans	-56.3	135.8	173.6	176.3	0	0	0	0	110.4	I56 C57 R58	S54-I56 PolarHBondContact O-N 2.86Å; S54-I56 VanDerWaalsContact O-N 3.11Å; S54-C57 WeakPolarHBondContact O-CB 3.19Å; S54-C57 PolarHBondContact O-N 3.22Å; S54-R58 PolarHBondContact O-N 3.08Å
55	R	74.6	Confident	77.6	Confident	159 Å²	159	89.1 Å²	89.1	60%	0.6	44%	0.435	S	S	*	.	H	α-helix	trans	-53.3	-34.5	179.2	-65.1	-178.2	-175.6	-172.7	0.1	111.7	L53 R58 I59	L53-R55 PolarHBondContact O-N 3.48Å; R55-R58 PolarHBondContact O-N 3.33Å; R55-I59 WeakPolarHBondContact O-CD1 3.41Å; R55-I59 VanDerWaalsContact O-CG1 3.24Å; R55-I59 WeakPolarHBondContact O-CG1 3.19Å; R55-I59 PolarHBondContact O-N 2.93Å
56	I	74.8	Confident	77.6	Confident	118 Å²	118	87.4 Å²	87.4	61%	0.605	43%	0.426	S	S	*	.	H	α-helix	trans	-62.6	-43.2	179.1	-61.8	169.1	0	0	0	111.2	S54 R58 I59 L60	S54-I56 PolarHBondContact O-N 2.86Å; S54-I56 VanDerWaalsContact O-N 3.11Å; I56-R58 PolarHBondContact O-N 2.96Å; I56-I59 PolarHBondContact O-N 3.4Å; I56-L60 HydrophobicContact CG2-CD1 4.11Å; I56-L60 HydrophobicContact CG2-CG 4.47Å; I56-L60 WeakPolarHBondContact O-CG 3.48Å; I56-L60 PolarHBondContact O-N 2.86Å
57	C	76.5	Confident	77.5	Confident	55 Å²	55	86.7 Å²	86.7	37%	0.372	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-42.7	-179.8	-179.8	0	0	0	0	111.6	L53 S54 I59 L60 L61	L53-C57 HydrophobicContact CD2-CB 4.2Å; S54-C57 WeakPolarHBondContact O-CB 3.19Å; S54-C57 PolarHBondContact O-N 3.22Å; C57-I59 VanDerWaalsContact C-N 3.3Å; C57-I59 PolarHBondContact O-N 3.29Å; C57-L60 PolarHBondContact O-N 3.17Å; C57-L61 WeakPolarHBondContact O-CB 3.43Å; C57-L61 PolarHBondContact O-N 3.4Å
58	R	76.6	Confident	77.6	Confident	48 Å²	48	88 Å²	88	18%	0.181	42%	0.424	C	S	.	.	H	α-helix	trans	-59.8	-41.7	175.4	-61.4	-165.2	-179.3	138.3	24.6	112.2	V47 M48 K50 K51 L53 S54 R55 I56 L61 L62	V47-R58 HydrophobicContact CG1-CB 4.43Å; V47-R58 HydrophobicContact CG1-CG 3.75Å; V47-R58 PolarHBondContact O-NE 3.42Å; M48-R58 HydrophobicContact SD-CB 3.91Å; M48-R58 HydrophobicContact SD-CG 4.27Å; K50-R58 PolarHBondContact O-NH2 2.92Å; K51-R58 PolarHBondContact O-NH2 3.43Å; L53-R58 PolarHBondContact O-NH2 2.68Å; S54-R58 PolarHBondContact O-N 3.08Å; R55-R58 PolarHBondContact O-N 3.33Å; I56-R58 PolarHBondContact O-N 2.96Å; R58-L61 PolarHBondContact O-N 2.9Å; R58-L62 WeakPolarHBondContact O-CB 3.33Å; R58-L62 PolarHBondContact O-N 2.78Å
59	I	74.9	Confident	77.9	Confident	49 Å²	49	84.7 Å²	84.7	25%	0.251	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-47	179.8	-65.3	160.7	0	0	0	110.5	R55 I56 C57 L61 L62 C63 M338	R55-I59 WeakPolarHBondContact O-CD1 3.41Å; R55-I59 VanDerWaalsContact O-CG1 3.24Å; R55-I59 WeakPolarHBondContact O-CG1 3.19Å; R55-I59 PolarHBondContact O-N 2.93Å; I56-I59 PolarHBondContact O-N 3.4Å; C57-I59 VanDerWaalsContact C-N 3.3Å; C57-I59 PolarHBondContact O-N 3.29Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 3.22Å; I59-L62 PolarHBondContact O-N 2.83Å; I59-C63 WeakPolarHBondContact O-CB 3.4Å; I59-C63 PolarHBondContact O-N 3.38Å; I59-C63 PolarHBondContact O-SG 3.42Å; I59-M338 HydrophobicContact CD1-CE 3.7Å; I59-M338 HydrophobicContact CD1-CG 4.4Å; I59-M338 HydrophobicContact CD1-SD 4.45Å; I59-M338 HydrophobicContact CG1-CE 4.32Å
60	L	80.2	Confident	78.1	Confident	104 Å²	104	78 Å²	78	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-57.8	-45.1	177.6	-73.8	172.1	0	0	0	111.1	I56 C57 C63 I64	I56-L60 HydrophobicContact CG2-CD1 4.11Å; I56-L60 HydrophobicContact CG2-CG 4.47Å; I56-L60 WeakPolarHBondContact O-CG 3.48Å; I56-L60 PolarHBondContact O-N 2.86Å; C57-L60 PolarHBondContact O-N 3.17Å; L60-C63 PolarHBondContact O-N 3.26Å; L60-I64 WeakPolarHBondContact O-CD1 3.2Å; L60-I64 VanDerWaalsContact O-CG1 3.22Å; L60-I64 WeakPolarHBondContact O-CG1 3.39Å; L60-I64 PolarHBondContact O-N 3.49Å
61	L	82.3	Confident	78.4	Confident	26 Å²	26	74.2 Å²	74.2	14%	0.136	37%	0.374	C	S	.	.	H	α-helix	trans	-64.6	-41.7	178.1	-171.7	63.7	0	0	0	112.3	L40 I43 N44 V47 C57 R58 I59 I64 C65	L40-L61 HydrophobicContact CD2-CD1 4.24Å; I43-L61 HydrophobicContact CG2-CD2 3.98Å; N44-L61 VanDerWaalsContact CA-CD2 3.5Å; N44-L61 HydrophobicContact CB-CD2 3.98Å; N44-L61 HydrophobicContact CB-CG 4.08Å; V47-L61 HydrophobicContact CB-CD2 3.83Å; V47-L61 HydrophobicContact CG1-CD2 3.91Å; V47-L61 HydrophobicContact CG2-CD2 3.89Å; C57-L61 WeakPolarHBondContact O-CB 3.43Å; C57-L61 PolarHBondContact O-N 3.4Å; R58-L61 PolarHBondContact O-N 2.9Å; I59-L61 VanDerWaalsContact C-N 3.28Å; I59-L61 PolarHBondContact O-N 3.22Å; L61-I64 PolarHBondContact O-N 3.42Å; L61-C65 VanDerWaalsContact O-CB 3.31Å; L61-C65 WeakPolarHBondContact O-CB 3.34Å; L61-C65 PolarHBondContact O-N 3.49Å
62	L	81.4	Confident	79.2	Confident	55 Å²	55	65.5 Å²	65.5	29%	0.288	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-45.1	174.7	-176.5	68.6	0	0	0	111.5	R58 I59 C65 L66 L334	R58-L62 WeakPolarHBondContact O-CB 3.33Å; R58-L62 PolarHBondContact O-N 2.78Å; I59-L62 PolarHBondContact O-N 2.83Å; L62-C65 PolarHBondContact O-N 2.91Å; L62-L66 HydrophobicContact CD1-CD1 4.01Å; L62-L66 HydrophobicContact CD1-CG 4.4Å; L62-L66 HydrophobicContact CG-CD1 3.87Å; L62-L66 WeakPolarHBondContact O-CB 3.36Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 3.4Å; L62-L334 HydrophobicContact CD2-CD2 4.09Å
63	C	80.4	Confident	79.7	Confident	17 Å²	17	55.3 Å²	55.3	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-45	176.7	-72.2	0	0	0	0	111.5	I59 L60 L66 S67	I59-C63 WeakPolarHBondContact O-CB 3.4Å; I59-C63 PolarHBondContact O-N 3.38Å; I59-C63 PolarHBondContact O-SG 3.42Å; L60-C63 PolarHBondContact O-N 3.26Å; C63-L66 PolarHBondContact O-N 2.92Å; C63-S67 VanDerWaalsContact O-CB 3.31Å; C63-S67 WeakPolarHBondContact O-CB 3.23Å; C63-S67 PolarHBondContact O-N 2.88Å; C63-S67 PolarHBondContact O-OG 3.47Å
64	I	83	Confident	80.2	Confident	87 Å²	87	53.3 Å²	53.3	45%	0.446	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-50.3	176.4	-69	163.3	0	0	0	109.8	L60 L61 L66 S67 L68	L60-I64 WeakPolarHBondContact O-CD1 3.2Å; L60-I64 VanDerWaalsContact O-CG1 3.22Å; L60-I64 WeakPolarHBondContact O-CG1 3.39Å; L60-I64 PolarHBondContact O-N 3.49Å; L61-I64 PolarHBondContact O-N 3.42Å; I64-L66 VanDerWaalsContact C-N 3.34Å; I64-L66 PolarHBondContact O-N 3.43Å; I64-S67 WeakPolarHBondContact CA-OG 3.43Å; I64-S67 PolarHBondContact O-N 3.22Å; I64-S67 PolarHBondContact O-OG 3.46Å; I64-L68 WeakPolarHBondContact O-CB 3.24Å; I64-L68 PolarHBondContact O-N 3Å
65	C	82.3	Confident	80.5	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.081	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-43.9	-179.9	-169.3	0	0	0	0	111.9	M37 L61 L62 G69	M37-C65 WeakPolarHBondContact CE-O 3.47Å; L61-C65 VanDerWaalsContact O-CB 3.31Å; L61-C65 WeakPolarHBondContact O-CB 3.34Å; L61-C65 PolarHBondContact O-N 3.49Å; L62-C65 PolarHBondContact O-N 2.91Å; C65-G69 PolarHBondContact O-N 2.86Å
66	L	82.4	Confident	80.8	Confident	67 Å²	67	45.8 Å²	45.8	35%	0.351	27%	0.272	S	S	.	.	H	α-helix	trans	-72.7	-37.4	179.7	-72.5	170.2	0	0	0	112.6	L62 C63 I64 S70 V330 L334	L62-L66 HydrophobicContact CD1-CD1 4.01Å; L62-L66 HydrophobicContact CD1-CG 4.4Å; L62-L66 HydrophobicContact CG-CD1 3.87Å; L62-L66 WeakPolarHBondContact O-CB 3.36Å; L62-L66 WeakPolarHBondContact O-CG 3.47Å; L62-L66 PolarHBondContact O-N 3.4Å; C63-L66 PolarHBondContact O-N 2.92Å; I64-L66 VanDerWaalsContact C-N 3.34Å; I64-L66 PolarHBondContact O-N 3.43Å; L66-S70 VanDerWaalsContact O-CB 3.25Å; L66-S70 WeakPolarHBondContact O-CB 3.49Å; L66-S70 PolarHBondContact O-N 3.22Å; L66-V330 HydrophobicContact CB-CG1 3.83Å; L66-V330 HydrophobicContact CD1-CG1 4.06Å; L66-V330 HydrophobicContact CG-CG1 4.43Å; L66-L334 HydrophobicContact CD1-CD1 3.37Å; L66-L334 HydrophobicContact CD1-CD2 4.17Å; L66-L334 HydrophobicContact CD1-CG 4.28Å
67	S	82.4	Confident	80.9	Confident	34 Å²	34	43 Å²	43	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-44.6	174.3	67.7	0	0	0	0	111.6	C63 I64 S70 C71	C63-S67 VanDerWaalsContact O-CB 3.31Å; C63-S67 WeakPolarHBondContact O-CB 3.23Å; C63-S67 PolarHBondContact O-N 2.88Å; C63-S67 PolarHBondContact O-OG 3.47Å; I64-S67 WeakPolarHBondContact CA-OG 3.43Å; I64-S67 PolarHBondContact O-N 3.22Å; I64-S67 PolarHBondContact O-OG 3.46Å; S67-S70 WeakPolarHBondContact O-CB 3.5Å; S67-S70 PolarHBondContact O-N 2.9Å; S67-C71 PolarHBondContact O-N 3.29Å; S67-C71 PolarHBondContact O-SG 3.41Å
68	L	83.2	Confident	80.9	Confident	47 Å²	47	41.5 Å²	41.5	25%	0.246	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-42.6	179.2	-175.7	65.6	0	0	0	110.4	M37 L40 I64 S70 C71 V72	M37-L68 HydrophobicContact CG-CB 4.47Å; M37-L68 HydrophobicContact CG-CD2 3.69Å; M37-L68 HydrophobicContact CG-CG 3.76Å; M37-L68 HydrophobicContact SD-CB 3.54Å; M37-L68 VanDerWaalsContact SD-CB 3.54Å; M37-L68 HydrophobicContact SD-CD2 3.5Å; M37-L68 VanDerWaalsContact SD-CD2 3.5Å; M37-L68 HydrophobicContact SD-CG 3.48Å; M37-L68 WeakPolarHBondContact SD-CG 3.49Å; L40-L68 HydrophobicContact CD1-CD2 3.44Å; L40-L68 VanDerWaalsContact CD1-CD2 3.44Å; I64-L68 WeakPolarHBondContact O-CB 3.24Å; I64-L68 PolarHBondContact O-N 3Å; L68-S70 VanDerWaalsContact C-N 3.31Å; L68-S70 PolarHBondContact O-N 3.45Å; L68-C71 PolarHBondContact O-N 3.4Å; L68-C71 VanDerWaalsContact O-N 3.17Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.17Å
69	G	83.1	Confident	80.9	Confident	27 Å²	27	40.7 Å²	40.7	28%	0.278	24%	0.243	S	C	.	.	H	α-helix	trans	-59.5	-41	173.5	0	0	0	0	0	112.7	M37 C65 V72 G73	M37-G69 PolarHBondContact SD-N 3.08Å; M37-G69 VanDerWaalsContact SD-N 3.42Å; C65-G69 PolarHBondContact O-N 2.86Å; G69-V72 PolarHBondContact O-N 3.45Å; G69-G73 PolarHBondContact O-N 2.86Å
70	S	83.6	Confident	80.8	Confident	13 Å²	13	44.8 Å²	44.8	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-62.9	-43.3	173.5	-179.5	0	0	0	0	112	L66 S67 L68 G73 A74 L326 P327	L66-S70 VanDerWaalsContact O-CB 3.25Å; L66-S70 WeakPolarHBondContact O-CB 3.49Å; L66-S70 PolarHBondContact O-N 3.22Å; S67-S70 WeakPolarHBondContact O-CB 3.5Å; S67-S70 PolarHBondContact O-N 2.9Å; L68-S70 VanDerWaalsContact C-N 3.31Å; L68-S70 PolarHBondContact O-N 3.45Å; S70-G73 PolarHBondContact O-N 2.85Å; S70-A74 WeakPolarHBondContact O-CB 3.31Å; S70-A74 PolarHBondContact O-N 3.37Å; S70-L326 WeakPolarHBondContact OG-CD2 3.17Å; S70-P327 WeakPolarHBondContact OG-CD 3.32Å; S70-P327 WeakPolarHBondContact OG-CG 3.42Å
71	C	82	Confident	80.4	Confident	60 Å²	60	40.2 Å²	40.2	41%	0.405	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-45.5	176.9	-70.5	0	0	0	0	111.6	S67 L68 G73 A74 L75	S67-C71 PolarHBondContact O-N 3.29Å; S67-C71 PolarHBondContact O-SG 3.41Å; L68-C71 PolarHBondContact O-N 3.4Å; L68-C71 VanDerWaalsContact O-N 3.17Å; C71-G73 VanDerWaalsContact C-N 3.33Å; C71-G73 PolarHBondContact O-N 2.91Å; C71-A74 PolarHBondContact O-N 2.84Å; C71-L75 WeakPolarHBondContact O-CG 3.49Å; C71-L75 PolarHBondContact O-N 3.31Å
72	V	84.7	Confident	80.1	Confident	13 Å²	13	39.3 Å²	39.3	8%	0.079	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-42.9	175.9	174.6	0	0	0	0	110.7	M30 L34 M37 L68 G69 A74 L75 A76	M30-V72 HydrophobicContact CG-CG1 4.48Å; L34-V72 HydrophobicContact CD2-CG1 3.85Å; L34-V72 HydrophobicContact CG-CG1 3.87Å; M37-V72 HydrophobicContact CG-CG2 4.34Å; L68-V72 WeakPolarHBondContact O-CG2 3.46Å; L68-V72 PolarHBondContact O-N 3.17Å; G69-V72 PolarHBondContact O-N 3.45Å; V72-A74 PolarHBondContact O-N 3.44Å; V72-L75 PolarHBondContact O-N 3.25Å; V72-A76 WeakPolarHBondContact O-CB 3.22Å; V72-A76 PolarHBondContact O-N 3.47Å
73	G	82.7	Confident	79.8	Confident	40 Å²	40	37 Å²	37	41%	0.412	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-42.5	174.9	0	0	0	0	0	112.7	G69 S70 C71 A76 F77	G69-G73 PolarHBondContact O-N 2.86Å; S70-G73 PolarHBondContact O-N 2.85Å; C71-G73 VanDerWaalsContact C-N 3.33Å; C71-G73 PolarHBondContact O-N 2.91Å; G73-A76 PolarHBondContact O-N 3.33Å; G73-F77 WeakPolarHBondContact O-CB 3.41Å; G73-F77 PolarHBondContact O-N 3.02Å
74	A	80.5	Confident	79.9	Confident	15 Å²	15	37.2 Å²	37.2	12%	0.124	22%	0.219	C	C	.	.	H	α-helix	trans	-65.7	-40.4	175.8	0	0	0	0	0	112.4	S70 C71 V72 F77 T78 M323	S70-A74 WeakPolarHBondContact O-CB 3.31Å; S70-A74 PolarHBondContact O-N 3.37Å; C71-A74 PolarHBondContact O-N 2.84Å; V72-A74 PolarHBondContact O-N 3.44Å; A74-F77 PolarHBondContact O-N 2.8Å; A74-T78 WeakPolarHBondContact O-CB 3.3Å; A74-T78 PolarHBondContact O-N 3.28Å; A74-T78 PolarHBondContact O-OG1 2.93Å; A74-M323 HydrophobicContact CB-CB 4.15Å; A74-M323 HydrophobicContact CB-CG 4.43Å; A74-M323 HydrophobicContact CB-SD 3.68Å
75	L	80.3	Confident	79.8	Confident	49 Å²	49	34 Å²	34	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-64.1	-44.6	174.2	-71.9	171.5	0	0	0	111.4	L26 F29 C71 V72 T78 H79	L26-L75 HydrophobicContact CD2-CD2 3.5Å; L26-L75 VanDerWaalsContact CD2-CD2 3.5Å; F29-L75 HydrophobicContact CB-CD1 4.23Å; C71-L75 WeakPolarHBondContact O-CG 3.49Å; C71-L75 PolarHBondContact O-N 3.31Å; V72-L75 PolarHBondContact O-N 3.25Å; L75-T78 PolarHBondContact O-N 2.85Å; L75-H79 WeakPolarHBondContact O-CB 3.47Å; L75-H79 PolarHBondContact O-N 3.31Å
76	A	79.4	Confident	79.9	Confident	26 Å²	26	38.2 Å²	38.2	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-61.9	-45.9	176	0	0	0	0	0	111.1	M30 V72 G73 T78 H79 Y80	M30-A76 HydrophobicContact SD-CB 3.87Å; V72-A76 WeakPolarHBondContact O-CB 3.22Å; V72-A76 PolarHBondContact O-N 3.47Å; G73-A76 PolarHBondContact O-N 3.33Å; A76-T78 VanDerWaalsContact C-N 3.33Å; A76-T78 PolarHBondContact O-N 2.65Å; A76-H79 PolarHBondContact O-N 2.97Å; A76-Y80 HydrophobicContact CB-CD2 4.38Å; A76-Y80 WeakPolarHBondContact O-CB 3.47Å; A76-Y80 VanDerWaalsContact O-CD2 3.26Å; A76-Y80 WeakPolarHBondContact O-CD2 3.28Å; A76-Y80 PolarHBondContact O-N 3.04Å
77	F	77.1	Confident	80	Confident	58 Å²	58	36 Å²	36	25%	0.254	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-44.5	174.7	-176.7	-89.8	0	0	0	111.5	G73 A74 H79 A81 L82 L111 I319 M323	G73-F77 WeakPolarHBondContact O-CB 3.41Å; G73-F77 PolarHBondContact O-N 3.02Å; A74-F77 PolarHBondContact O-N 2.8Å; F77-H79 VanDerWaalsContact C-N 3.33Å; F77-H79 PolarHBondContact O-N 3.25Å; F77-A81 HydrophobicContact CD1-CB 4.34Å; F77-A81 HydrophobicContact CD2-CB 3.99Å; F77-A81 HydrophobicContact CE1-CB 4.21Å; F77-A81 HydrophobicContact CE2-CB 3.83Å; F77-A81 HydrophobicContact CG-CB 4.26Å; F77-A81 HydrophobicContact CZ-CB 3.95Å; F77-A81 WeakPolarHBondContact O-CA 3.18Å; F77-A81 WeakPolarHBondContact O-CB 3.23Å; F77-A81 PolarHBondContact O-N 3.25Å; F77-L82 HydrophobicContact CD1-CD1 3.99Å; F77-L82 HydrophobicContact CD1-CG 4.18Å; F77-L82 HydrophobicContact CE1-CD1 3.81Å; F77-L82 HydrophobicContact CE1-CD2 4.29Å; F77-L82 HydrophobicContact CE1-CG 3.85Å; F77-L82 PolarHBondContact O-N 3.45Å; F77-L111 HydrophobicContact CE2-CD1 4.37Å; F77-I319 HydrophobicContact CE1-CG2 4.37Å; F77-M323 HydrophobicContact CB-CE 4.02Å; F77-M323 HydrophobicContact CB-SD 4.4Å; F77-M323 HydrophobicContact CD1-CE 3.1Å; F77-M323 HydrophobicContact CD1-SD 4.15Å; F77-M323 HydrophobicContact CD2-CE 4.08Å; F77-M323 HydrophobicContact CE1-CE 3.42Å; F77-M323 VanDerWaalsContact CE1-CE 3.42Å; F77-M323 HydrophobicContact CE2-CE 4.35Å; F77-M323 HydrophobicContact CG-CE 3.46Å; F77-M323 VanDerWaalsContact CG-CE 3.46Å; F77-M323 HydrophobicContact CG-SD 4.42Å; F77-M323 HydrophobicContact CZ-CE 4.05Å
78	T	77.3	Confident	80	Confident	24 Å²	24	38.6 Å²	38.6	15%	0.147	23%	0.228	C	C	.	.	I	π-helix	trans	-62.8	-41.3	177.9	-55.9	0	0	0	0	111.1	L26 A74 L75 A76 L82 G83	L26-T78 HydrophobicContact CD1-CG2 4.31Å; A74-T78 WeakPolarHBondContact O-CB 3.3Å; A74-T78 PolarHBondContact O-N 3.28Å; A74-T78 PolarHBondContact O-OG1 2.93Å; L75-T78 PolarHBondContact O-N 2.85Å; A76-T78 VanDerWaalsContact C-N 3.33Å; A76-T78 PolarHBondContact O-N 2.65Å; T78-L82 CarbonylContact O-C 3.5Å; T78-L82 VanDerWaalsContact O-C 3.32Å; T78-L82 WeakPolarHBondContact O-CA 3.1Å; T78-L82 WeakPolarHBondContact O-CB 2.99Å; T78-L82 PolarHBondContact O-N 2.97Å; T78-G83 WeakPolarHBondContact O-CA 2.99Å; T78-G83 PolarHBondContact O-N 2.87Å
79	H	75.2	Confident	80	Confident	32 Å²	32	36.4 Å²	36.4	15%	0.148	22%	0.216	C	C	.	.	I	π-helix	trans	-71.6	-47.3	-179.8	-170.9	-16.2	0	0	0	112.4	F27 L75 A76 F77 G83	F27-H79 AromaticContact CD2-NE2 3.73Å; L75-H79 WeakPolarHBondContact O-CB 3.47Å; L75-H79 PolarHBondContact O-N 3.31Å; A76-H79 PolarHBondContact O-N 2.97Å; F77-H79 VanDerWaalsContact C-N 3.33Å; F77-H79 PolarHBondContact O-N 3.25Å; H79-G83 WeakPolarHBondContact O-CA 3.49Å; H79-G83 PolarHBondContact O-N 3.12Å
80	Y	74.2	Confident	79.9	Confident	135 Å²	135	35.7 Å²	35.7	53%	0.529	21%	0.206	S	C	.	.	I	π-helix	trans	-89.8	-34.5	-171.1	-69.1	-68.3	0	0	0	113.7	M30 A76	M30-Y80 HydrophobicContact CE-CE2 4.04Å; M30-Y80 HydrophobicContact SD-CE2 3.81Å; A76-Y80 HydrophobicContact CB-CD2 4.38Å; A76-Y80 WeakPolarHBondContact O-CB 3.47Å; A76-Y80 VanDerWaalsContact O-CD2 3.26Å; A76-Y80 WeakPolarHBondContact O-CD2 3.28Å; A76-Y80 PolarHBondContact O-N 3.04Å
81	A	72.3	Confident	79.7	Confident	8 Å²	8	37.1 Å²	37.1	7%	0.066	21%	0.211	C	C	.	.	I	π-helix	trans	-94.2	-44.1	179.6	0	0	0	0	0	112.5	F77 R112	F77-A81 HydrophobicContact CD1-CB 4.34Å; F77-A81 HydrophobicContact CD2-CB 3.99Å; F77-A81 HydrophobicContact CE1-CB 4.21Å; F77-A81 HydrophobicContact CE2-CB 3.83Å; F77-A81 HydrophobicContact CG-CB 4.26Å; F77-A81 HydrophobicContact CZ-CB 3.95Å; F77-A81 WeakPolarHBondContact O-CA 3.18Å; F77-A81 WeakPolarHBondContact O-CB 3.23Å; F77-A81 PolarHBondContact O-N 3.25Å; A81-R112 PolarHBondContact O-NH1 2.93Å
82	L	75	Confident	79.5	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	19%	0.192	C	C	.	.	I	π-helix	trans	-97.6	-14.6	-175.7	-57	172.6	0	0	0	114	F77 T78 T115 P315 I319	F77-L82 HydrophobicContact CD1-CD1 3.99Å; F77-L82 HydrophobicContact CD1-CG 4.18Å; F77-L82 HydrophobicContact CE1-CD1 3.81Å; F77-L82 HydrophobicContact CE1-CD2 4.29Å; F77-L82 HydrophobicContact CE1-CG 3.85Å; F77-L82 PolarHBondContact O-N 3.45Å; T78-L82 CarbonylContact O-C 3.5Å; T78-L82 VanDerWaalsContact O-C 3.32Å; T78-L82 WeakPolarHBondContact O-CA 3.1Å; T78-L82 WeakPolarHBondContact O-CB 2.99Å; T78-L82 PolarHBondContact O-N 2.97Å; L82-T115 VanDerWaalsContact CD2-CB 3.48Å; L82-T115 HydrophobicContact CD2-CG2 4.15Å; L82-T115 WeakPolarHBondContact CD2-OG1 3.3Å; L82-P315 HydrophobicContact CD1-CB 3.97Å; L82-P315 HydrophobicContact CD1-CG 4.49Å; L82-P315 HydrophobicContact CD2-CB 4.45Å; L82-I319 HydrophobicContact CD1-CG2 4.05Å
83	G	75.9	Confident	79.4	Confident	7 Å²	7	34 Å²	34	7%	0.072	19%	0.19	C	C	.	.	S	Bend	trans	-67.7	169.5	-173.4	0	0	0	0	0	113.1	T78 H79 I85 R112	T78-G83 WeakPolarHBondContact O-CA 2.99Å; T78-G83 PolarHBondContact O-N 2.87Å; H79-G83 WeakPolarHBondContact O-CA 3.49Å; H79-G83 PolarHBondContact O-N 3.12Å; G83-I85 PolarHBondContact O-N 3.01Å; G83-R112 PolarHBondContact O-NH1 2.82Å; G83-R112 PolarHBondContact O-NH2 2.83Å
84	P	80.9	Confident	79.4	Confident	21 Å²	21	33 Å²	33	14%	0.136	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-61.9	134.4	-179.8	-11	21.6	0	0	0	111.6	K23 H310 I311 I312	K23-P84 HydrophobicContact CD-CG 4.37Å; K23-P84 WeakPolarHBondContact CE-O 3Å; K23-P84 HydrophobicContact CG-CG 4.27Å; K23-P84 PolarHBondContact NZ-O 2.68Å; K23-P84 VanDerWaalsContact NZ-O 3.13Å; P84-H310 WeakPolarHBondContact CB-CE1 3.29Å; P84-I311 WeakPolarHBondContact CA-O 3.31Å; P84-I312 HydrophobicContact CB-CG1 4.47Å
85	I	81.7	Confident	79.5	Confident	21 Å²	21	32.6 Å²	32.6	11%	0.108	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.2	174.8	-63.6	169.9	0	0	0	108.3	G83 I87 H109 R112 H310 I311	G83-I85 PolarHBondContact O-N 3.01Å; I85-I87 HydrophobicContact CG2-CD1 4.13Å; I85-I87 HydrophobicContact CG2-CG1 3.64Å; I85-H109 HydrophobicContact CD1-CB 4.24Å; I85-H109 VanDerWaalsContact CD1-ND1 3.27Å; I85-H109 WeakPolarHBondContact CD1-ND1 3.35Å; I85-R112 VanDerWaalsContact CD1-NH1 3.29Å; I85-H310 WeakPolarHBondContact O-CA 3.44Å; I85-I311 HydrophobicContact CB-CB 4.46Å; I85-I311 PolarHBondContact N-O 2.71Å; I85-I311 PolarHBondContact O-N 2.86Å
86	D	84.2	Confident	79.5	Confident	99 Å²	99	31.9 Å²	31.9	53%	0.529	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.3	173.8	-66.7	-69.4	0	0	0	107.8	K23 H310	K23-D86 IonicContact NZ-OD2 2.65Å; K23-D86 PolarHBondContact NZ-OD2 3.02Å; D86-H310 IonicContact OD1-CE1 3.83Å; D86-H310 IonicContact OD1-CG 3.91Å; D86-H310 IonicContact OD1-ND1 3.97Å; D86-H310 PolarHBondContact OD1-ND1 2.83Å; D86-H310 IonicContact OD2-ND1 3.89Å
87	I	83.7	Confident	79.6	Confident	21 Å²	21	31.3 Å²	31.3	11%	0.108	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.4	177.8	-47.5	-175.8	0	0	0	108.4	I85 L89 V95 I97 V309 I311	I85-I87 HydrophobicContact CG2-CD1 4.13Å; I85-I87 HydrophobicContact CG2-CG1 3.64Å; I87-L89 HydrophobicContact CG2-CD2 3.58Å; I87-L89 HydrophobicContact CG2-CG 4.17Å; I87-V95 HydrophobicContact CD1-CG1 4.26Å; I87-V95 HydrophobicContact CG2-CG2 4.42Å; I87-I97 HydrophobicContact CD1-CD1 4.45Å; I87-V309 PolarHBondContact N-O 2.86Å; I87-V309 PolarHBondContact O-N 2.62Å; I87-I311 HydrophobicContact CD1-CD1 3.53Å; I87-I311 HydrophobicContact CG1-CD1 4.17Å
88	T	83.7	Confident	79.5	Confident	89 Å²	89	28.6 Å²	28.6	55%	0.546	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.9	167.6	-53.9	0	0	0	0	108.6	N308	T88-N308 PolarHBondContact OG1-OD1 2.85Å
89	L	83.7	Confident	78.9	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.7	177	-59.5	-177.4	0	0	0	109.4	I87 D93 V95 I128 I292 Y294 Y306 A307 V309	I87-L89 HydrophobicContact CG2-CD2 3.58Å; I87-L89 HydrophobicContact CG2-CG 4.17Å; L89-D93 HydrophobicContact CB-CB 4.29Å; L89-D93 HydrophobicContact CD2-CB 4.19Å; L89-V95 HydrophobicContact CD2-CG2 3.41Å; L89-V95 VanDerWaalsContact CD2-CG2 3.41Å; L89-I128 HydrophobicContact CD1-CD1 4.34Å; L89-I292 HydrophobicContact CD1-CG2 3.73Å; L89-Y294 HydrophobicContact CB-CD1 4.49Å; L89-Y306 CarbonylContact O-C 3.51Å; L89-Y306 VanDerWaalsContact O-CA 3.27Å; L89-Y306 WeakPolarHBondContact O-CA 3.44Å; L89-A307 PolarHBondContact N-O 3.08Å; L89-A307 PolarHBondContact O-N 3.05Å; L89-V309 HydrophobicContact CD1-CG2 3.75Å; L89-V309 HydrophobicContact CG-CG2 4.17Å
90	T	80.3	Confident	78.2	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.067	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	155.3	164	64.8	0	0	0	0	110.3	G92 D93 H159 L160 D305	T90-G92 PolarHBondContact O-N 3.49Å; T90-D93 WeakPolarHBondContact CB-OD2 3.27Å; T90-D93 PolarHBondContact N-OD2 3.33Å; T90-D93 VanDerWaalsContact O-CB 3.23Å; T90-D93 WeakPolarHBondContact O-CB 3.27Å; T90-D93 PolarHBondContact O-N 3.39Å; T90-D93 PolarHBondContact OG1-OD1 2.84Å; T90-D93 VanDerWaalsContact OG1-OD1 3.06Å; T90-D93 PolarHBondContact OG1-OD2 3.46Å; T90-H159 WeakPolarHBondContact CG2-O 3.4Å; T90-L160 HydrophobicContact CG2-CD2 4.41Å; T90-D305 WeakPolarHBondContact CA-O 3.3Å
91	K	79.2	Confident	77.4	Confident	44 Å²	44	29.8 Å²	29.8	19%	0.191	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	123.4	-179.7	-144.1	-161.3	176.9	174.2	0	110.4	Y294 V296 P302 D305	K91-Y294 HydrophobicContact CB-CD1 4.06Å; K91-Y294 HydrophobicContact CB-CE1 3.89Å; K91-Y294 HydrophobicContact CG-CD1 4.15Å; K91-Y294 HydrophobicContact CG-CE1 3.86Å; K91-Y294 HydrophobicContact CG-CE2 4.31Å; K91-Y294 HydrophobicContact CG-CG 4.44Å; K91-V296 HydrophobicContact CB-CG2 4.23Å; K91-V296 HydrophobicContact CD-CG1 4.3Å; K91-V296 HydrophobicContact CD-CG2 3.99Å; K91-V296 HydrophobicContact CG-CG2 3.72Å; K91-P302 HydrophobicContact CD-CB 3.41Å; K91-P302 VanDerWaalsContact CD-CB 3.41Å; K91-P302 HydrophobicContact CD-CG 3.92Å; K91-D305 PolarHBondContact N-O 2.86Å
92	G	78.7	Confident	76.6	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	-7	-174.6	0	0	0	0	0	114.5	T90 R260 R262 Y294 V296	T90-G92 PolarHBondContact O-N 3.49Å; G92-R260 PolarHBondContact O-NH1 3.27Å; G92-R262 PolarHBondContact O-NE 3.48Å; G92-R262 PolarHBondContact O-NH2 2.9Å; G92-Y294 WeakPolarHBondContact CA-O 3.05Å; G92-Y294 PolarHBondContact N-O 3.37Å; G92-V296 VanDerWaalsContact CA-CG2 3.44Å
93	D	81.8	Confident	75.3	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.027	21%	0.209	C	C	.	.			trans	-68.4	146.9	173.1	-71.8	-15.4	0	0	0	111.8	L89 T90 R260 Y294	L89-D93 HydrophobicContact CB-CB 4.29Å; L89-D93 HydrophobicContact CD2-CB 4.19Å; T90-D93 WeakPolarHBondContact CB-OD2 3.27Å; T90-D93 PolarHBondContact N-OD2 3.33Å; T90-D93 VanDerWaalsContact O-CB 3.23Å; T90-D93 WeakPolarHBondContact O-CB 3.27Å; T90-D93 PolarHBondContact O-N 3.39Å; T90-D93 PolarHBondContact OG1-OD1 2.84Å; T90-D93 VanDerWaalsContact OG1-OD1 3.06Å; T90-D93 PolarHBondContact OG1-OD2 3.46Å; D93-R260 IonicContact OD1-CZ 2.93Å; D93-R260 VanDerWaalsContact OD1-CZ 3.28Å; D93-R260 IonicContact OD1-NH1 3.99Å; D93-R260 PolarHBondContact OD1-NH1 3.41Å; D93-R260 IonicContact OD1-NH2 2.91Å; D93-R260 PolarHBondContact OD1-NH2 2.73Å; D93-Y294 PolarHBondContact O-N 3.25Å
94	Q	83.5	Confident	74	Confident	20 Å²	20	38 Å²	38	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.5	169.7	-74.7	174.6	-24.7	0	0	109.5	R161 W263 I291 I292 D293	Q94-R161 WeakPolarHBondContact O-CD 3.36Å; Q94-W263 PolarHBondContact NE2-O 2.69Å; Q94-W263 VanDerWaalsContact NE2-O 3.1Å; Q94-I291 HydrophobicContact CB-CG2 4.02Å; Q94-I291 HydrophobicContact CG-CG2 4.14Å; Q94-I292 CarbonylContact C-O 3.59Å; Q94-I292 WeakPolarHBondContact CA-O 3.4Å; Q94-D293 HydrophobicContact CG-CB 4.02Å; Q94-D293 PolarHBondContact NE2-OD2 2.85Å
95	V	82.4	Confident	72.5	Confident	7 Å²	7	38.5 Å²	38.5	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	116.2	176.1	-179.9	0	0	0	0	108.8	I87 L89 I97 R161 I291 I292	I87-V95 HydrophobicContact CD1-CG1 4.26Å; I87-V95 HydrophobicContact CG2-CG2 4.42Å; L89-V95 HydrophobicContact CD2-CG2 3.41Å; L89-V95 VanDerWaalsContact CD2-CG2 3.41Å; V95-I97 HydrophobicContact CG1-CG1 4.12Å; V95-R161 VanDerWaalsContact CG2-CZ 3.47Å; V95-I291 CarbonylContact O-C 3.42Å; V95-I291 WeakPolarHBondContact O-CA 3.1Å; V95-I292 PolarHBondContact N-O 3.42Å; V95-I292 PolarHBondContact O-N 2.91Å
96	L	80.4	Confident	70.8	Confident	34 Å²	34	42.2 Å²	42.2	18%	0.178	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	129.2	169.3	-178.7	68.9	0	0	0	109.3	F104 L105 T133 P137 I291	L96-F104 HydrophobicContact CD2-CB 4.09Å; L96-L105 HydrophobicContact CB-CD2 4.16Å; L96-L105 HydrophobicContact CD2-CD2 3.89Å; L96-L105 HydrophobicContact CD2-CG 4.48Å; L96-L105 HydrophobicContact CG-CD2 3.77Å; L96-L105 VanDerWaalsContact O-CD2 3.26Å; L96-L105 WeakPolarHBondContact O-CD2 3.5Å; L96-T133 HydrophobicContact CD1-CG2 3.59Å; L96-P137 HydrophobicContact CD2-CG 4.14Å; L96-I291 HydrophobicContact CB-CG1 4.24Å; L96-I291 HydrophobicContact CD1-CD1 4.02Å; L96-I291 HydrophobicContact CD1-CG1 3.47Å; L96-I291 VanDerWaalsContact CD1-CG1 3.47Å; L96-I291 HydrophobicContact CG-CG1 4.46Å
97	I	79.7	Confident	69.2	Low	13 Å²	13	42.9 Å²	42.9	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.6	168.9	-59.2	175.9	0	0	0	106.6	I87 V95 S289 Y290 I292 I311	I87-I97 HydrophobicContact CD1-CD1 4.45Å; V95-I97 HydrophobicContact CG1-CG1 4.12Å; I97-S289 CarbonylContact O-C 3.58Å; I97-S289 VanDerWaalsContact O-CA 3.3Å; I97-S289 WeakPolarHBondContact O-CA 3.14Å; I97-Y290 HydrophobicContact CB-CD1 4.29Å; I97-Y290 HydrophobicContact CB-CD2 4.27Å; I97-Y290 HydrophobicContact CB-CE1 3.82Å; I97-Y290 HydrophobicContact CB-CE2 3.8Å; I97-Y290 HydrophobicContact CD1-CE2 3.67Å; I97-Y290 WeakPolarHBondContact CD1-OH 3.29Å; I97-Y290 HydrophobicContact CG1-CE2 4.15Å; I97-Y290 HydrophobicContact CG2-CD1 4.48Å; I97-Y290 HydrophobicContact CG2-CE1 3.65Å; I97-Y290 HydrophobicContact CG2-CE2 4.32Å; I97-Y290 WeakPolarHBondContact CG2-OH 3.36Å; I97-Y290 PolarHBondContact N-O 2.9Å; I97-Y290 PolarHBondContact O-N 2.87Å; I97-Y290 VanDerWaalsContact O-O 3.11Å; I97-I292 HydrophobicContact CD1-CD1 4.01Å; I97-I311 HydrophobicContact CD1-CD1 3.64Å
98	G	75.2	Confident	67.6	Low	1 Å²	1	47.9 Å²	47.9	1%	0.01	28%	0.275	C	S	.	.			trans	-156.7	-164.8	-174.4	0	0	0	0	0	114	L105 E110 S113 K288	G98-L105 VanDerWaalsContact C-CD1 3.46Å; G98-E110 VanDerWaalsContact O-O 3.04Å; G98-S113 PolarHBondContact O-OG 3.32Å; G98-K288 CarbonylContact C-O 3.59Å; G98-K288 WeakPolarHBondContact CA-O 3.31Å
99	E	66	Low	66.2	Low	39 Å²	39	47.3 Å²	47.3	18%	0.182	27%	0.266	C	S	.	.			trans	-81	154.4	177.9	-70.8	178.7	167.4	0	0	110.6	T101 N102 L105 S113 K288	E99-T101 PolarHBondContact O-N 3.37Å; E99-N102 PolarHBondContact N-ND2 2.91Å; E99-N102 WeakPolarHBondContact O-CB 3.12Å; E99-N102 PolarHBondContact O-N 2.9Å; E99-L105 WeakPolarHBondContact O-CD1 3.4Å; E99-S113 PolarHBondContact N-OG 2.69Å; E99-K288 HydrophobicContact CG-CB 4.3Å; E99-K288 PolarHBondContact N-O 3.04Å; E99-K288 VanDerWaalsContact OE1-CD 3.27Å; E99-K288 WeakPolarHBondContact OE1-CD 3.3Å; E99-K288 VanDerWaalsContact OE1-CG 3.27Å; E99-K288 WeakPolarHBondContact OE1-CG 3.22Å; E99-K288 IonicContact OE1-NZ 3.97Å
100	P	60.7	Low	64.9	Low	63 Å²	63	50.3 Å²	50.3	41%	0.409	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.8	-178.1	-18.3	27	0	0	0	114.2	N102 E110 L111	P100-N102 PolarHBondContact O-N 3.36Å; P100-E110 HydrophobicContact CB-CB 4.15Å; P100-E110 WeakPolarHBondContact CD-O 3.16Å; P100-E110 HydrophobicContact CG-CB 4.02Å; P100-L111 HydrophobicContact CG-CD2 4.27Å
101	T	57.3	Low	64.1	Low	114 Å²	114	53.2 Å²	53.2	70%	0.699	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-12.2	177.4	50.6	0	0	0	0	113.6	E99 G103	E99-T101 PolarHBondContact O-N 3.37Å; T101-G103 PolarHBondContact O-N 2.98Å
102	N	55.3	Low	63.7	Low	15 Å²	15	51.1 Å²	51.1	8%	0.08	29%	0.286	C	S	.	.			trans	-81.1	103.5	179.2	-62.7	-10.3	0	0	0	108.6	E99 P100 F104 L105 I135	E99-N102 PolarHBondContact N-ND2 2.91Å; E99-N102 WeakPolarHBondContact O-CB 3.12Å; E99-N102 PolarHBondContact O-N 2.9Å; P100-N102 PolarHBondContact O-N 3.36Å; N102-F104 PolarHBondContact O-N 2.9Å; N102-L105 HydrophobicContact CB-CD1 3.74Å; N102-L105 HydrophobicContact CB-CG 4.03Å; N102-L105 PolarHBondContact O-N 2.77Å; N102-I135 PolarHBondContact OD1-O 2.93Å
103	G	47.4	Very low	63.3	Low	81 Å²	81	51.1 Å²	51.1	84%	0.835	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	10	-174.7	0	0	0	0	0	117.2	T101	T101-G103 PolarHBondContact O-N 2.98Å
104	F	49	Very low	62.9	Low	99 Å²	99	54 Å²	54	43%	0.434	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	3.3	179.4	-71.1	-82.3	0	0	0	113.5	L96 N102 P137 Y139	L96-F104 HydrophobicContact CD2-CB 4.09Å; N102-F104 PolarHBondContact O-N 2.9Å; F104-P137 HydrophobicContact CD2-CG 4.4Å; F104-P137 HydrophobicContact CG-CG 4.42Å; F104-Y139 HydrophobicContact CD1-CE2 4.44Å; F104-Y139 WeakPolarHBondContact CD1-OH 3.15Å; F104-Y139 AromaticContact CE1-CE2 3.87Å; F104-Y139 HydrophobicContact CE1-CE2 3.87Å; F104-Y139 HydrophobicContact CZ-CE2 4.27Å
105	L	48.9	Very low	62.6	Low	31 Å²	31	53.3 Å²	53.3	16%	0.162	30%	0.298	C	S	.	.			trans	-96.5	142.2	-172.5	-65.8	176.3	0	0	0	112.5	L96 G98 E99 N102 E110	L96-L105 HydrophobicContact CB-CD2 4.16Å; L96-L105 HydrophobicContact CD2-CD2 3.89Å; L96-L105 HydrophobicContact CD2-CG 4.48Å; L96-L105 HydrophobicContact CG-CD2 3.77Å; L96-L105 VanDerWaalsContact O-CD2 3.26Å; L96-L105 WeakPolarHBondContact O-CD2 3.5Å; G98-L105 VanDerWaalsContact C-CD1 3.46Å; E99-L105 WeakPolarHBondContact O-CD1 3.4Å; N102-L105 HydrophobicContact CB-CD1 3.74Å; N102-L105 HydrophobicContact CB-CG 4.03Å; N102-L105 PolarHBondContact O-N 2.77Å; L105-E110 HydrophobicContact CB-CG 4.23Å; L105-E110 HydrophobicContact CD1-CG 4.49Å
106	M	46.1	Very low	62.6	Low	99 Å²	99	53 Å²	53	49%	0.488	30%	0.296	S	S	.	.			trans	-109.8	133.2	170.7	-72.3	165.7	113	0	0	109.2	D226	M106-D226 HydrophobicContact CE-CB 4.28Å
107	N	51.1	Low	62.9	Low	112 Å²	112	54.5 Å²	54.5	60%	0.599	30%	0.304	S	S	*	.	S	Bend	trans	83.9	166.1	159.7	-53.4	-40.5	0	0	0	118.2	H109 E110	N107-H109 PolarHBondContact O-N 3.05Å; N107-E110 WeakPolarHBondContact O-CG 3.43Å; N107-E110 PolarHBondContact O-N 2Å; N107-E110 VanDerWaalsContact O-N 3.09Å
108	I	49.7	Very low	63.2	Low	127 Å²	127	57.2 Å²	57.2	65%	0.651	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-42.7	-17	-179.7	-74	168.1	0	0	0	115.6	E110	I108-E110 PolarHBondContact O-N 2.73Å
109	H	53.2	Low	63.8	Low	76 Å²	76	57.3 Å²	57.3	35%	0.352	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-69.4	-8.4	176.1	-53.4	-49.9	0	0	0	114.2	I85 N107 L111 R112	I85-H109 HydrophobicContact CD1-CB 4.24Å; I85-H109 VanDerWaalsContact CD1-ND1 3.27Å; I85-H109 WeakPolarHBondContact CD1-ND1 3.35Å; N107-H109 PolarHBondContact O-N 3.05Å; H109-L111 PolarHBondContact O-N 3.47Å; H109-R112 VanDerWaalsContact O-CB 3.25Å; H109-R112 WeakPolarHBondContact O-CB 3.49Å; H109-R112 PolarHBondContact O-N 2.9Å
110	E	57	Low	65	Low	65 Å²	65	55.8 Å²	55.8	30%	0.304	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-52	-31.8	175.3	-77.8	166.4	-155.3	0	0	114.8	G98 P100 L105 N107 I108 R112	G98-E110 VanDerWaalsContact O-O 3.04Å; P100-E110 HydrophobicContact CB-CB 4.15Å; P100-E110 WeakPolarHBondContact CD-O 3.16Å; P100-E110 HydrophobicContact CG-CB 4.02Å; L105-E110 HydrophobicContact CB-CG 4.23Å; L105-E110 HydrophobicContact CD1-CG 4.49Å; N107-E110 WeakPolarHBondContact O-CG 3.43Å; N107-E110 PolarHBondContact O-N 2Å; N107-E110 VanDerWaalsContact O-N 3.09Å; I108-E110 PolarHBondContact O-N 2.73Å; E110-R112 VanDerWaalsContact C-N 3.31Å; E110-R112 PolarHBondContact O-N 2.85Å
111	L	63.7	Low	66.3	Low	71 Å²	71	53 Å²	53	37%	0.372	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-82.4	-8.8	-178.5	-71.8	168.4	0	0	0	113.3	F77 P100 H109 L114 T115	F77-L111 HydrophobicContact CE2-CD1 4.37Å; P100-L111 HydrophobicContact CG-CD2 4.27Å; H109-L111 PolarHBondContact O-N 3.47Å; L111-L114 PolarHBondContact O-N 2.65Å; L111-T115 HydrophobicContact CB-CG2 4.39Å; L111-T115 VanDerWaalsContact O-CB 3.3Å; L111-T115 WeakPolarHBondContact O-CB 3.18Å; L111-T115 WeakPolarHBondContact O-CG2 3.42Å; L111-T115 PolarHBondContact O-N 3.23Å; L111-T115 PolarHBondContact O-OG1 3.46Å
112	R	69.6	Low	68	Low	1 Å²	1	53 Å²	53	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-67.5	-47.8	-169.8	-167.2	177.3	-166.9	96.9	-8.2	112	A81 G83 I85 H109 E110 L114 T115 C116 I311 C313	A81-R112 PolarHBondContact O-NH1 2.93Å; G83-R112 PolarHBondContact O-NH1 2.82Å; G83-R112 PolarHBondContact O-NH2 2.83Å; I85-R112 VanDerWaalsContact CD1-NH1 3.29Å; H109-R112 VanDerWaalsContact O-CB 3.25Å; H109-R112 WeakPolarHBondContact O-CB 3.49Å; H109-R112 PolarHBondContact O-N 2.9Å; E110-R112 VanDerWaalsContact C-N 3.31Å; E110-R112 PolarHBondContact O-N 2.85Å; R112-L114 VanDerWaalsContact C-N 3.26Å; R112-L114 PolarHBondContact O-N 3.48Å; R112-T115 WeakPolarHBondContact CA-OG1 3.38Å; R112-T115 PolarHBondContact O-N 3.31Å; R112-T115 PolarHBondContact O-OG1 3.49Å; R112-T115 VanDerWaalsContact O-OG1 3.12Å; R112-C116 WeakPolarHBondContact CG-SG 3.31Å; R112-C116 WeakPolarHBondContact O-CB 3.32Å; R112-C116 PolarHBondContact O-N 2.89Å; R112-C116 PolarHBondContact O-SG 3.17Å; R112-I311 PolarHBondContact NH2-O 2.91Å; R112-C313 HydrophobicContact CG-CB 4.13Å; R112-C313 VanDerWaalsContact CZ-CB 3.41Å; R112-C313 VanDerWaalsContact NH2-N 3.15Å
113	S	70.8	Confident	69.7	Low	1 Å²	1	53 Å²	53	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-54.6	-41.7	178.6	56.6	0	0	0	0	112.9	G98 E99 K288	G98-S113 PolarHBondContact O-OG 3.32Å; E99-S113 PolarHBondContact N-OG 2.69Å; S113-K288 WeakPolarHBondContact CB-O 3.03Å; S113-K288 PolarHBondContact OG-O 3.46Å
114	L	73.1	Confident	71.7	Confident	65 Å²	65	52.9 Å²	52.9	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-70.5	-34.8	177.7	-174.9	68.7	0	0	0	112.2	L111 R112 R316	L111-L114 PolarHBondContact O-N 2.65Å; R112-L114 VanDerWaalsContact C-N 3.26Å; R112-L114 PolarHBondContact O-N 3.48Å; L114-R316 PolarHBondContact O-NE 2.53Å
115	T	78.2	Confident	73.5	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-92	-23.3	-169.9	55.1	0	0	0	0	114.7	L82 L111 R112 P315 R316 I319	L82-T115 VanDerWaalsContact CD2-CB 3.48Å; L82-T115 HydrophobicContact CD2-CG2 4.15Å; L82-T115 WeakPolarHBondContact CD2-OG1 3.3Å; L111-T115 HydrophobicContact CB-CG2 4.39Å; L111-T115 VanDerWaalsContact O-CB 3.3Å; L111-T115 WeakPolarHBondContact O-CB 3.18Å; L111-T115 WeakPolarHBondContact O-CG2 3.42Å; L111-T115 PolarHBondContact O-N 3.23Å; L111-T115 PolarHBondContact O-OG1 3.46Å; R112-T115 WeakPolarHBondContact CA-OG1 3.38Å; R112-T115 PolarHBondContact O-N 3.31Å; R112-T115 PolarHBondContact O-OG1 3.49Å; R112-T115 VanDerWaalsContact O-OG1 3.12Å; T115-P315 CarbonylContact O-C 3.59Å; T115-P315 WeakPolarHBondContact O-CA 3.11Å; T115-R316 WeakPolarHBondContact O-CG 3.47Å; T115-R316 PolarHBondContact O-N 2.72Å; T115-I319 HydrophobicContact CG2-CD1 3.43Å; T115-I319 VanDerWaalsContact CG2-CD1 3.43Å; T115-I319 HydrophobicContact CG2-CG1 4.18Å; T115-I319 WeakPolarHBondContact O-CD1 3.28Å
116	C	83.1	Confident	75.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.4	178.5	-53.7	0	0	0	0	111.8	R112 L119 S286 C313 R316	R112-C116 WeakPolarHBondContact CG-SG 3.31Å; R112-C116 WeakPolarHBondContact O-CB 3.32Å; R112-C116 PolarHBondContact O-N 2.89Å; R112-C116 PolarHBondContact O-SG 3.17Å; C116-L119 HydrophobicContact CB-CD2 3.77Å; C116-L119 HydrophobicContact CB-CG 4.38Å; C116-S286 WeakPolarHBondContact O-CB 3.33Å; C116-C313 WeakPolarHBondContact CA-SG 3.25Å; C116-C313 HydrophobicContact CB-CB 4.2Å; C116-C313 WeakPolarHBondContact CB-SG 3.45Å; C116-C313 WeakPolarHBondContact SG-CB 3.41Å; C116-C313 CovalentContact SG-SG 2Å; C116-C313 PolarHBondContact SG-SG 2.98Å; C116-R316 PolarHBondContact O-NE 2.72Å
117	N	85.9	Confident	77.4	Confident	66 Å²	66	53.6 Å²	53.6	35%	0.353	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-52.5	166.3	-168.1	37.5	0	0	0	109.6	S285 S286 Y314 R316	N117-S285 CarbonylContact O-C 3.53Å; N117-S285 WeakPolarHBondContact O-CA 3.47Å; N117-S286 PolarHBondContact O-N 3.26Å; N117-Y314 PolarHBondContact N-O 3.11Å; N117-R316 HydrophobicContact CB-CB 4.41Å; N117-R316 HydrophobicContact CB-CG 3.71Å
118	H	86.4	Confident	79.1	Confident	70 Å²	70	48.6 Å²	48.6	32%	0.324	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.1	177.7	56.3	-79.4	0	0	0	110.5	I283 Y314	H118-I283 VanDerWaalsContact CA-O 3.3Å; H118-I283 WeakPolarHBondContact CA-O 3.25Å; H118-I283 VanDerWaalsContact CB-O 3.3Å; H118-I283 WeakPolarHBondContact CB-O 3.22Å; H118-Y314 VanDerWaalsContact CD2-CB 3.44Å; H118-Y314 WeakPolarHBondContact CD2-CB 2.92Å; H118-Y314 AromaticContact CD2-CD2 3Å; H118-Y314 WeakPolarHBondContact CD2-CD2 3.32Å; H118-Y314 AromaticContact CD2-CE2 3.59Å; H118-Y314 AromaticContact CD2-CG 3.25Å; H118-Y314 WeakPolarHBondContact CE1-CB 3.44Å; H118-Y314 AromaticContact CE1-CD1 3.78Å; H118-Y314 AromaticContact CE1-CG 3.38Å; H118-Y314 AromaticContact CG-CD2 3.84Å; H118-Y314 AromaticContact CG-CG 3.92Å; H118-Y314 VanDerWaalsContact ND1-CB 3.29Å; H118-Y314 WeakPolarHBondContact ND1-CB 3.07Å; H118-Y314 AromaticContact ND1-CG 3.97Å; H118-Y314 WeakPolarHBondContact NE2-CB 3.43Å; H118-Y314 AromaticContact NE2-CD1 3.23Å; H118-Y314 WeakPolarHBondContact NE2-CD1 3.34Å; H118-Y314 AromaticContact NE2-CD2 3.18Å; H118-Y314 WeakPolarHBondContact NE2-CD2 3.33Å; H118-Y314 AromaticContact NE2-CE1 3.78Å; H118-Y314 AromaticContact NE2-CE2 3.73Å; H118-Y314 AromaticContact NE2-CG 2.87Å; H118-Y314 AromaticContact NE2-CZ 3.99Å; H118-Y314 PolarHBondContact O-N 2.91Å
119	L	87.6	Confident	81	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.3	178.4	-64.3	171.4	0	0	0	109.4	C116 I283 S286 Y290 I312 C313	C116-L119 HydrophobicContact CB-CD2 3.77Å; C116-L119 HydrophobicContact CB-CG 4.38Å; L119-I283 HydrophobicContact CB-CB 4.23Å; L119-I283 HydrophobicContact CB-CD1 4.19Å; L119-I283 HydrophobicContact CD1-CD1 4.43Å; L119-I283 PolarHBondContact N-O 2.97Å; L119-I283 PolarHBondContact O-N 2.87Å; L119-S286 WeakPolarHBondContact CD1-OG 3.49Å; L119-Y290 HydrophobicContact CD1-CD1 4.38Å; L119-Y290 HydrophobicContact CD1-CE1 3.7Å; L119-Y290 HydrophobicContact CD1-CE2 4.39Å; L119-I312 WeakPolarHBondContact CA-O 3.36Å; L119-C313 HydrophobicContact CD2-CB 4.39Å
120	E	90	Very high	82.7	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.033	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.6	167.5	178.8	169.8	164.9	0	0	108.7	R122 L280 C281 K282 I312 Y314	E120-R122 HydrophobicContact CG-CG 4.3Å; E120-R122 IonicContact OE1-CZ 3.28Å; E120-R122 IonicContact OE1-NE 2.65Å; E120-R122 PolarHBondContact OE1-NE 2.84Å; E120-R122 IonicContact OE1-NH2 3.9Å; E120-R122 PolarHBondContact OE1-NH2 2.61Å; E120-R122 IonicContact OE2-NH2 3.72Å; E120-L280 HydrophobicContact CG-CD1 3.48Å; E120-L280 VanDerWaalsContact CG-CD1 3.48Å; E120-L280 WeakPolarHBondContact OE1-CD1 3.48Å; E120-C281 CarbonylContact C-O 3.59Å; E120-C281 WeakPolarHBondContact CA-O 3.38Å; E120-K282 HydrophobicContact CB-CG 4.5Å; E120-K282 HydrophobicContact CG-CG 4.14Å; E120-K282 WeakPolarHBondContact OE2-CE 3.32Å; E120-I312 HydrophobicContact CB-CB 4.18Å; E120-I312 PolarHBondContact N-O 3Å; E120-I312 PolarHBondContact O-N 3.42Å; E120-Y314 HydrophobicContact CB-CE2 3.99Å; E120-Y314 PolarHBondContact OE2-OH 3.25Å
121	I	89.7	Confident	84.1	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.1	-177.8	-59.1	175.9	0	0	0	106.6	V130 C281 I283 I292 V309 I311	I121-V130 HydrophobicContact CD1-CB 4.36Å; I121-V130 HydrophobicContact CD1-CG1 4.08Å; I121-V130 HydrophobicContact CD1-CG2 3.67Å; I121-V130 HydrophobicContact CG2-CG2 4.49Å; I121-C281 HydrophobicContact CB-CB 4.4Å; I121-C281 PolarHBondContact N-O 2.89Å; I121-C281 PolarHBondContact O-N 2.68Å; I121-I283 HydrophobicContact CD1-CD1 3.73Å; I121-I283 HydrophobicContact CG1-CD1 4.45Å; I121-I292 HydrophobicContact CD1-CD1 4.4Å; I121-V309 HydrophobicContact CG2-CG1 3.66Å; I121-I311 HydrophobicContact CG1-CG2 4.42Å
122	R	92.1	Very high	85.2	Confident	115 Å²	115	38.8 Å²	38.8	43%	0.434	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	141.4	176.4	-67	176.3	-175.3	-175.7	3.4	108.4	E120 T279 L280 V309 H310	E120-R122 HydrophobicContact CG-CG 4.3Å; E120-R122 IonicContact OE1-CZ 3.28Å; E120-R122 IonicContact OE1-NE 2.65Å; E120-R122 PolarHBondContact OE1-NE 2.84Å; E120-R122 IonicContact OE1-NH2 3.9Å; E120-R122 PolarHBondContact OE1-NH2 2.61Å; E120-R122 IonicContact OE2-NH2 3.72Å; R122-T279 CarbonylContact C-O 3.54Å; R122-T279 WeakPolarHBondContact CA-O 3.41Å; R122-L280 HydrophobicContact CG-CD1 3.52Å; R122-V309 CarbonylContact O-C 3.54Å; R122-V309 WeakPolarHBondContact O-CA 3.42Å; R122-H310 HydrophobicContact CB-CB 4.21Å; R122-H310 PolarHBondContact N-O 2.86Å; R122-H310 PolarHBondContact O-N 3.16Å
123	S	91.3	Very high	85.5	Confident	15 Å²	15	39.2 Å²	39.2	11%	0.105	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.1	169.7	-174.1	0	0	0	0	110.1	K125 I128 T279 N308	S123-K125 VanDerWaalsContact CB-O 3.24Å; S123-K125 WeakPolarHBondContact CB-O 3.35Å; S123-K125 PolarHBondContact OG-N 3.49Å; S123-K125 VanDerWaalsContact OG-N 3.07Å; S123-K125 PolarHBondContact OG-O 3.4Å; S123-K125 VanDerWaalsContact OG-O 3.07Å; S123-I128 WeakPolarHBondContact OG-CG1 3.06Å; S123-T279 PolarHBondContact N-O 2.78Å; S123-T279 VanDerWaalsContact O-CB 3.26Å; S123-T279 WeakPolarHBondContact O-CB 3.33Å; S123-N308 VanDerWaalsContact CA-O 3.31Å; S123-N308 WeakPolarHBondContact CA-O 3.43Å; S123-N308 PolarHBondContact OG-O 3.37Å
124	N	90.2	Very high	85.2	Confident	79 Å²	79	42.7 Å²	42.7	42%	0.422	21%	0.208	S	C	.	.	S	Bend	trans	-78.6	-5.9	165.7	67	-21	0	0	0	112.7	A307 N308	N124-A307 WeakPolarHBondContact OD1-CA 3.31Å; N124-N308 PolarHBondContact N-O 3.42Å; N124-N308 VanDerWaalsContact N-O 3.12Å; N124-N308 PolarHBondContact OD1-N 2.76Å; N124-N308 PolarHBondContact OD1-O 2.95Å
125	K	86.7	Confident	84.7	Confident	90 Å²	90	46 Å²	46	39%	0.391	22%	0.224	S	C	.	.	S	Bend	trans	-134.3	160.4	-177.1	-65.1	-67.7	-174.1	170.9	0	111.6	S123 A307	S123-K125 VanDerWaalsContact CB-O 3.24Å; S123-K125 WeakPolarHBondContact CB-O 3.35Å; S123-K125 PolarHBondContact OG-N 3.49Å; S123-K125 VanDerWaalsContact OG-N 3.07Å; S123-K125 PolarHBondContact OG-O 3.4Å; S123-K125 VanDerWaalsContact OG-O 3.07Å; K125-A307 HydrophobicContact CB-CB 3.95Å; K125-A307 HydrophobicContact CG-CB 4.18Å
126	L	88.3	Confident	84.1	Confident	79 Å²	79	49 Å²	49	41%	0.414	25%	0.245	S	C	.	.	S	Bend	trans	-80.3	179.5	170.4	-62.8	175.5	0	0	0	110.6	I128 G275 T279 Y294	L126-I128 VanDerWaalsContact C-N 3.27Å; L126-I128 PolarHBondContact O-N 3.36Å; L126-G275 CarbonylContact C-O 3.56Å; L126-G275 VanDerWaalsContact CA-O 3.27Å; L126-G275 WeakPolarHBondContact CA-O 3.44Å; L126-G275 WeakPolarHBondContact CB-O 3Å; L126-T279 HydrophobicContact CD2-CG2 3.86Å; L126-T279 HydrophobicContact CG-CG2 4.49Å; L126-Y294 WeakPolarHBondContact O-CE2 3.44Å
127	K	87.3	Confident	83.4	Confident	75 Å²	75	49.6 Å²	49.6	33%	0.326	25%	0.249	S	C	.	.			trans	70.4	12.4	176.9	-54.5	-174.5	170.4	-163.5	0	115.2	G275 Y294 T295 E297	K127-G275 PolarHBondContact N-O 2.84Å; K127-Y294 HydrophobicContact CB-CD2 4.33Å; K127-Y294 HydrophobicContact CB-CE2 4.03Å; K127-T295 WeakPolarHBondContact CB-OG1 3.46Å; K127-T295 WeakPolarHBondContact O-CB 3.2Å; K127-T295 PolarHBondContact O-N 3.17Å; K127-T295 PolarHBondContact O-OG1 3.24Å; K127-E297 IonicContact NZ-OE1 3.82Å; K127-E297 PolarHBondContact NZ-OE1 2.89Å
128	I	87.9	Confident	82.8	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	119.4	167.5	-59.6	-58.7	0	0	0	109.4	L89 S123 L126 G275 I292 D293 Y294 A307 V309	L89-I128 HydrophobicContact CD1-CD1 4.34Å; S123-I128 WeakPolarHBondContact OG-CG1 3.06Å; L126-I128 VanDerWaalsContact C-N 3.27Å; L126-I128 PolarHBondContact O-N 3.36Å; I128-G275 WeakPolarHBondContact O-CA 3.43Å; I128-G275 PolarHBondContact O-N 2.8Å; I128-I292 HydrophobicContact CG2-CG2 3.76Å; I128-D293 CarbonylContact C-O 3.6Å; I128-D293 WeakPolarHBondContact CA-O 3.45Å; I128-Y294 HydrophobicContact CD1-CD2 3.56Å; I128-Y294 HydrophobicContact CD1-CE2 4.33Å; I128-Y294 HydrophobicContact CD1-CG 3.68Å; I128-A307 HydrophobicContact CD1-CB 3.81Å; I128-A307 HydrophobicContact CG1-CB 4.45Å; I128-V309 HydrophobicContact CD1-CG2 3.87Å; I128-V309 HydrophobicContact CG1-CG2 4.09Å; I128-V309 HydrophobicContact CG2-CG2 4.39Å
129	R	88.9	Confident	82.3	Confident	75 Å²	75	51.7 Å²	51.7	28%	0.283	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	147.6	173.8	-67.3	-165.3	179.6	151.3	-4.5	111.1	C273 D274 I292 D293 T295	R129-C273 CarbonylContact C-O 3.41Å; R129-C273 WeakPolarHBondContact CA-O 3.24Å; R129-D274 WeakPolarHBondContact CG-OD1 3.23Å; R129-D274 IonicContact CZ-OD1 3.94Å; R129-D274 IonicContact NE-OD1 3.07Å; R129-D274 PolarHBondContact NE-OD1 3.19Å; R129-D274 IonicContact NE-OD2 3.73Å; R129-D274 IonicContact NH2-OD1 2.69Å; R129-D274 IonicContact NH2-OD2 2.63Å; R129-I292 WeakPolarHBondContact O-CA 3.41Å; R129-D293 PolarHBondContact N-O 2.83Å; R129-D293 PolarHBondContact O-N 3.43Å; R129-T295 HydrophobicContact CB-CG2 3.9Å; R129-T295 HydrophobicContact CG-CG2 3.62Å
130	V	88.6	Confident	81.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.6	175.1	-166.4	0	0	0	0	109.5	I121 I272 C273 Y290 I291 I292	I121-V130 HydrophobicContact CD1-CB 4.36Å; I121-V130 HydrophobicContact CD1-CG1 4.08Å; I121-V130 HydrophobicContact CD1-CG2 3.67Å; I121-V130 HydrophobicContact CG2-CG2 4.49Å; V130-I272 HydrophobicContact CB-CG1 4.13Å; V130-I272 HydrophobicContact CG1-CD1 3.96Å; V130-I272 HydrophobicContact CG1-CG1 4.04Å; V130-I272 VanDerWaalsContact O-CG1 3.25Å; V130-I272 WeakPolarHBondContact O-CG1 3.17Å; V130-I272 PolarHBondContact O-N 3.01Å; V130-C273 HydrophobicContact CB-CB 3.56Å; V130-C273 HydrophobicContact CG2-CB 3.66Å; V130-C273 PolarHBondContact N-O 3.47Å; V130-C273 PolarHBondContact O-N 3.37Å; V130-Y290 HydrophobicContact CG1-CD2 3.67Å; V130-Y290 HydrophobicContact CG1-CE2 4.5Å; V130-Y290 HydrophobicContact CG1-CG 4.31Å; V130-I291 VanDerWaalsContact CA-O 3.29Å; V130-I291 WeakPolarHBondContact CA-O 3.04Å; V130-I292 HydrophobicContact CG1-CG1 4.2Å; V130-I292 HydrophobicContact CG2-CG1 4.16Å; V130-I292 HydrophobicContact CG2-CG2 4.48Å
131	W	86.7	Confident	81.1	Confident	30 Å²	30	56.5 Å²	56.5	11%	0.114	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.9	-176.6	-52.3	87.8	0	0	0	109.5	W263 P265 V271 Y290 I291	W131-W263 HydrophobicContact CB-CH2 3.39Å; W131-W263 HydrophobicContact CB-CZ2 4.33Å; W131-W263 HydrophobicContact CB-CZ3 3.66Å; W131-W263 AromaticContact CD1-CZ3 3.59Å; W131-W263 AromaticContact CD2-CH2 3.7Å; W131-W263 HydrophobicContact CD2-CH2 3.7Å; W131-W263 AromaticContact CD2-CZ3 3.5Å; W131-W263 HydrophobicContact CD2-CZ3 3.5Å; W131-W263 VanDerWaalsContact CD2-CZ3 3.5Å; W131-W263 AromaticContact CE2-CZ3 3.92Å; W131-W263 AromaticContact CE3-CH2 3.84Å; W131-W263 HydrophobicContact CE3-CH2 3.84Å; W131-W263 HydrophobicContact CE3-CZ3 4.02Å; W131-W263 HydrophobicContact CG-CE3 4.42Å; W131-W263 AromaticContact CG-CH2 3.52Å; W131-W263 HydrophobicContact CG-CH2 3.52Å; W131-W263 AromaticContact CG-CZ3 3.31Å; W131-W263 HydrophobicContact CG-CZ3 3.31Å; W131-W263 AromaticContact NE1-CZ3 3.92Å; W131-P265 HydrophobicContact CD2-CB 4.46Å; W131-P265 HydrophobicContact CE3-CB 3.81Å; W131-P265 HydrophobicContact CH2-CB 4.11Å; W131-P265 HydrophobicContact CH2-CG 3.97Å; W131-P265 HydrophobicContact CZ2-CG 4.46Å; W131-P265 HydrophobicContact CZ3-CB 3.6Å; W131-P265 HydrophobicContact CZ3-CG 3.98Å; W131-V271 HydrophobicContact CD2-CG2 4.01Å; W131-V271 HydrophobicContact CE3-CB 4.48Å; W131-V271 HydrophobicContact CE3-CG2 3.43Å; W131-V271 VanDerWaalsContact CE3-CG2 3.43Å; W131-V271 HydrophobicContact CH2-CG2 3.53Å; W131-V271 HydrophobicContact CZ2-CG2 4.1Å; W131-V271 HydrophobicContact CZ3-CG2 3.17Å; W131-Y290 CarbonylContact O-C 3.56Å; W131-Y290 WeakPolarHBondContact O-CA 3.17Å; W131-Y290 WeakPolarHBondContact O-CB 3.22Å; W131-I291 HydrophobicContact CB-CB 4.5Å; W131-I291 PolarHBondContact N-O 2.97Å; W131-I291 PolarHBondContact O-N 3.37Å
132	T	86.2	Confident	80.5	Confident	28 Å²	28	61 Å²	61	17%	0.172	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	144.5	162.6	62	0	0	0	0	109.5	D269 P270 I272 P287	T132-D269 WeakPolarHBondContact O-CB 3.3Å; T132-P270 HydrophobicContact CG2-CG 4.5Å; T132-P270 PolarHBondContact N-O 3.32Å; T132-P270 VanDerWaalsContact N-O 3.1Å; T132-P270 WeakPolarHBondContact OG1-CD 3.46Å; T132-P270 WeakPolarHBondContact OG1-CG 3.32Å; T132-I272 HydrophobicContact CG2-CB 4.35Å; T132-I272 HydrophobicContact CG2-CD1 3.82Å; T132-I272 HydrophobicContact CG2-CG1 4.1Å; T132-I272 HydrophobicContact CG2-CG2 3.42Å; T132-I272 VanDerWaalsContact CG2-CG2 3.42Å; T132-P287 HydrophobicContact CG2-CB 3.77Å; T132-P287 HydrophobicContact CG2-CG 4.07Å
133	T	77.1	Confident	79.8	Confident	10 Å²	10	58.1 Å²	58.1	6%	0.061	30%	0.304	C	S	.	.			trans	-135	139.4	177.8	170.3	0	0	0	0	110.6	L96 S289 I291	L96-T133 HydrophobicContact CD1-CG2 3.59Å; T133-S289 PolarHBondContact N-O 2.88Å; T133-S289 VanDerWaalsContact N-O 3.16Å; T133-S289 PolarHBondContact O-OG 3.47Å; T133-I291 HydrophobicContact CG2-CD1 3.99Å; T133-I291 HydrophobicContact CG2-CG1 3.97Å
134	P	64.1	Low	79.2	Confident	75 Å²	75	62.2 Å²	62.2	49%	0.487	32%	0.324	S	S	.	.			trans	-85.5	122	170.9	31	-30.9	0	0	0	111.3	S136 D269	P134-S136 VanDerWaalsContact C-N 3.26Å; P134-S136 PolarHBondContact O-N 3.32Å; P134-D269 WeakPolarHBondContact CD-OD1 3.4Å
135	I	63.4	Low	78.7	Confident	135 Å²	135	59.1 Å²	59.1	69%	0.692	31%	0.307	S	S	*	.	S	Bend	trans	65	-59.4	160.3	-50.4	172.4	0	0	0	115.9	N102	N102-I135 PolarHBondContact OD1-O 2.93Å
136	S	65.5	Low	78.4	Confident	67 Å²	67	56 Å²	56	47%	0.469	30%	0.296	S	S	.	.	S	Bend	trans	-140.9	133.8	-177.3	60.7	0	0	0	0	111.6	P134 H138	P134-S136 VanDerWaalsContact C-N 3.26Å; P134-S136 PolarHBondContact O-N 3.32Å; S136-H138 PolarHBondContact O-N 3.04Å
137	P	67.9	Low	78.2	Confident	13 Å²	13	52.9 Å²	52.9	8%	0.084	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-63.8	125.8	175.2	27	-33.2	0	0	0	110.6	L96 F104 Y139 W263 I291	L96-P137 HydrophobicContact CD2-CG 4.14Å; F104-P137 HydrophobicContact CD2-CG 4.4Å; F104-P137 HydrophobicContact CG-CG 4.42Å; P137-Y139 HydrophobicContact CG-CE2 4.29Å; P137-Y139 PolarHBondContact O-N 3.41Å; P137-W263 HydrophobicContact CB-CB 4.2Å; P137-W263 HydrophobicContact CB-CG 4.03Å; P137-I291 HydrophobicContact CB-CD1 4.25Å
138	H	73.8	Confident	78.1	Confident	108 Å²	108	49.8 Å²	49.8	50%	0.5	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-72.8	116.5	164.7	-177.9	62.3	0	0	0	109.2	S136 G140 W263 A264	S136-H138 PolarHBondContact O-N 3.04Å; H138-G140 PolarHBondContact O-N 3.31Å; H138-W263 CarbonylContact O-C 3.46Å; H138-W263 VanDerWaalsContact O-CA 3.29Å; H138-W263 WeakPolarHBondContact O-CA 3.23Å; H138-W263 VanDerWaalsContact O-CD1 3.27Å; H138-A264 PolarHBondContact O-N 2.91Å
139	Y	74.9	Confident	78	Confident	72 Å²	72	50 Å²	50	28%	0.282	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-77.4	118.7	174.2	-68.1	-81.5	0	0	0	109.5	F104 P137 N163 R262	F104-Y139 HydrophobicContact CD1-CE2 4.44Å; F104-Y139 WeakPolarHBondContact CD1-OH 3.15Å; F104-Y139 AromaticContact CE1-CE2 3.87Å; F104-Y139 HydrophobicContact CE1-CE2 3.87Å; F104-Y139 HydrophobicContact CZ-CE2 4.27Å; P137-Y139 HydrophobicContact CG-CE2 4.29Å; P137-Y139 PolarHBondContact O-N 3.41Å; Y139-N163 HydrophobicContact CE1-CB 4.38Å; Y139-R262 CarbonylContact C-O 3.32Å; Y139-R262 WeakPolarHBondContact CA-O 2.95Å
140	G	75.8	Confident	77.9	Confident	14 Å²	14	53.6 Å²	53.6	14%	0.144	28%	0.282	C	S	.	.			trans	-75	-175.1	173.2	0	0	0	0	0	113.2	H138 R262	H138-G140 PolarHBondContact O-N 3.31Å; G140-R262 PolarHBondContact N-O 3.24Å
141	P	76.2	Confident	77.8	Confident	97 Å²	97	59.4 Å²	59.4	63%	0.63	31%	0.313	S	S	*	.			trans	-63.4	155	179.9	28.5	-35.4	0	0	0	111.8	Q143	P141-Q143 PolarHBondContact O-N 3.1Å; P141-Q143 VanDerWaalsContact O-N 3.14Å
142	L	77.6	Confident	77.7	Confident	97 Å²	97	61.3 Å²	61.3	51%	0.508	32%	0.32	S	S	.	.			trans	-58.3	115.9	169.7	-73.3	167	0	0	0	109.2	F259 T261	L142-F259 HydrophobicContact CD2-CB 4.5Å; L142-T261 HydrophobicContact CD2-CG2 3.35Å; L142-T261 HydrophobicContact CG-CG2 4.13Å
143	Q	77.3	Confident	77.8	Confident	56 Å²	56	64 Å²	64	26%	0.262	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	136.9	173.9	-68	-170.4	19.4	0	0	109.5	P141 Y145 R260	P141-Q143 PolarHBondContact O-N 3.1Å; P141-Q143 VanDerWaalsContact O-N 3.14Å; Q143-Y145 HydrophobicContact CB-CD2 4.44Å; Q143-Y145 HydrophobicContact CB-CE1 4.09Å; Q143-Y145 HydrophobicContact CB-CE2 3.48Å; Q143-Y145 VanDerWaalsContact CB-CE2 3.48Å; Q143-Y145 WeakPolarHBondContact CB-OH 3.37Å; Q143-Y145 WeakPolarHBondContact O-CD2 3.09Å; Q143-Y145 VanDerWaalsContact O-CE2 3.27Å; Q143-Y145 WeakPolarHBondContact O-CE2 3.3Å; Q143-Y145 PolarHBondContact OE1-OH 2.83Å; Q143-R260 PolarHBondContact N-O 2.99Å; Q143-R260 PolarHBondContact O-N 2.85Å
144	N	78.3	Confident	78	Confident	101 Å²	101	64.9 Å²	64.9	54%	0.54	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128	-179	-58.1	-5.5	0	0	0	109.2	F259	N144-F259 HydrophobicContact CB-CD1 4.49Å; N144-F259 HydrophobicContact CB-CE1 4.45Å; N144-F259 WeakPolarHBondContact OD1-CD1 3.32Å; N144-F259 WeakPolarHBondContact OD1-CE1 3.06Å
145	Y	79.3	Confident	79.1	Confident	13 Å²	13	64.9 Å²	64.9	5%	0.051	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	157.9	175	-44.6	-81.6	0	0	0	109.2	Q143 D257 L258 R260 R262 V296	Q143-Y145 HydrophobicContact CB-CD2 4.44Å; Q143-Y145 HydrophobicContact CB-CE1 4.09Å; Q143-Y145 HydrophobicContact CB-CE2 3.48Å; Q143-Y145 VanDerWaalsContact CB-CE2 3.48Å; Q143-Y145 WeakPolarHBondContact CB-OH 3.37Å; Q143-Y145 WeakPolarHBondContact O-CD2 3.09Å; Q143-Y145 VanDerWaalsContact O-CE2 3.27Å; Q143-Y145 WeakPolarHBondContact O-CE2 3.3Å; Q143-Y145 PolarHBondContact OE1-OH 2.83Å; Y145-D257 CarbonylContact O-C 3.6Å; Y145-D257 VanDerWaalsContact O-CA 3.31Å; Y145-D257 WeakPolarHBondContact O-CA 3.42Å; Y145-L258 PolarHBondContact N-O 2.71Å; Y145-L258 PolarHBondContact O-N 2.85Å; Y145-R260 HydrophobicContact CD2-CB 4.25Å; Y145-R260 HydrophobicContact CD2-CG 3.91Å; Y145-R260 HydrophobicContact CE2-CB 3.9Å; Y145-R260 HydrophobicContact CE2-CG 4.05Å; Y145-R262 WeakPolarHBondContact OH-CD 3.42Å; Y145-V296 HydrophobicContact CE1-CB 4.46Å
146	S	82	Confident	80.2	Confident	25 Å²	25	59.7 Å²	59.7	18%	0.175	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	126.5	173.3	-49.2	0	0	0	0	108.9	V148 I256 D257	S146-V148 PolarHBondContact O-N 2.84Å; S146-I256 CarbonylContact C-O 3.42Å; S146-I256 WeakPolarHBondContact CA-O 3.5Å; S146-D257 WeakPolarHBondContact CB-OD1 3.49Å; S146-D257 PolarHBondContact OG-OD1 3.07Å
147	L	83.1	Confident	81.3	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.068	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	113.2	163.8	-56.7	178.5	0	0	0	107.9	T158 L160 I256 L258 L304	L147-T158 HydrophobicContact CD1-CG2 4.35Å; L147-L160 HydrophobicContact CD1-CD1 3.62Å; L147-L160 HydrophobicContact CD1-CD2 3.67Å; L147-L160 HydrophobicContact CD1-CG 4.17Å; L147-L160 HydrophobicContact CD2-CD2 4.41Å; L147-I256 HydrophobicContact CB-CB 4.2Å; L147-I256 HydrophobicContact CD1-CB 4.49Å; L147-I256 PolarHBondContact N-O 2.76Å; L147-I256 PolarHBondContact O-N 2.92Å; L147-L258 HydrophobicContact CD1-CD1 3.98Å; L147-L258 HydrophobicContact CD2-CD1 4.13Å; L147-L258 HydrophobicContact CG-CD1 3.8Å; L147-L258 HydrophobicContact CG-CG 4.42Å; L147-L304 HydrophobicContact CD1-CD1 4.37Å; L147-L304 HydrophobicContact CD2-CD1 3.69Å
148	V	85.5	Confident	82.2	Confident	11 Å²	11	60.5 Å²	60.5	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	111.5	178.8	-168.5	0	0	0	0	109.1	S146 R150 Y255 A301	S146-V148 PolarHBondContact O-N 2.84Å; V148-R150 HydrophobicContact CG1-CG 3.77Å; V148-Y255 HydrophobicContact CB-CD1 4.42Å; V148-Y255 HydrophobicContact CB-CE1 4.25Å; V148-Y255 HydrophobicContact CG1-CD1 4.16Å; V148-Y255 HydrophobicContact CG1-CE1 3.61Å; V148-Y255 HydrophobicContact CG2-CD1 4.01Å; V148-Y255 HydrophobicContact CG2-CE1 3.85Å; V148-A301 HydrophobicContact CG2-CB 4.22Å
149	I	86.2	Confident	82.8	Confident	9 Å²	9	57.6 Å²	57.6	5%	0.046	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.2	176.1	-60.6	154.8	0	0	0	107	W152 F173 M232 S253 G254 I256	I149-W152 HydrophobicContact CG2-CB 3.68Å; I149-W152 HydrophobicContact CG2-CD2 3.76Å; I149-W152 HydrophobicContact CG2-CE3 4.02Å; I149-W152 HydrophobicContact CG2-CG 3.55Å; I149-F173 HydrophobicContact CD1-CE1 3.84Å; I149-F173 HydrophobicContact CD1-CZ 3.73Å; I149-M232 HydrophobicContact CD1-CE 4.44Å; I149-M232 HydrophobicContact CD1-SD 3.28Å; I149-M232 WeakPolarHBondContact CD1-SD 3.21Å; I149-M232 HydrophobicContact CG1-SD 4.15Å; I149-S253 CarbonylContact O-C 3.56Å; I149-S253 WeakPolarHBondContact O-CA 3.4Å; I149-G254 WeakPolarHBondContact CB-O 3.41Å; I149-G254 PolarHBondContact N-O 3.05Å; I149-G254 PolarHBondContact O-N 3.4Å; I149-I256 HydrophobicContact CD1-CD1 3.67Å; I149-I256 HydrophobicContact CD1-CG1 3.86Å
150	R	86.7	Confident	83.3	Confident	152 Å²	152	54.2 Å²	54.2	57%	0.574	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	109.9	-179.6	-61.2	-173	179.1	178.8	1	110.1	V148 W152	V148-R150 HydrophobicContact CG1-CG 3.77Å; R150-W152 VanDerWaalsContact C-N 3.32Å; R150-W152 VanDerWaalsContact O-CD1 3.26Å; R150-W152 PolarHBondContact O-N 3.2Å
151	N	86.6	Confident	83.7	Confident	122 Å²	122	57.2 Å²	57.2	65%	0.652	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.8	46.5	174.4	-57.5	-29.5	0	0	0	113.2	V251 G252 S253	N151-V251 HydrophobicContact CB-CG1 3.65Å; N151-V251 WeakPolarHBondContact O-CG1 3.33Å; N151-G252 WeakPolarHBondContact CA-O 3.29Å; N151-G252 PolarHBondContact N-O 2.72Å; N151-S253 PolarHBondContact N-OG 2.76Å; N151-S253 PolarHBondContact OD1-OG 2.83Å; N151-S253 VanDerWaalsContact OD1-OG 3.05Å
152	W	85.2	Confident	84.1	Confident	70 Å²	70	52.7 Å²	52.7	27%	0.265	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	138.2	177.4	-79.1	18.4	0	0	0	111.4	I149 R150 T156 M232 V251 G252 L304	I149-W152 HydrophobicContact CG2-CB 3.68Å; I149-W152 HydrophobicContact CG2-CD2 3.76Å; I149-W152 HydrophobicContact CG2-CE3 4.02Å; I149-W152 HydrophobicContact CG2-CG 3.55Å; R150-W152 VanDerWaalsContact C-N 3.32Å; R150-W152 VanDerWaalsContact O-CD1 3.26Å; R150-W152 PolarHBondContact O-N 3.2Å; W152-T156 HydrophobicContact CB-CG2 4.26Å; W152-T156 HydrophobicContact CD2-CG2 4.45Å; W152-T156 HydrophobicContact CE3-CG2 3.46Å; W152-T156 VanDerWaalsContact CE3-CG2 3.46Å; W152-T156 HydrophobicContact CZ3-CG2 4.07Å; W152-T156 WeakPolarHBondContact CZ3-OG1 3.45Å; W152-M232 HydrophobicContact CE3-CE 4.13Å; W152-M232 HydrophobicContact CZ3-CE 3.92Å; W152-V251 CarbonylContact O-C 3.53Å; W152-V251 VanDerWaalsContact O-CA 3.26Å; W152-V251 WeakPolarHBondContact O-CA 3.25Å; W152-G252 PolarHBondContact N-O 2.95Å; W152-G252 PolarHBondContact O-N 3.05Å; W152-L304 HydrophobicContact CH2-CD2 3.06Å; W152-L304 HydrophobicContact CH2-CG 4.46Å; W152-L304 HydrophobicContact CZ2-CB 4.42Å; W152-L304 HydrophobicContact CZ2-CD2 3.4Å; W152-L304 HydrophobicContact CZ3-CD2 4.14Å
153	S	86.8	Confident	84.4	Confident	84 Å²	84	49.3 Å²	49.3	59%	0.587	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	136.2	172.8	52.1	0	0	0	0	111.1	P155 T156 T250	S153-P155 CarbonylContact O-C 3.53Å; S153-T156 WeakPolarHBondContact O-CB 3.45Å; S153-T250 CarbonylContact C-O 3.53Å; S153-T250 WeakPolarHBondContact CA-O 3.48Å
154	L	82.1	Confident	84.7	Confident	29 Å²	29	49.7 Å²	49.7	15%	0.152	26%	0.256	C	S	.	.	S	Bend	trans	-107.1	136.1	177.9	-60.6	-177.7	0	0	0	110	T156 M232 T234 T250	L154-T156 HydrophobicContact CD2-CG2 3.57Å; L154-M232 HydrophobicContact CD2-CB 3.93Å; L154-T234 HydrophobicContact CD1-CG2 3.85Å; L154-T250 PolarHBondContact N-O 3.48Å
155	P	86.3	Confident	85	Confident	75 Å²	75	46.4 Å²	46.4	49%	0.487	25%	0.247	S	C	.	.	S	Bend	cis	-74.8	145.2	1.9	33.2	-36.8	0	0	0	113.1	S153 M232 R233	S153-P155 CarbonylContact O-C 3.53Å; P155-M232 VanDerWaalsContact CA-O 3.31Å; P155-M232 WeakPolarHBondContact CA-O 3.31Å; P155-R233 HydrophobicContact CB-CG 4.07Å
156	T	88.2	Confident	85.4	Confident	26 Å²	26	45.8 Å²	45.8	16%	0.16	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	163.4	172.2	-178.3	0	0	0	0	109.1	W152 S153 L154 I231 M232	W152-T156 HydrophobicContact CB-CG2 4.26Å; W152-T156 HydrophobicContact CD2-CG2 4.45Å; W152-T156 HydrophobicContact CE3-CG2 3.46Å; W152-T156 VanDerWaalsContact CE3-CG2 3.46Å; W152-T156 HydrophobicContact CZ3-CG2 4.07Å; W152-T156 WeakPolarHBondContact CZ3-OG1 3.45Å; S153-T156 WeakPolarHBondContact O-CB 3.45Å; L154-T156 HydrophobicContact CD2-CG2 3.57Å; T156-I231 CarbonylContact O-C 3.38Å; T156-M232 HydrophobicContact CG2-CB 3.99Å; T156-M232 HydrophobicContact CG2-CE 3.77Å; T156-M232 HydrophobicContact CG2-SD 4.11Å; T156-M232 PolarHBondContact N-O 2.78Å; T156-M232 PolarHBondContact O-N 2.87Å
157	F	88.7	Confident	85.9	Confident	83 Å²	83	44.9 Å²	44.9	36%	0.364	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	156.4	177.3	63.5	-87.1	0	0	0	111.4	H159 M188 W191 T229 L230 I231	F157-H159 AromaticContact CD2-CE1 3.69Å; F157-H159 AromaticContact CD2-NE2 3.3Å; F157-H159 VanDerWaalsContact CD2-NE2 3.3Å; F157-H159 WeakPolarHBondContact CD2-NE2 3.25Å; F157-H159 AromaticContact CE2-CE1 3.93Å; F157-H159 AromaticContact CE2-NE2 3.22Å; F157-H159 WeakPolarHBondContact CE2-NE2 3.18Å; F157-M188 HydrophobicContact CE2-CE 4.41Å; F157-W191 AromaticContact CD1-CH2 3.98Å; F157-W191 HydrophobicContact CD1-CH2 3.98Å; F157-W191 HydrophobicContact CD1-CZ3 4.06Å; F157-W191 HydrophobicContact CE1-CH2 4.35Å; F157-W191 HydrophobicContact CE1-CZ3 4.17Å; F157-T229 HydrophobicContact CB-CG2 4.33Å; F157-T229 HydrophobicContact CD2-CG2 4.38Å; F157-L230 CarbonylContact C-O 3.54Å; F157-L230 WeakPolarHBondContact CA-O 3.02Å; F157-L230 WeakPolarHBondContact CB-O 3.14Å; F157-I231 HydrophobicContact CB-CB 4.46Å; F157-I231 HydrophobicContact CB-CG1 4Å
158	T	86.1	Confident	86.2	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.08	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.1	172.2	-171.5	0	0	0	0	109.9	L147 T229 L230 M232	L147-T158 HydrophobicContact CD1-CG2 4.35Å; T158-T229 WeakPolarHBondContact O-CA 3.25Å; T158-L230 HydrophobicContact CG2-CB 4.06Å; T158-L230 PolarHBondContact N-O 3.29Å; T158-L230 PolarHBondContact O-N 2.92Å; T158-M232 HydrophobicContact CG2-CE 4.14Å
159	H	85.7	Confident	86.4	Confident	47 Å²	47	45 Å²	45	22%	0.218	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.9	178	-56.2	-68.7	0	0	0	109.5	T90 F157 M188 V227 Y228 T229	T90-H159 WeakPolarHBondContact CG2-O 3.4Å; F157-H159 AromaticContact CD2-CE1 3.69Å; F157-H159 AromaticContact CD2-NE2 3.3Å; F157-H159 VanDerWaalsContact CD2-NE2 3.3Å; F157-H159 WeakPolarHBondContact CD2-NE2 3.25Å; F157-H159 AromaticContact CE2-CE1 3.93Å; F157-H159 AromaticContact CE2-NE2 3.22Å; F157-H159 WeakPolarHBondContact CE2-NE2 3.18Å; H159-M188 WeakPolarHBondContact CE1-CE 3.35Å; H159-M188 PolarHBondContact CE1-SD 3.43Å; H159-M188 WeakPolarHBondContact NE2-CE 3.47Å; H159-V227 HydrophobicContact CB-CG1 4.18Å; H159-Y228 WeakPolarHBondContact CA-O 3.22Å; H159-T229 WeakPolarHBondContact CE1-CG2 3.5Å; H159-T229 PolarHBondContact CE1-OG1 2.91Å; H159-T229 VanDerWaalsContact CE1-OG1 3.25Å; H159-T229 PolarHBondContact ND1-OG1 3.47Å
160	L	85.4	Confident	86.5	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.9	178.3	-56.1	171.3	0	0	0	108.3	T90 L147 L162 Y228 L230 L258	T90-L160 HydrophobicContact CG2-CD2 4.41Å; L147-L160 HydrophobicContact CD1-CD1 3.62Å; L147-L160 HydrophobicContact CD1-CD2 3.67Å; L147-L160 HydrophobicContact CD1-CG 4.17Å; L147-L160 HydrophobicContact CD2-CD2 4.41Å; L160-L162 HydrophobicContact CB-CD1 4.41Å; L160-L162 HydrophobicContact CB-CD2 3.93Å; L160-L162 HydrophobicContact CB-CG 4.01Å; L160-L162 PolarHBondContact O-N 3.5Å; L160-Y228 PolarHBondContact N-O 2.84Å; L160-Y228 PolarHBondContact O-N 2.83Å; L160-L230 HydrophobicContact CD1-CD1 3.87Å; L160-L230 HydrophobicContact CD1-CD2 3.86Å; L160-L230 HydrophobicContact CG-CD1 4.36Å; L160-L258 HydrophobicContact CD1-CD1 3.93Å; L160-L258 HydrophobicContact CD1-CD2 3.84Å; L160-L258 HydrophobicContact CD2-CD1 4.33Å
161	R	84.3	Confident	86.6	Confident	78 Å²	78	39.5 Å²	39.5	29%	0.294	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	103.8	173.3	-174.8	172.7	-64.8	-138.7	0.6	109.5	Q94 V95 R260	Q94-R161 WeakPolarHBondContact O-CD 3.36Å; V95-R161 VanDerWaalsContact CG2-CZ 3.47Å; R161-R260 PolarHBondContact O-NH2 2.84Å
162	L	85.6	Confident	86.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.8	-173.1	-54.8	173.7	0	0	0	110.9	L160 D166 I168 I222 N225 D226 Y228	L160-L162 HydrophobicContact CB-CD1 4.41Å; L160-L162 HydrophobicContact CB-CD2 3.93Å; L160-L162 HydrophobicContact CB-CG 4.01Å; L160-L162 PolarHBondContact O-N 3.5Å; L162-D166 WeakPolarHBondContact CA-OD2 3.45Å; L162-D166 HydrophobicContact CB-CB 4.28Å; L162-I168 HydrophobicContact CD1-CD1 3.29Å; L162-I168 HydrophobicContact CD1-CG1 3.81Å; L162-I222 HydrophobicContact CB-CB 4.49Å; L162-I222 HydrophobicContact CB-CD1 4.43Å; L162-I222 HydrophobicContact CB-CG1 3.87Å; L162-I222 HydrophobicContact CB-CG2 4.13Å; L162-I222 HydrophobicContact CD1-CD1 3.75Å; L162-I222 HydrophobicContact CD1-CG1 3.83Å; L162-I222 HydrophobicContact CG-CG1 4.48Å; L162-N225 WeakPolarHBondContact O-CA 3.41Å; L162-D226 PolarHBondContact N-O 3.37Å; L162-D226 PolarHBondContact O-N 3.12Å; L162-Y228 HydrophobicContact CB-CD2 3.77Å; L162-Y228 HydrophobicContact CB-CE2 4.17Å; L162-Y228 HydrophobicContact CD1-CD2 3.99Å; L162-Y228 HydrophobicContact CD1-CG 4.05Å; L162-Y228 HydrophobicContact CG-CD2 4.11Å
163	N	82.6	Confident	86.6	Confident	26 Å²	26	37.5 Å²	37.5	14%	0.139	21%	0.212	C	C	.	.			trans	-97.8	158.9	176.6	-65.1	-41.9	0	0	0	110.9	Y139 G165 D166 I222 N225 T261	Y139-N163 HydrophobicContact CE1-CB 4.38Å; N163-G165 PolarHBondContact O-N 3.46Å; N163-D166 PolarHBondContact N-OD2 3.28Å; N163-D166 WeakPolarHBondContact O-CB 3.46Å; N163-D166 PolarHBondContact O-N 2.83Å; N163-I222 WeakPolarHBondContact O-CB 2.93Å; N163-I222 VanDerWaalsContact O-CG2 3.24Å; N163-I222 WeakPolarHBondContact O-CG2 3.25Å; N163-N225 WeakPolarHBondContact CA-OD1 3.16Å; N163-T261 WeakPolarHBondContact CB-OG1 3.1Å; N163-T261 PolarHBondContact ND2-O 2.93Å
164	S	83.4	Confident	86.6	Confident	64 Å²	64	36.4 Å²	36.4	45%	0.448	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	129.5	170.4	-170.8	0	0	0	0	110	D166 I222 E223 N225	S164-D166 VanDerWaalsContact C-N 3.34Å; S164-I222 CarbonylContact C-O 3.58Å; S164-I222 VanDerWaalsContact CA-O 3.3Å; S164-I222 WeakPolarHBondContact CA-O 3.1Å; S164-E223 WeakPolarHBondContact CB-O 3.29Å; S164-E223 PolarHBondContact OG-O 2.96Å; S164-N225 PolarHBondContact N-OD1 3.24Å
165	G	85.3	Confident	86.6	Confident	33 Å²	33	38.6 Å²	38.6	34%	0.34	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	-11.2	-173.7	0	0	0	0	0	114.7	N163 I222	N163-G165 PolarHBondContact O-N 3.46Å; G165-I222 PolarHBondContact N-O 2.93Å
166	D	88.7	Confident	86.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.			trans	-62.5	147.7	169	-69.2	2.6	0	0	0	109.5	L162 N163 S164 T221 I222 F259 R260 T261	L162-D166 WeakPolarHBondContact CA-OD2 3.45Å; L162-D166 HydrophobicContact CB-CB 4.28Å; N163-D166 PolarHBondContact N-OD2 3.28Å; N163-D166 WeakPolarHBondContact O-CB 3.46Å; N163-D166 PolarHBondContact O-N 2.83Å; S164-D166 VanDerWaalsContact C-N 3.34Å; D166-T221 CarbonylContact O-C 3.56Å; D166-T221 WeakPolarHBondContact O-CA 3.4Å; D166-I222 HydrophobicContact CB-CB 4.21Å; D166-I222 HydrophobicContact CB-CG1 4.02Å; D166-I222 WeakPolarHBondContact O-CB 3.36Å; D166-I222 WeakPolarHBondContact O-CG1 3.43Å; D166-I222 PolarHBondContact O-N 3.42Å; D166-F259 CarbonylContact C-O 3.57Å; D166-F259 VanDerWaalsContact CA-O 3.24Å; D166-F259 WeakPolarHBondContact CA-O 3.46Å; D166-R260 WeakPolarHBondContact OD1-CA 3.48Å; D166-R260 IonicContact OD2-NE 3.58Å; D166-T261 WeakPolarHBondContact OD1-CA 3.35Å; D166-T261 WeakPolarHBondContact OD1-CB 3.37Å; D166-T261 PolarHBondContact OD1-N 2.51Å; D166-T261 PolarHBondContact OD1-OG1 2.6Å
167	A	90.8	Very high	86.6	Confident	5 Å²	5	36 Å²	36	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.4	172.8	0	0	0	0	0	112.7	Q219 I220 L258 F259	A167-Q219 HydrophobicContact CB-CG 4.01Å; A167-I220 CarbonylContact C-O 3.55Å; A167-I220 WeakPolarHBondContact CA-O 3.26Å; A167-I220 VanDerWaalsContact CB-O 3.29Å; A167-I220 WeakPolarHBondContact CB-O 3.46Å; A167-L258 WeakPolarHBondContact O-CA 3.44Å; A167-F259 HydrophobicContact CB-CB 4.16Å; A167-F259 HydrophobicContact CB-CD2 4.28Å; A167-F259 PolarHBondContact N-O 2.68Å; A167-F259 PolarHBondContact O-N 3.14Å
168	I	90.9	Very high	86.7	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.1	174.7	-46.2	-177.7	0	0	0	108.7	L162 I181 L210 Q219 I220 I222 L230 I256 D257 L258	L162-I168 HydrophobicContact CD1-CD1 3.29Å; L162-I168 HydrophobicContact CD1-CG1 3.81Å; I168-I181 HydrophobicContact CD1-CD1 4.33Å; I168-L210 HydrophobicContact CG2-CD1 4.19Å; I168-Q219 WeakPolarHBondContact O-CA 3.35Å; I168-I220 HydrophobicContact CB-CD1 3.83Å; I168-I220 HydrophobicContact CB-CG1 3.63Å; I168-I220 HydrophobicContact CD1-CD1 3.85Å; I168-I220 HydrophobicContact CD1-CG1 4.43Å; I168-I220 HydrophobicContact CG1-CD1 4.04Å; I168-I220 HydrophobicContact CG1-CG1 4.07Å; I168-I220 PolarHBondContact N-O 3.18Å; I168-I220 PolarHBondContact O-N 2.8Å; I168-I222 HydrophobicContact CD1-CD1 4.33Å; I168-L230 HydrophobicContact CD1-CD1 4.26Å; I168-L230 HydrophobicContact CD1-CD2 4.24Å; I168-L230 HydrophobicContact CG2-CD2 4.34Å; I168-I256 HydrophobicContact CG2-CG2 3.42Å; I168-I256 VanDerWaalsContact CG2-CG2 3.42Å; I168-D257 WeakPolarHBondContact CA-O 3.41Å; I168-L258 HydrophobicContact CB-CD2 4.3Å; I168-L258 HydrophobicContact CD1-CD2 4.44Å; I168-L258 HydrophobicContact CG1-CD2 3.9Å; I168-L258 HydrophobicContact CG2-CD2 3.97Å
169	Y	89	Confident	87	Confident	26 Å²	26	33.4 Å²	33.4	10%	0.102	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.7	175.4	171.9	-118.5	0	0	0	109.7	H171 R217 I256 D257	Y169-H171 HydrophobicContact CD1-CB 4.47Å; Y169-H171 AromaticContact CD1-CD2 3.7Å; Y169-H171 HydrophobicContact CE1-CB 3.6Å; Y169-H171 AromaticContact CE1-CD2 3.4Å; Y169-H171 VanDerWaalsContact CE1-CD2 3.4Å; Y169-H171 WeakPolarHBondContact CE1-CD2 3.42Å; Y169-H171 AromaticContact CE1-CG 3.62Å; Y169-H171 HydrophobicContact CE2-CB 4.41Å; Y169-H171 VanDerWaalsContact OH-CB 3.29Å; Y169-H171 WeakPolarHBondContact OH-CB 3.36Å; Y169-R217 HydrophobicContact CD2-CB 4.39Å; Y169-R217 HydrophobicContact CE2-CB 3.5Å; Y169-R217 VanDerWaalsContact CE2-CB 3.5Å; Y169-R217 HydrophobicContact CE2-CG 3.78Å; Y169-R217 WeakPolarHBondContact OH-CD 3.38Å; Y169-R217 VanDerWaalsContact OH-CG 3.22Å; Y169-R217 WeakPolarHBondContact OH-CG 3.48Å; Y169-R217 PolarHBondContact OH-NE 2.88Å; Y169-R217 VanDerWaalsContact OH-NE 3.15Å; Y169-I256 CarbonylContact O-C 3.51Å; Y169-I256 WeakPolarHBondContact O-CA 3.46Å; Y169-D257 HydrophobicContact CD1-CB 4.03Å; Y169-D257 PolarHBondContact N-O 2.78Å; Y169-D257 PolarHBondContact O-N 2.8Å
170	A	89.2	Confident	87.3	Confident	12 Å²	12	31.2 Å²	31.2	10%	0.099	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.6	-178.6	0	0	0	0	0	110.4	F173 I179 L210 T212 Y255	A170-F173 HydrophobicContact CB-CE2 3.92Å; A170-I179 HydrophobicContact CB-CD1 3.46Å; A170-I179 VanDerWaalsContact CB-CD1 3.46Å; A170-L210 HydrophobicContact CB-CD1 4.31Å; A170-T212 HydrophobicContact CB-CG2 4.18Å; A170-Y255 WeakPolarHBondContact CA-O 3.36Å
171	H	87.4	Confident	87.8	Confident	34 Å²	34	31.2 Å²	31.2	16%	0.157	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	167.8	-177	72.3	98.2	0	0	0	113.8	Y169 F173 Y255 D257	Y169-H171 HydrophobicContact CD1-CB 4.47Å; Y169-H171 AromaticContact CD1-CD2 3.7Å; Y169-H171 HydrophobicContact CE1-CB 3.6Å; Y169-H171 AromaticContact CE1-CD2 3.4Å; Y169-H171 VanDerWaalsContact CE1-CD2 3.4Å; Y169-H171 WeakPolarHBondContact CE1-CD2 3.42Å; Y169-H171 AromaticContact CE1-CG 3.62Å; Y169-H171 HydrophobicContact CE2-CB 4.41Å; Y169-H171 VanDerWaalsContact OH-CB 3.29Å; Y169-H171 WeakPolarHBondContact OH-CB 3.36Å; H171-F173 WeakPolarHBondContact O-CD2 3.17Å; H171-F173 PolarHBondContact O-N 2.88Å; H171-Y255 PolarHBondContact N-O 2.76Å; H171-Y255 WeakPolarHBondContact NE2-CB 3.29Å; H171-Y255 PolarHBondContact O-N 3.23Å; H171-D257 IonicContact CD2-OD2 3.5Å; H171-D257 IonicContact NE2-OD1 3.34Å; H171-D257 PolarHBondContact NE2-OD1 2.75Å; H171-D257 IonicContact NE2-OD2 3.13Å; H171-D257 PolarHBondContact NE2-OD2 2.7Å; H171-D257 VanDerWaalsContact NE2-OD2 3.13Å
172	N	85	Confident	88.2	Confident	121 Å²	121	27.5 Å²	27.5	65%	0.647	16%	0.161	S	C	*	.			trans	52.7	38.5	175.7	-63.4	-9	0	0	0	113.6	G254 Y255	N172-G254 WeakPolarHBondContact O-CA 3.5Å; N172-Y255 HydrophobicContact CB-CD2 3.89Å; N172-Y255 HydrophobicContact CB-CE2 4.39Å
173	F	86.8	Confident	88.5	Confident	30 Å²	30	29.5 Å²	29.5	13%	0.132	17%	0.17	C	C	.	.			trans	-75.6	138.9	173.8	-81.1	-100	0	0	0	110.7	I149 A170 H171 H175 T177 I179 T212 S253 Y255 I256	I149-F173 HydrophobicContact CD1-CE1 3.84Å; I149-F173 HydrophobicContact CD1-CZ 3.73Å; A170-F173 HydrophobicContact CB-CE2 3.92Å; H171-F173 WeakPolarHBondContact O-CD2 3.17Å; H171-F173 PolarHBondContact O-N 2.88Å; F173-H175 PolarHBondContact O-N 2.91Å; F173-T177 HydrophobicContact CD1-CG2 3.79Å; F173-T177 WeakPolarHBondContact CD1-OG1 3.37Å; F173-T177 HydrophobicContact CE1-CG2 3.89Å; F173-I179 HydrophobicContact CE2-CD1 4.09Å; F173-I179 HydrophobicContact CZ-CD1 3.77Å; F173-T212 HydrophobicContact CB-CG2 4.31Å; F173-T212 HydrophobicContact CD2-CG2 3.51Å; F173-T212 HydrophobicContact CE2-CG2 3.98Å; F173-T212 HydrophobicContact CG-CG2 3.93Å; F173-S253 CarbonylContact C-O 3.47Å; F173-S253 VanDerWaalsContact CA-O 3.25Å; F173-S253 WeakPolarHBondContact CA-O 3.33Å; F173-Y255 WeakPolarHBondContact CE2-O 3.32Å; F173-I256 HydrophobicContact CE2-CG1 4.34Å; F173-I256 HydrophobicContact CZ-CD1 4.41Å; F173-I256 HydrophobicContact CZ-CG1 3.91Å
174	S	86.5	Confident	88.7	Confident	61 Å²	61	28.7 Å²	28.7	43%	0.427	17%	0.167	S	C	.	.	S	Bend	trans	-64.8	-22.3	-177.3	55.7	0	0	0	0	113.6	S253	S174-S253 PolarHBondContact N-O 3.21Å; S174-S253 PolarHBondContact OG-N 3.39Å; S174-S253 PolarHBondContact OG-O 2.84Å
175	H	83.8	Confident	88.7	Confident	74 Å²	74	29.7 Å²	29.7	34%	0.343	17%	0.165	S	C	.	.	S	Bend	trans	-145.6	157.7	177.8	-51.3	81.1	0	0	0	108.9	F173 T177 S249	F173-H175 PolarHBondContact O-N 2.91Å; H175-T177 PolarHBondContact O-N 2.84Å; H175-T177 PolarHBondContact O-OG1 2.78Å; H175-S249 PolarHBondContact CD2-OG 2.85Å; H175-S249 VanDerWaalsContact CD2-OG 3.23Å; H175-S249 PolarHBondContact CE1-OG 2.63Å; H175-S249 VanDerWaalsContact CG-OG 3.26Å; H175-S249 PolarHBondContact ND1-OG 3.28Å; H175-S249 PolarHBondContact NE2-OG 3.19Å
176	P	86.3	Confident	88.7	Confident	46 Å²	46	34 Å²	34	30%	0.299	18%	0.176	S	C	.	.			trans	-48.9	114.2	171.7	-29.7	36.7	0	0	0	111.3	D213 S235 I238	P176-D213 HydrophobicContact CB-CB 3.92Å; P176-D213 HydrophobicContact CG-CB 4.34Å; P176-S235 WeakPolarHBondContact O-CB 3.49Å; P176-S235 PolarHBondContact O-N 3.12Å; P176-I238 HydrophobicContact CB-CD1 3.89Å; P176-I238 HydrophobicContact CB-CG1 3.87Å; P176-I238 HydrophobicContact CG-CD1 3.99Å; P176-I238 HydrophobicContact CG-CG1 3.88Å
177	T	87.9	Confident	88.7	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.3	-173.6	-61	0	0	0	0	108.6	F173 H175 I179 T212 M232 R233	F173-T177 HydrophobicContact CD1-CG2 3.79Å; F173-T177 WeakPolarHBondContact CD1-OG1 3.37Å; F173-T177 HydrophobicContact CE1-CG2 3.89Å; H175-T177 PolarHBondContact O-N 2.84Å; H175-T177 PolarHBondContact O-OG1 2.78Å; T177-I179 HydrophobicContact CG2-CG1 4.3Å; T177-T212 PolarHBondContact N-OG1 3.4Å; T177-T212 WeakPolarHBondContact O-CG2 3.27Å; T177-T212 PolarHBondContact O-N 2.92Å; T177-T212 PolarHBondContact O-OG1 3.09Å; T177-T212 VanDerWaalsContact O-OG1 3.12Å; T177-M232 HydrophobicContact CG2-CB 4.39Å; T177-R233 CarbonylContact C-O 3.52Å; T177-R233 VanDerWaalsContact CA-O 3.3Å; T177-R233 WeakPolarHBondContact CA-O 3.17Å; T177-R233 VanDerWaalsContact CG2-O 3.31Å; T177-R233 WeakPolarHBondContact CG2-O 3.26Å
178	Q	90	Very high	88.4	Confident	41 Å²	41	36.1 Å²	36.1	19%	0.192	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.1	167.6	59.7	-179.1	-23.4	0	0	108.4	I180 I209 L210 R233 T234	Q178-I180 HydrophobicContact CB-CD1 4.47Å; Q178-I180 HydrophobicContact CG-CD1 3.82Å; Q178-I209 HydrophobicContact CB-CG2 4.42Å; Q178-L210 CarbonylContact C-O 3.54Å; Q178-L210 WeakPolarHBondContact CA-O 3.33Å; Q178-R233 HydrophobicContact CG-CB 3.74Å; Q178-R233 WeakPolarHBondContact CG-O 3.43Å; Q178-R233 PolarHBondContact N-O 2.78Å; Q178-R233 PolarHBondContact O-N 3.37Å; Q178-T234 PolarHBondContact NE2-O 2.7Å
179	I	92.2	Very high	88.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	104	174.5	-48.2	-179.3	0	0	0	107.1	A170 F173 T177 I181 I209 L210 L230 I231 M232 I256	A170-I179 HydrophobicContact CB-CD1 3.46Å; A170-I179 VanDerWaalsContact CB-CD1 3.46Å; F173-I179 HydrophobicContact CE2-CD1 4.09Å; F173-I179 HydrophobicContact CZ-CD1 3.77Å; T177-I179 HydrophobicContact CG2-CG1 4.3Å; I179-I181 HydrophobicContact CG2-CG1 4.32Å; I179-I209 WeakPolarHBondContact O-CA 3.31Å; I179-L210 HydrophobicContact CB-CB 4.18Å; I179-L210 PolarHBondContact N-O 3.39Å; I179-L210 PolarHBondContact O-N 2.78Å; I179-L230 HydrophobicContact CG2-CB 3.88Å; I179-L230 HydrophobicContact CG2-CD2 4.2Å; I179-L230 HydrophobicContact CG2-CG 4.08Å; I179-I231 CarbonylContact C-O 3.58Å; I179-I231 WeakPolarHBondContact CA-O 3.27Å; I179-M232 HydrophobicContact CG1-CG 4.12Å; I179-M232 HydrophobicContact CG2-CG 4.28Å; I179-I256 HydrophobicContact CD1-CD1 3.83Å; I179-I256 HydrophobicContact CD1-CG1 3.97Å
180	I	93.4	Very high	88.3	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	125.3	177.5	-55.4	91.4	0	0	0	108.1	Q178 L182 E202 S206 I209 I231 R233	Q178-I180 HydrophobicContact CB-CD1 4.47Å; Q178-I180 HydrophobicContact CG-CD1 3.82Å; I180-L182 HydrophobicContact CG2-CD2 4.27Å; I180-E202 HydrophobicContact CG1-CB 4.39Å; I180-E202 HydrophobicContact CG2-CB 4Å; I180-E202 HydrophobicContact CG2-CG 4.17Å; I180-S206 VanDerWaalsContact CG2-CB 3.49Å; I180-I209 HydrophobicContact CG2-CG1 4.5Å; I180-I231 HydrophobicContact CB-CB 4.24Å; I180-I231 WeakPolarHBondContact CD1-O 3.24Å; I180-I231 PolarHBondContact N-O 2.85Å; I180-I231 PolarHBondContact O-N 3.32Å; I180-R233 HydrophobicContact CD1-CB 4.38Å; I180-R233 HydrophobicContact CD1-CG 3.95Å
181	I	94.7	Very high	88.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	115.2	-175.2	-52.9	-178.4	0	0	0	108.5	I168 I179 W207 Y208 L210 I220 Y228 T229 L230	I168-I181 HydrophobicContact CD1-CD1 4.33Å; I179-I181 HydrophobicContact CG2-CG1 4.32Å; I181-W207 HydrophobicContact CB-CE3 4.39Å; I181-W207 HydrophobicContact CG2-CE3 3.93Å; I181-W207 HydrophobicContact CG2-CZ3 4.42Å; I181-W207 WeakPolarHBondContact O-CB 3.33Å; I181-W207 PolarHBondContact O-N 3.29Å; I181-Y208 PolarHBondContact N-O 3.22Å; I181-Y208 PolarHBondContact O-N 3.25Å; I181-L210 HydrophobicContact CD1-CD1 3.93Å; I181-L210 HydrophobicContact CD1-CG 4.18Å; I181-I220 HydrophobicContact CD1-CD1 3.1Å; I181-Y228 HydrophobicContact CG2-CD1 3.76Å; I181-Y228 HydrophobicContact CG2-CG 4.49Å; I181-T229 CarbonylContact C-O 3.57Å; I181-T229 WeakPolarHBondContact CA-O 3.2Å; I181-L230 HydrophobicContact CG1-CG 4.23Å; I181-L230 HydrophobicContact CG2-CD1 4.41Å
182	L	93.7	Very high	88.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	133.8	171.4	-51.4	-177.7	0	0	0	108.9	I180 W191 Y201 Y228 T229 I231	I180-L182 HydrophobicContact CG2-CD2 4.27Å; L182-W191 HydrophobicContact CD1-CB 3.59Å; L182-W191 HydrophobicContact CD1-CG 3.86Å; L182-Y201 HydrophobicContact CD1-CE1 4.25Å; L182-Y201 HydrophobicContact CD2-CE1 4.4Å; L182-Y228 CarbonylContact O-C 3.49Å; L182-Y228 WeakPolarHBondContact O-CA 3.4Å; L182-T229 PolarHBondContact N-O 2.79Å; L182-T229 PolarHBondContact O-N 3.47Å; L182-I231 HydrophobicContact CD1-CD1 3.6Å; L182-I231 HydrophobicContact CG-CD1 3.91Å
183	K	91.8	Very high	88.8	Confident	44 Å²	44	48.7 Å²	48.7	19%	0.191	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.8	175.5	-179.3	-178	175.7	-169.3	0	110.3	S187 W207 Q224 D226 Y228	K183-S187 WeakPolarHBondContact O-CB 3.41Å; K183-S187 PolarHBondContact O-OG 3.25Å; K183-W207 HydrophobicContact CB-CB 3.91Å; K183-W207 HydrophobicContact CB-CG 4.09Å; K183-Q224 VanDerWaalsContact NZ-CD 3.35Å; K183-D226 HydrophobicContact CG-CB 4.24Å; K183-Y228 HydrophobicContact CB-CD1 4.13Å; K183-Y228 HydrophobicContact CB-CE1 3.78Å; K183-Y228 HydrophobicContact CD-CE1 4.07Å; K183-Y228 HydrophobicContact CG-CD1 4.33Å; K183-Y228 HydrophobicContact CG-CE1 3.69Å
184	G	85.5	Confident	88.9	Confident	8 Å²	8	48.9 Å²	48.9	8%	0.082	24%	0.239	C	C	.	.	S	Bend	trans	85.4	148.8	175.1	0	0	0	0	0	114.1	E186 S187 M188 D226 V227	G184-E186 PolarHBondContact O-N 2.84Å; G184-S187 PolarHBondContact O-N 3.34Å; G184-M188 PolarHBondContact O-N 3.29Å; G184-D226 WeakPolarHBondContact CA-OD1 3.33Å; G184-D226 WeakPolarHBondContact CA-OD2 3.48Å; G184-D226 PolarHBondContact N-OD2 2.79Å; G184-V227 WeakPolarHBondContact CA-O 3.37Å; G184-V227 PolarHBondContact N-O 2.84Å
185	E	83.6	Confident	88.9	Confident	86 Å²	86	48 Å²	48	40%	0.402	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-36.3	177.2	-173	60.2	-142.4	0	0	111.5	S187 M188 Q189	E185-S187 PolarHBondContact O-N 3.22Å; E185-M188 WeakPolarHBondContact O-CB 3.46Å; E185-M188 PolarHBondContact O-N 2.85Å; E185-M188 VanDerWaalsContact OE1-SD 3.36Å; E185-Q189 HydrophobicContact CG-CG 4.36Å; E185-Q189 VanDerWaalsContact O-CG 3.31Å; E185-Q189 WeakPolarHBondContact O-CG 3.36Å; E185-Q189 PolarHBondContact O-N 3.43Å; E185-Q189 PolarHBondContact OE1-NE2 3.25Å
186	E	85.8	Confident	89	Confident	123 Å²	123	49.6 Å²	49.6	58%	0.575	26%	0.259	S	S	*	.	H	α-helix	trans	-62.4	-42.7	179.3	-172.7	178.7	-169.6	0	0	112.5	G184 M188 Q189 R190	G184-E186 PolarHBondContact O-N 2.84Å; E186-M188 VanDerWaalsContact C-N 3.29Å; E186-M188 PolarHBondContact O-N 3.44Å; E186-Q189 PolarHBondContact O-N 3.26Å; E186-R190 HydrophobicContact CG-CG 4.47Å; E186-R190 WeakPolarHBondContact O-CB 2.86Å; E186-R190 WeakPolarHBondContact O-CG 3.45Å; E186-R190 PolarHBondContact O-N 2.86Å; E186-R190 IonicContact OE1-CZ 3.17Å; E186-R190 IonicContact OE1-NE 2.62Å; E186-R190 PolarHBondContact OE1-NE 2.85Å; E186-R190 IonicContact OE1-NH2 3.62Å; E186-R190 PolarHBondContact OE1-NH2 3.4Å; E186-R190 IonicContact OE2-NH2 3.21Å
187	S	87.9	Confident	88.9	Confident	30 Å²	30	56 Å²	56	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-38.7	178.6	-58.1	0	0	0	0	111.3	K183 G184 E185 W191 Y201	K183-S187 WeakPolarHBondContact O-CB 3.41Å; K183-S187 PolarHBondContact O-OG 3.25Å; G184-S187 PolarHBondContact O-N 3.34Å; E185-S187 PolarHBondContact O-N 3.22Å; S187-W191 WeakPolarHBondContact O-CB 3.25Å; S187-W191 PolarHBondContact O-N 2.9Å; S187-Y201 WeakPolarHBondContact CA-OH 2.71Å; S187-Y201 WeakPolarHBondContact O-CE1 3.13Å; S187-Y201 PolarHBondContact O-OH 2.75Å
188	M	84.7	Confident	89	Confident	19 Å²	19	58.8 Å²	58.8	9%	0.094	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-50.7	172	174	-160.6	172.3	0	0	111.5	F157 H159 G184 E185 E186 R190 W191 I192 T229	F157-M188 HydrophobicContact CE2-CE 4.41Å; H159-M188 WeakPolarHBondContact CE1-CE 3.35Å; H159-M188 PolarHBondContact CE1-SD 3.43Å; H159-M188 WeakPolarHBondContact NE2-CE 3.47Å; G184-M188 PolarHBondContact O-N 3.29Å; E185-M188 WeakPolarHBondContact O-CB 3.46Å; E185-M188 PolarHBondContact O-N 2.85Å; E185-M188 VanDerWaalsContact OE1-SD 3.36Å; E186-M188 VanDerWaalsContact C-N 3.29Å; E186-M188 PolarHBondContact O-N 3.44Å; M188-R190 VanDerWaalsContact C-N 3.26Å; M188-R190 PolarHBondContact O-N 3.49Å; M188-W191 CarbonylContact O-C 3.58Å; M188-W191 WeakPolarHBondContact O-CA 3.28Å; M188-W191 WeakPolarHBondContact O-CB 3.41Å; M188-W191 PolarHBondContact O-N 2.98Å; M188-I192 HydrophobicContact CE-CD1 3.66Å; M188-I192 HydrophobicContact CG-CD1 4.11Å; M188-I192 WeakPolarHBondContact O-CG1 3.32Å; M188-I192 PolarHBondContact O-N 3.41Å; M188-T229 HydrophobicContact CG-CG2 4.48Å
189	Q	88	Confident	88.9	Confident	78 Å²	78	65.8 Å²	65.8	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-38.8	-178.7	-68.8	-60.1	-31.7	0	0	111.6	E185 E186 I192 K193	E185-Q189 HydrophobicContact CG-CG 4.36Å; E185-Q189 VanDerWaalsContact O-CG 3.31Å; E185-Q189 WeakPolarHBondContact O-CG 3.36Å; E185-Q189 PolarHBondContact O-N 3.43Å; E185-Q189 PolarHBondContact OE1-NE2 3.25Å; E186-Q189 PolarHBondContact O-N 3.26Å; Q189-I192 PolarHBondContact O-N 2.9Å; Q189-K193 VanDerWaalsContact O-CG 3.28Å; Q189-K193 WeakPolarHBondContact O-CG 3.46Å; Q189-K193 PolarHBondContact O-N 2.74Å; Q189-K193 VanDerWaalsContact O-N 3.09Å
190	R	90.2	Very high	88.7	Confident	127 Å²	127	68 Å²	68	48%	0.479	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-44.7	172.5	-71.5	175.7	-175.9	-170.6	1.9	111.3	E186 M188 I192 K193 T194 Y201	E186-R190 HydrophobicContact CG-CG 4.47Å; E186-R190 WeakPolarHBondContact O-CB 2.86Å; E186-R190 WeakPolarHBondContact O-CG 3.45Å; E186-R190 PolarHBondContact O-N 2.86Å; E186-R190 IonicContact OE1-CZ 3.17Å; E186-R190 IonicContact OE1-NE 2.62Å; E186-R190 PolarHBondContact OE1-NE 2.85Å; E186-R190 IonicContact OE1-NH2 3.62Å; E186-R190 PolarHBondContact OE1-NH2 3.4Å; E186-R190 IonicContact OE2-NH2 3.21Å; M188-R190 VanDerWaalsContact C-N 3.26Å; M188-R190 PolarHBondContact O-N 3.49Å; R190-I192 PolarHBondContact O-N 2Å; R190-K193 PolarHBondContact O-N 2.78Å; R190-T194 WeakPolarHBondContact O-CG2 3.15Å; R190-T194 PolarHBondContact O-N 2.95Å; R190-Y201 HydrophobicContact CB-CE2 3.81Å; R190-Y201 WeakPolarHBondContact CB-OH 3.34Å
191	W	91.9	Very high	88.6	Confident	10 Å²	10	69.4 Å²	69.4	4%	0.038	34%	0.344	C	S	.	.	H	α-helix	trans	-58	-44.5	174.9	177.3	83.1	0	0	0	112.5	F157 L182 S187 M188 K193 T194 K198 Y201 E202 I231	F157-W191 AromaticContact CD1-CH2 3.98Å; F157-W191 HydrophobicContact CD1-CH2 3.98Å; F157-W191 HydrophobicContact CD1-CZ3 4.06Å; F157-W191 HydrophobicContact CE1-CH2 4.35Å; F157-W191 HydrophobicContact CE1-CZ3 4.17Å; L182-W191 HydrophobicContact CD1-CB 3.59Å; L182-W191 HydrophobicContact CD1-CG 3.86Å; S187-W191 WeakPolarHBondContact O-CB 3.25Å; S187-W191 PolarHBondContact O-N 2.9Å; M188-W191 CarbonylContact O-C 3.58Å; M188-W191 WeakPolarHBondContact O-CA 3.28Å; M188-W191 WeakPolarHBondContact O-CB 3.41Å; M188-W191 PolarHBondContact O-N 2.98Å; W191-K193 VanDerWaalsContact C-N 3.34Å; W191-K193 PolarHBondContact O-N 3.45Å; W191-T194 PolarHBondContact O-N 2.87Å; W191-T194 PolarHBondContact O-OG1 2.85Å; W191-K198 HydrophobicContact CD2-CD 4.43Å; W191-K198 HydrophobicContact CD2-CG 4.33Å; W191-K198 HydrophobicContact CH2-CD 4.23Å; W191-K198 HydrophobicContact CZ2-CD 3.69Å; W191-K198 HydrophobicContact CZ2-CG 4.21Å; W191-Y201 HydrophobicContact CB-CD1 3.73Å; W191-Y201 HydrophobicContact CB-CE1 3.72Å; W191-Y201 AromaticContact CD1-CD1 3.8Å; W191-Y201 HydrophobicContact CG-CD1 4.2Å; W191-E202 PolarHBondContact NE1-OE1 2.88Å; W191-I231 HydrophobicContact CD2-CD1 3.8Å; W191-I231 HydrophobicContact CE3-CD1 4.43Å; W191-I231 HydrophobicContact CG-CD1 4.05Å; W191-I231 HydrophobicContact CZ2-CD1 3.9Å; W191-I231 HydrophobicContact CZ2-CG1 4.34Å; W191-I231 HydrophobicContact CZ2-CG2 4.12Å
192	I	88.6	Confident	88.5	Confident	72 Å²	72	69.8 Å²	69.8	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-58.4	-47.9	175.7	-67.4	172.9	0	0	0	110.3	M188 Q189 R190 T194 G195	M188-I192 HydrophobicContact CE-CD1 3.66Å; M188-I192 HydrophobicContact CG-CD1 4.11Å; M188-I192 WeakPolarHBondContact O-CG1 3.32Å; M188-I192 PolarHBondContact O-N 3.41Å; Q189-I192 PolarHBondContact O-N 2.9Å; R190-I192 PolarHBondContact O-N 2Å; I192-T194 VanDerWaalsContact C-N 3.27Å; I192-T194 PolarHBondContact O-N 3.31Å; I192-G195 PolarHBondContact O-N 3.49Å
193	K	91.3	Very high	88.3	Confident	171 Å²	171	78.2 Å²	78.2	74%	0.743	38%	0.383	S	S	*	.	H	α-helix	trans	-65.5	-24.3	-179.5	-71.6	173.6	-176.3	179.9	0	114	Q189 R190 W191 G195	Q189-K193 VanDerWaalsContact O-CG 3.28Å; Q189-K193 WeakPolarHBondContact O-CG 3.46Å; Q189-K193 PolarHBondContact O-N 2.74Å; Q189-K193 VanDerWaalsContact O-N 3.09Å; R190-K193 PolarHBondContact O-N 2.78Å; W191-K193 VanDerWaalsContact C-N 3.34Å; W191-K193 PolarHBondContact O-N 3.45Å; K193-G195 PolarHBondContact O-N 3.35Å
194	T	88.4	Confident	88.1	Confident	33 Å²	33	81.3 Å²	81.3	20%	0.202	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-17.5	-178.7	64.3	0	0	0	0	114.3	R190 W191 I192 S196 Y197 K198 Y201	R190-T194 WeakPolarHBondContact O-CG2 3.15Å; R190-T194 PolarHBondContact O-N 2.95Å; W191-T194 PolarHBondContact O-N 2.87Å; W191-T194 PolarHBondContact O-OG1 2.85Å; I192-T194 VanDerWaalsContact C-N 3.27Å; I192-T194 PolarHBondContact O-N 3.31Å; T194-S196 PolarHBondContact O-N 3.14Å; T194-Y197 PolarHBondContact O-N 3.37Å; T194-K198 WeakPolarHBondContact OG1-CA 3.35Å; T194-K198 WeakPolarHBondContact OG1-CG 3.4Å; T194-Y201 HydrophobicContact CG2-CD2 3.54Å; T194-Y201 HydrophobicContact CG2-CE2 4.34Å; T194-Y201 HydrophobicContact CG2-CG 3.74Å
195	G	87.3	Confident	88.4	Confident	42 Å²	42	83.2 Å²	83.2	43%	0.433	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	58	-111.3	173	0	0	0	0	0	113.3	I192 K193 Y197 K198	I192-G195 PolarHBondContact O-N 3.49Å; K193-G195 PolarHBondContact O-N 3.35Å; G195-Y197 VanDerWaalsContact C-N 3.28Å; G195-Y197 PolarHBondContact O-N 2.84Å; G195-K198 WeakPolarHBondContact O-CD 3.49Å; G195-K198 WeakPolarHBondContact O-CG 3.37Å
196	S	85.1	Confident	88.8	Confident	108 Å²	108	80.5 Å²	80.5	76%	0.755	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-68.8	-23.8	178	51.4	0	0	0	0	113.5	T194 K198	T194-S196 PolarHBondContact O-N 3.14Å; S196-K198 VanDerWaalsContact C-N 3.27Å; S196-K198 PolarHBondContact O-N 2.97Å
197	Y	86.1	Confident	89.1	Confident	180 Å²	180	78 Å²	78	71%	0.706	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-86.9	10.7	-177.1	-56.4	-76	0	0	0	113.9	T194 G195 R199 G200 Y201	T194-Y197 PolarHBondContact O-N 3.37Å; G195-Y197 VanDerWaalsContact C-N 3.28Å; G195-Y197 PolarHBondContact O-N 2.84Å; Y197-R199 VanDerWaalsContact C-N 3.3Å; Y197-R199 PolarHBondContact O-N 3.25Å; Y197-G200 PolarHBondContact O-N 2.83Å; Y197-Y201 PolarHBondContact O-N 2.77Å
198	K	89.8	Confident	89.3	Confident	61 Å²	61	81.1 Å²	81.1	27%	0.265	40%	0.404	S	S	.	.	H	α-helix	trans	-50	-44.6	-177.7	-82.7	173.6	179.3	-169.7	0	113.9	W191 T194 G195 S196 G200 Y201 E202	W191-K198 HydrophobicContact CD2-CD 4.43Å; W191-K198 HydrophobicContact CD2-CG 4.33Å; W191-K198 HydrophobicContact CH2-CD 4.23Å; W191-K198 HydrophobicContact CZ2-CD 3.69Å; W191-K198 HydrophobicContact CZ2-CG 4.21Å; T194-K198 WeakPolarHBondContact OG1-CA 3.35Å; T194-K198 WeakPolarHBondContact OG1-CG 3.4Å; G195-K198 WeakPolarHBondContact O-CD 3.49Å; G195-K198 WeakPolarHBondContact O-CG 3.37Å; S196-K198 VanDerWaalsContact C-N 3.27Å; S196-K198 PolarHBondContact O-N 2.97Å; K198-G200 PolarHBondContact O-N 3.48Å; K198-Y201 PolarHBondContact O-N 3.49Å; K198-E202 WeakPolarHBondContact O-CB 3.47Å; K198-E202 WeakPolarHBondContact O-CG 3.34Å; K198-E202 PolarHBondContact O-N 3.5Å
199	R	87.7	Confident	89.6	Confident	187 Å²	187	83 Å²	83	71%	0.706	41%	0.413	S	S	*	.	H	α-helix	trans	-63.5	-39.9	178.3	-72.1	-173.3	179	-179.2	-0	112.7	Y197 Y201 K203	Y197-R199 VanDerWaalsContact C-N 3.3Å; Y197-R199 PolarHBondContact O-N 3.25Å; R199-Y201 VanDerWaalsContact C-N 3.35Å; R199-K203 PolarHBondContact O-N 3.47Å; R199-K203 VanDerWaalsContact O-N 3.1Å
200	G	88	Confident	89.7	Confident	48 Å²	48	79.4 Å²	79.4	50%	0.495	40%	0.397	S	S	.	.	H	α-helix	trans	-65.5	-41.7	175.9	0	0	0	0	0	111.3	Y197 K198 K203 C204	Y197-G200 PolarHBondContact O-N 2.83Å; K198-G200 PolarHBondContact O-N 3.48Å; G200-K203 PolarHBondContact O-N 3.01Å; G200-C204 WeakPolarHBondContact O-CB 3.48Å; G200-C204 PolarHBondContact O-N 3.45Å; G200-C204 VanDerWaalsContact O-N 3.11Å
201	Y	91.2	Very high	89.6	Confident	30 Å²	30	76.8 Å²	76.8	12%	0.118	39%	0.39	C	S	.	.	H	α-helix	trans	-63.8	-47.8	175.4	-172.3	-88.7	0	0	0	112.2	L182 S187 R190 W191 T194 Y197 K198 R199 K203 C204 C205	L182-Y201 HydrophobicContact CD1-CE1 4.25Å; L182-Y201 HydrophobicContact CD2-CE1 4.4Å; S187-Y201 WeakPolarHBondContact CA-OH 2.71Å; S187-Y201 WeakPolarHBondContact O-CE1 3.13Å; S187-Y201 PolarHBondContact O-OH 2.75Å; R190-Y201 HydrophobicContact CB-CE2 3.81Å; R190-Y201 WeakPolarHBondContact CB-OH 3.34Å; W191-Y201 HydrophobicContact CB-CD1 3.73Å; W191-Y201 HydrophobicContact CB-CE1 3.72Å; W191-Y201 AromaticContact CD1-CD1 3.8Å; W191-Y201 HydrophobicContact CG-CD1 4.2Å; T194-Y201 HydrophobicContact CG2-CD2 3.54Å; T194-Y201 HydrophobicContact CG2-CE2 4.34Å; T194-Y201 HydrophobicContact CG2-CG 3.74Å; Y197-Y201 PolarHBondContact O-N 2.77Å; K198-Y201 PolarHBondContact O-N 3.49Å; R199-Y201 VanDerWaalsContact C-N 3.35Å; Y201-K203 VanDerWaalsContact C-N 3.29Å; Y201-K203 PolarHBondContact O-N 2.92Å; Y201-C204 PolarHBondContact O-N 2.85Å; Y201-C204 VanDerWaalsContact O-N 3.11Å; Y201-C205 HydrophobicContact CD1-CB 4.06Å; Y201-C205 HydrophobicContact CD2-CB 4.3Å; Y201-C205 HydrophobicContact CE1-CB 3.64Å; Y201-C205 HydrophobicContact CE2-CB 3.87Å; Y201-C205 VanDerWaalsContact CE2-SG 3.55Å; Y201-C205 HydrophobicContact CG-CB 4.38Å; Y201-C205 WeakPolarHBondContact O-CB 3.35Å; Y201-C205 PolarHBondContact O-N 2.75Å
202	E	91.9	Very high	89.3	Confident	8 Å²	8	78 Å²	78	4%	0.037	40%	0.399	C	S	.	.	H	α-helix	trans	-55.7	-43.1	176.9	-74.5	158.8	-158.8	0	0	111.8	I180 W191 K198 C204 S206 I231 R233	I180-E202 HydrophobicContact CG1-CB 4.39Å; I180-E202 HydrophobicContact CG2-CB 4Å; I180-E202 HydrophobicContact CG2-CG 4.17Å; W191-E202 PolarHBondContact NE1-OE1 2.88Å; K198-E202 WeakPolarHBondContact O-CB 3.47Å; K198-E202 WeakPolarHBondContact O-CG 3.34Å; K198-E202 PolarHBondContact O-N 3.5Å; E202-C204 PolarHBondContact O-N 3.25Å; E202-S206 WeakPolarHBondContact O-CB 3.26Å; E202-S206 PolarHBondContact O-N 2.86Å; E202-S206 VanDerWaalsContact O-N 3.16Å; E202-S206 PolarHBondContact O-OG 3.35Å; E202-I231 HydrophobicContact CG-CD1 4.27Å; E202-R233 VanDerWaalsContact CD-NE 3.28Å; E202-R233 IonicContact OE1-CZ 3.32Å; E202-R233 VanDerWaalsContact OE1-CZ 3.32Å; E202-R233 IonicContact OE1-NE 3.08Å; E202-R233 PolarHBondContact OE1-NE 2.99Å; E202-R233 VanDerWaalsContact OE1-NE 3.08Å; E202-R233 IonicContact OE1-NH2 2.71Å; E202-R233 PolarHBondContact OE1-NH2 3.36Å; E202-R233 WeakPolarHBondContact OE2-CD 3.1Å; E202-R233 IonicContact OE2-CZ 3.55Å; E202-R233 IonicContact OE2-NE 2.73Å; E202-R233 PolarHBondContact OE2-NE 3.16Å; E202-R233 IonicContact OE2-NH2 3.65Å
203	K	88.6	Confident	88.8	Confident	178 Å²	178	77.5 Å²	77.5	77%	0.774	40%	0.397	S	S	*	.	H	α-helix	trans	-67.3	-35.2	177.5	-172.3	177	179.9	-179.3	0	113	R199 G200 Y201	R199-K203 PolarHBondContact O-N 3.47Å; R199-K203 VanDerWaalsContact O-N 3.1Å; G200-K203 PolarHBondContact O-N 3.01Å; Y201-K203 VanDerWaalsContact C-N 3.29Å; Y201-K203 PolarHBondContact O-N 2.92Å
204	C	89	Confident	87.9	Confident	108 Å²	108	72.9 Å²	72.9	73%	0.73	38%	0.38	S	S	*	.	H	α-helix	trans	-87.5	-37.6	-173.9	-173.5	0	0	0	0	113.3	G200 Y201 E202	G200-C204 WeakPolarHBondContact O-CB 3.48Å; G200-C204 PolarHBondContact O-N 3.45Å; G200-C204 VanDerWaalsContact O-N 3.11Å; Y201-C204 PolarHBondContact O-N 2.85Å; Y201-C204 VanDerWaalsContact O-N 3.11Å; E202-C204 PolarHBondContact O-N 3.25Å
205	C	91.6	Very high	86.8	Confident	48 Å²	48	80.8 Å²	80.8	32%	0.324	42%	0.415	S	S	.	.	H	α-helix	trans	-118.6	8.1	-167.1	-58.4	0	0	0	0	113.1	Y201	Y201-C205 HydrophobicContact CD1-CB 4.06Å; Y201-C205 HydrophobicContact CD2-CB 4.3Å; Y201-C205 HydrophobicContact CE1-CB 3.64Å; Y201-C205 HydrophobicContact CE2-CB 3.87Å; Y201-C205 VanDerWaalsContact CE2-SG 3.55Å; Y201-C205 HydrophobicContact CG-CB 4.38Å; Y201-C205 WeakPolarHBondContact O-CB 3.35Å; Y201-C205 PolarHBondContact O-N 2.75Å
206	S	92	Very high	85.7	Confident	29 Å²	29	85.2 Å²	85.2	20%	0.203	43%	0.428	C	S	.	.			trans	-64.9	136.7	168	50	0	0	0	0	110.3	I180 E202	I180-S206 VanDerWaalsContact CG2-CB 3.49Å; E202-S206 WeakPolarHBondContact O-CB 3.26Å; E202-S206 PolarHBondContact O-N 2.86Å; E202-S206 VanDerWaalsContact O-N 3.16Å; E202-S206 PolarHBondContact O-OG 3.35Å
207	W	92	Very high	84.7	Confident	71 Å²	71	89.5 Å²	89.5	27%	0.269	43%	0.428	S	S	.	.	S	Bend	trans	-74.9	-40.4	169.4	174	69.5	0	0	0	110	I181 K183 I220 I222 Y228	I181-W207 HydrophobicContact CB-CE3 4.39Å; I181-W207 HydrophobicContact CG2-CE3 3.93Å; I181-W207 HydrophobicContact CG2-CZ3 4.42Å; I181-W207 WeakPolarHBondContact O-CB 3.33Å; I181-W207 PolarHBondContact O-N 3.29Å; K183-W207 HydrophobicContact CB-CB 3.91Å; K183-W207 HydrophobicContact CB-CG 4.09Å; W207-I220 HydrophobicContact CZ3-CD1 3.89Å; W207-I222 HydrophobicContact CH2-CD1 3.88Å; W207-I222 HydrophobicContact CZ3-CD1 3.84Å; W207-Y228 HydrophobicContact CD2-CE1 4Å; W207-Y228 HydrophobicContact CE3-CD1 4.1Å; W207-Y228 AromaticContact CE3-CE1 3.72Å; W207-Y228 HydrophobicContact CE3-CE1 3.72Å; W207-Y228 HydrophobicContact CH2-CE1 4.41Å; W207-Y228 HydrophobicContact CZ3-CD1 4.36Å; W207-Y228 AromaticContact CZ3-CE1 3.92Å; W207-Y228 HydrophobicContact CZ3-CE1 3.92Å
208	Y	92.2	Very high	84.2	Confident	96 Å²	96	83.5 Å²	83.5	38%	0.376	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	157.1	175.6	-153.4	-90	0	0	0	111.4	I181 L210 I220	I181-Y208 PolarHBondContact N-O 3.22Å; I181-Y208 PolarHBondContact O-N 3.25Å; Y208-L210 HydrophobicContact CD1-CD2 4.13Å; Y208-L210 HydrophobicContact CD1-CG 4.25Å; Y208-L210 HydrophobicContact CE1-CD2 3.89Å; Y208-L210 HydrophobicContact CE1-CG 4.47Å; Y208-I220 HydrophobicContact CD1-CG2 3.28Å; Y208-I220 HydrophobicContact CD2-CG2 4.05Å; Y208-I220 HydrophobicContact CE1-CG2 3.21Å; Y208-I220 HydrophobicContact CE2-CG2 3.98Å; Y208-I220 HydrophobicContact CG-CG2 3.7Å
209	I	90.9	Very high	84	Confident	57 Å²	57	86 Å²	86	29%	0.292	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	116.2	173.3	-57.3	176.2	0	0	0	108	Q178 I179 I180 Q211	Q178-I209 HydrophobicContact CB-CG2 4.42Å; I179-I209 WeakPolarHBondContact O-CA 3.31Å; I180-I209 HydrophobicContact CG2-CG1 4.5Å; I209-Q211 HydrophobicContact CG2-CG 4.36Å
210	L	89.5	Confident	84.2	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.016	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.8	170.3	-66.4	170.6	0	0	0	109.3	I168 A170 Q178 I179 I181 Y208 Q218 I220	I168-L210 HydrophobicContact CG2-CD1 4.19Å; A170-L210 HydrophobicContact CB-CD1 4.31Å; Q178-L210 CarbonylContact C-O 3.54Å; Q178-L210 WeakPolarHBondContact CA-O 3.33Å; I179-L210 HydrophobicContact CB-CB 4.18Å; I179-L210 PolarHBondContact N-O 3.39Å; I179-L210 PolarHBondContact O-N 2.78Å; I181-L210 HydrophobicContact CD1-CD1 3.93Å; I181-L210 HydrophobicContact CD1-CG 4.18Å; Y208-L210 HydrophobicContact CD1-CD2 4.13Å; Y208-L210 HydrophobicContact CD1-CG 4.25Å; Y208-L210 HydrophobicContact CE1-CD2 3.89Å; Y208-L210 HydrophobicContact CE1-CG 4.47Å; L210-Q218 HydrophobicContact CD2-CB 3.61Å; L210-I220 HydrophobicContact CD1-CD1 4.17Å; L210-I220 HydrophobicContact CD2-CG2 3.73Å; L210-I220 HydrophobicContact CG-CD1 4.48Å; L210-I220 HydrophobicContact CG-CG2 4.43Å
211	Q	88.5	Confident	84.4	Confident	73 Å²	73	78.9 Å²	78.9	34%	0.341	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.7	175.2	-72.8	-177.6	-7.1	0	0	109.8	I209 D213 L214	I209-Q211 HydrophobicContact CG2-CG 4.36Å; Q211-D213 VanDerWaalsContact C-N 3.35Å; Q211-D213 WeakPolarHBondContact CB-OD1 3.44Å; Q211-L214 HydrophobicContact CB-CD1 3.74Å; Q211-L214 HydrophobicContact CB-CG 3.86Å
212	T	85	Confident	84.3	Confident	36 Å²	36	77.5 Å²	77.5	22%	0.221	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-8.3	-176.1	70.2	0	0	0	0	113.5	A170 F173 T177	A170-T212 HydrophobicContact CB-CG2 4.18Å; F173-T212 HydrophobicContact CB-CG2 4.31Å; F173-T212 HydrophobicContact CD2-CG2 3.51Å; F173-T212 HydrophobicContact CE2-CG2 3.98Å; F173-T212 HydrophobicContact CG-CG2 3.93Å; T177-T212 PolarHBondContact N-OG1 3.4Å; T177-T212 WeakPolarHBondContact O-CG2 3.27Å; T177-T212 PolarHBondContact O-N 2.92Å; T177-T212 PolarHBondContact O-OG1 3.09Å; T177-T212 VanDerWaalsContact O-OG1 3.12Å
213	D	78.2	Confident	84	Confident	61 Å²	61	83.4 Å²	83.4	33%	0.326	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.3	178.7	54.9	-33.9	0	0	0	113.9	P176 Q211 S237	P176-D213 HydrophobicContact CB-CB 3.92Å; P176-D213 HydrophobicContact CG-CB 4.34Å; Q211-D213 VanDerWaalsContact C-N 3.35Å; Q211-D213 WeakPolarHBondContact CB-OD1 3.44Å; D213-S237 WeakPolarHBondContact OD2-CB 3.39Å; D213-S237 PolarHBondContact OD2-OG 3.24Å
214	L	72.8	Confident	83.8	Confident	74 Å²	74	80.3 Å²	80.3	39%	0.387	40%	0.397	S	S	.	.	S	Bend	trans	-82.5	132.7	173.7	-61.1	176.9	0	0	0	110.1	Q211 N216 Q218	Q211-L214 HydrophobicContact CB-CD1 3.74Å; Q211-L214 HydrophobicContact CB-CG 3.86Å; L214-N216 PolarHBondContact O-N 2.73Å; L214-Q218 HydrophobicContact CD1-CG 4.48Å
215	E	65.5	Low	83.5	Confident	199 Å²	199	77.3 Å²	77.3	93%	0.93	37%	0.374	S	S	*	.	S	Bend	trans	-57.5	-32.9	178.9	-67.9	-174.6	160.8	0	0	112.4	R217	E215-R217 PolarHBondContact O-N 2.84Å
216	N	63.4	Low	83.2	Confident	135 Å²	135	76.4 Å²	76.4	72%	0.722	37%	0.366	S	S	*	.	S	Bend	trans	-81.1	115.7	176.9	-71.2	-26.3	0	0	0	110.2	L214 Q218	L214-N216 PolarHBondContact O-N 2.73Å; N216-Q218 PolarHBondContact O-N 3.11Å
217	R	64.8	Low	82.9	Confident	198 Å²	198	76.2 Å²	76.2	75%	0.747	36%	0.363	S	S	*	.			trans	-51	100.4	170.6	-68.7	-173	175.9	-164.8	0.6	110.2	Y169 E215 Q219	Y169-R217 HydrophobicContact CD2-CB 4.39Å; Y169-R217 HydrophobicContact CE2-CB 3.5Å; Y169-R217 VanDerWaalsContact CE2-CB 3.5Å; Y169-R217 HydrophobicContact CE2-CG 3.78Å; Y169-R217 WeakPolarHBondContact OH-CD 3.38Å; Y169-R217 VanDerWaalsContact OH-CG 3.22Å; Y169-R217 WeakPolarHBondContact OH-CG 3.48Å; Y169-R217 PolarHBondContact OH-NE 2.88Å; Y169-R217 VanDerWaalsContact OH-NE 3.15Å; E215-R217 PolarHBondContact O-N 2.84Å; R217-Q219 PolarHBondContact O-N 3.29Å
218	Q	76.2	Confident	82.8	Confident	54 Å²	54	72.9 Å²	72.9	25%	0.252	35%	0.35	S	S	.	.			trans	-76.8	114	176.3	-66.7	-171.4	-30.1	0	0	109.3	L210 L214 N216	L210-Q218 HydrophobicContact CD2-CB 3.61Å; L214-Q218 HydrophobicContact CD1-CG 4.48Å; N216-Q218 PolarHBondContact O-N 3.11Å
219	Q	85.6	Confident	82.8	Confident	112 Å²	112	68.3 Å²	68.3	52%	0.523	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	135.1	169.3	-179.7	-179.4	-4.4	0	0	108.1	A167 I168 R217	A167-Q219 HydrophobicContact CB-CG 4.01Å; I168-Q219 WeakPolarHBondContact O-CA 3.35Å; R217-Q219 PolarHBondContact O-N 3.29Å
220	I	90.5	Very high	82.8	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	143.5	172.1	60.2	-179.4	0	0	0	109	A167 I168 I181 W207 Y208 L210	A167-I220 CarbonylContact C-O 3.55Å; A167-I220 WeakPolarHBondContact CA-O 3.26Å; A167-I220 VanDerWaalsContact CB-O 3.29Å; A167-I220 WeakPolarHBondContact CB-O 3.46Å; I168-I220 HydrophobicContact CB-CD1 3.83Å; I168-I220 HydrophobicContact CB-CG1 3.63Å; I168-I220 HydrophobicContact CD1-CD1 3.85Å; I168-I220 HydrophobicContact CD1-CG1 4.43Å; I168-I220 HydrophobicContact CG1-CD1 4.04Å; I168-I220 HydrophobicContact CG1-CG1 4.07Å; I168-I220 PolarHBondContact N-O 3.18Å; I168-I220 PolarHBondContact O-N 2.8Å; I181-I220 HydrophobicContact CD1-CD1 3.1Å; W207-I220 HydrophobicContact CZ3-CD1 3.89Å; Y208-I220 HydrophobicContact CD1-CG2 3.28Å; Y208-I220 HydrophobicContact CD2-CG2 4.05Å; Y208-I220 HydrophobicContact CE1-CG2 3.21Å; Y208-I220 HydrophobicContact CE2-CG2 3.98Å; Y208-I220 HydrophobicContact CG-CG2 3.7Å; L210-I220 HydrophobicContact CD1-CD1 4.17Å; L210-I220 HydrophobicContact CD2-CG2 3.73Å; L210-I220 HydrophobicContact CG-CD1 4.48Å; L210-I220 HydrophobicContact CG-CG2 4.43Å
221	T	91.9	Very high	83	Confident	81 Å²	81	65.4 Å²	65.4	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.1	170.8	-54.3	0	0	0	0	108.3	D166	D166-T221 CarbonylContact O-C 3.56Å; D166-T221 WeakPolarHBondContact O-CA 3.4Å
222	I	89.8	Confident	83.1	Confident	1 Å²	1	62 Å²	62	1%	0.005	30%	0.302	C	S	.	.			trans	-78.3	124.9	-178.8	-60.8	-56.7	0	0	0	108.6	L162 N163 S164 G165 D166 I168 W207 Q224 Y228	L162-I222 HydrophobicContact CB-CB 4.49Å; L162-I222 HydrophobicContact CB-CD1 4.43Å; L162-I222 HydrophobicContact CB-CG1 3.87Å; L162-I222 HydrophobicContact CB-CG2 4.13Å; L162-I222 HydrophobicContact CD1-CD1 3.75Å; L162-I222 HydrophobicContact CD1-CG1 3.83Å; L162-I222 HydrophobicContact CG-CG1 4.48Å; N163-I222 WeakPolarHBondContact O-CB 2.93Å; N163-I222 VanDerWaalsContact O-CG2 3.24Å; N163-I222 WeakPolarHBondContact O-CG2 3.25Å; S164-I222 CarbonylContact C-O 3.58Å; S164-I222 VanDerWaalsContact CA-O 3.3Å; S164-I222 WeakPolarHBondContact CA-O 3.1Å; G165-I222 PolarHBondContact N-O 2.93Å; D166-I222 HydrophobicContact CB-CB 4.21Å; D166-I222 HydrophobicContact CB-CG1 4.02Å; D166-I222 WeakPolarHBondContact O-CB 3.36Å; D166-I222 WeakPolarHBondContact O-CG1 3.43Å; D166-I222 PolarHBondContact O-N 3.42Å; I168-I222 HydrophobicContact CD1-CD1 4.33Å; W207-I222 HydrophobicContact CH2-CD1 3.88Å; W207-I222 HydrophobicContact CZ3-CD1 3.84Å; I222-Q224 VanDerWaalsContact CG2-O 3.23Å; I222-Q224 WeakPolarHBondContact CG2-O 3.04Å; I222-Y228 HydrophobicContact CD1-CD1 4.21Å; I222-Y228 HydrophobicContact CD1-CD2 4.4Å; I222-Y228 HydrophobicContact CD1-CE1 3.97Å; I222-Y228 HydrophobicContact CD1-CE2 4.19Å; I222-Y228 HydrophobicContact CD1-CG 4.41Å; I222-Y228 HydrophobicContact CG2-CE2 3.61Å
223	E	86.6	Confident	83.3	Confident	131 Å²	131	61.6 Å²	61.6	61%	0.612	30%	0.296	S	S	*	.			trans	-86	-32.3	-177.4	-63.7	176.3	172.2	0	0	112.2	S164	S164-E223 WeakPolarHBondContact CB-O 3.29Å; S164-E223 PolarHBondContact OG-O 2.96Å
224	Q	84.6	Confident	83.7	Confident	113 Å²	113	60.7 Å²	60.7	53%	0.528	29%	0.293	S	S	.	.	S	Bend	trans	-137.7	143.8	-172.2	-65.4	-178.5	1.7	0	0	111.1	K183 I222 D226 Y228	K183-Q224 VanDerWaalsContact NZ-CD 3.35Å; I222-Q224 VanDerWaalsContact CG2-O 3.23Å; I222-Q224 WeakPolarHBondContact CG2-O 3.04Å; Q224-D226 PolarHBondContact O-N 2.81Å; Q224-Y228 PolarHBondContact O-OH 3.13Å; Q224-Y228 VanDerWaalsContact O-OH 3.09Å
225	N	81.5	Confident	84.1	Confident	45 Å²	45	57.6 Å²	57.6	24%	0.241	28%	0.277	C	S	.	.			trans	-64.6	118.4	176.3	-56.5	-10.3	0	0	0	109.6	L162 N163 S164	L162-N225 WeakPolarHBondContact O-CA 3.41Å; N163-N225 WeakPolarHBondContact CA-OD1 3.16Å; S164-N225 PolarHBondContact N-OD1 3.24Å
226	D	85.6	Confident	84.2	Confident	30 Å²	30	51.4 Å²	51.4	16%	0.16	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	174.5	177.2	-150.4	-18.9	0	0	0	111.6	M106 L162 K183 G184 Q224 Y228	M106-D226 HydrophobicContact CE-CB 4.28Å; L162-D226 PolarHBondContact N-O 3.37Å; L162-D226 PolarHBondContact O-N 3.12Å; K183-D226 HydrophobicContact CG-CB 4.24Å; G184-D226 WeakPolarHBondContact CA-OD1 3.33Å; G184-D226 WeakPolarHBondContact CA-OD2 3.48Å; G184-D226 PolarHBondContact N-OD2 2.79Å; Q224-D226 PolarHBondContact O-N 2.81Å; D226-Y228 HydrophobicContact CB-CD2 4.28Å; D226-Y228 HydrophobicContact CB-CE2 3.75Å; D226-Y228 WeakPolarHBondContact O-CD2 3.31Å
227	V	85.2	Confident	83.9	Confident	25 Å²	25	47.1 Å²	47.1	15%	0.152	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.9	164.5	-178.6	0	0	0	0	108.9	H159 G184	H159-V227 HydrophobicContact CB-CG1 4.18Å; G184-V227 WeakPolarHBondContact CA-O 3.37Å; G184-V227 PolarHBondContact N-O 2.84Å
228	Y	90.2	Very high	83.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.1	177.3	-71.2	-96.9	0	0	0	109.6	H159 L160 L162 I181 L182 K183 W207 I222 Q224 D226	H159-Y228 WeakPolarHBondContact CA-O 3.22Å; L160-Y228 PolarHBondContact N-O 2.84Å; L160-Y228 PolarHBondContact O-N 2.83Å; L162-Y228 HydrophobicContact CB-CD2 3.77Å; L162-Y228 HydrophobicContact CB-CE2 4.17Å; L162-Y228 HydrophobicContact CD1-CD2 3.99Å; L162-Y228 HydrophobicContact CD1-CG 4.05Å; L162-Y228 HydrophobicContact CG-CD2 4.11Å; I181-Y228 HydrophobicContact CG2-CD1 3.76Å; I181-Y228 HydrophobicContact CG2-CG 4.49Å; L182-Y228 CarbonylContact O-C 3.49Å; L182-Y228 WeakPolarHBondContact O-CA 3.4Å; K183-Y228 HydrophobicContact CB-CD1 4.13Å; K183-Y228 HydrophobicContact CB-CE1 3.78Å; K183-Y228 HydrophobicContact CD-CE1 4.07Å; K183-Y228 HydrophobicContact CG-CD1 4.33Å; K183-Y228 HydrophobicContact CG-CE1 3.69Å; W207-Y228 HydrophobicContact CD2-CE1 4Å; W207-Y228 HydrophobicContact CE3-CD1 4.1Å; W207-Y228 AromaticContact CE3-CE1 3.72Å; W207-Y228 HydrophobicContact CE3-CE1 3.72Å; W207-Y228 HydrophobicContact CH2-CE1 4.41Å; W207-Y228 HydrophobicContact CZ3-CD1 4.36Å; W207-Y228 AromaticContact CZ3-CE1 3.92Å; W207-Y228 HydrophobicContact CZ3-CE1 3.92Å; I222-Y228 HydrophobicContact CD1-CD1 4.21Å; I222-Y228 HydrophobicContact CD1-CD2 4.4Å; I222-Y228 HydrophobicContact CD1-CE1 3.97Å; I222-Y228 HydrophobicContact CD1-CE2 4.19Å; I222-Y228 HydrophobicContact CD1-CG 4.41Å; I222-Y228 HydrophobicContact CG2-CE2 3.61Å; Q224-Y228 PolarHBondContact O-OH 3.13Å; Q224-Y228 VanDerWaalsContact O-OH 3.09Å; D226-Y228 HydrophobicContact CB-CD2 4.28Å; D226-Y228 HydrophobicContact CB-CE2 3.75Å; D226-Y228 WeakPolarHBondContact O-CD2 3.31Å
229	T	91.6	Very high	81.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.3	176.4	-56.6	0	0	0	0	109.2	F157 T158 H159 I181 L182 M188 I231	F157-T229 HydrophobicContact CB-CG2 4.33Å; F157-T229 HydrophobicContact CD2-CG2 4.38Å; T158-T229 WeakPolarHBondContact O-CA 3.25Å; H159-T229 WeakPolarHBondContact CE1-CG2 3.5Å; H159-T229 PolarHBondContact CE1-OG1 2.91Å; H159-T229 VanDerWaalsContact CE1-OG1 3.25Å; H159-T229 PolarHBondContact ND1-OG1 3.47Å; I181-T229 CarbonylContact C-O 3.57Å; I181-T229 WeakPolarHBondContact CA-O 3.2Å; L182-T229 PolarHBondContact N-O 2.79Å; L182-T229 PolarHBondContact O-N 3.47Å; M188-T229 HydrophobicContact CG-CG2 4.48Å; T229-I231 HydrophobicContact CG2-CG1 4.09Å
230	L	92.7	Very high	80	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	109.7	178.2	-75.5	66.8	0	0	0	108.1	F157 T158 L160 I168 I179 I181 I256	F157-L230 CarbonylContact C-O 3.54Å; F157-L230 WeakPolarHBondContact CA-O 3.02Å; F157-L230 WeakPolarHBondContact CB-O 3.14Å; T158-L230 HydrophobicContact CG2-CB 4.06Å; T158-L230 PolarHBondContact N-O 3.29Å; T158-L230 PolarHBondContact O-N 2.92Å; L160-L230 HydrophobicContact CD1-CD1 3.87Å; L160-L230 HydrophobicContact CD1-CD2 3.86Å; L160-L230 HydrophobicContact CG-CD1 4.36Å; I168-L230 HydrophobicContact CD1-CD1 4.26Å; I168-L230 HydrophobicContact CD1-CD2 4.24Å; I168-L230 HydrophobicContact CG2-CD2 4.34Å; I179-L230 HydrophobicContact CG2-CB 3.88Å; I179-L230 HydrophobicContact CG2-CD2 4.2Å; I179-L230 HydrophobicContact CG2-CG 4.08Å; I181-L230 HydrophobicContact CG1-CG 4.23Å; I181-L230 HydrophobicContact CG2-CD1 4.41Å; L230-I256 HydrophobicContact CD2-CD1 3.98Å; L230-I256 HydrophobicContact CD2-CG2 4.11Å
231	I	92.1	Very high	77.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	114.8	176.6	-56.8	163	0	0	0	107.9	T156 F157 I179 I180 L182 W191 E202 T229 R233	T156-I231 CarbonylContact O-C 3.38Å; F157-I231 HydrophobicContact CB-CB 4.46Å; F157-I231 HydrophobicContact CB-CG1 4Å; I179-I231 CarbonylContact C-O 3.58Å; I179-I231 WeakPolarHBondContact CA-O 3.27Å; I180-I231 HydrophobicContact CB-CB 4.24Å; I180-I231 WeakPolarHBondContact CD1-O 3.24Å; I180-I231 PolarHBondContact N-O 2.85Å; I180-I231 PolarHBondContact O-N 3.32Å; L182-I231 HydrophobicContact CD1-CD1 3.6Å; L182-I231 HydrophobicContact CG-CD1 3.91Å; W191-I231 HydrophobicContact CD2-CD1 3.8Å; W191-I231 HydrophobicContact CE3-CD1 4.43Å; W191-I231 HydrophobicContact CG-CD1 4.05Å; W191-I231 HydrophobicContact CZ2-CD1 3.9Å; W191-I231 HydrophobicContact CZ2-CG1 4.34Å; W191-I231 HydrophobicContact CZ2-CG2 4.12Å; E202-I231 HydrophobicContact CG-CD1 4.27Å; T229-I231 HydrophobicContact CG2-CG1 4.09Å; I231-R233 HydrophobicContact CG2-CG 4.27Å
232	M	91.1	Very high	75.5	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.4	179.1	-66.4	157.7	-90.6	0	0	109.9	I149 W152 L154 P155 T156 T158 T177 I179 I256	I149-M232 HydrophobicContact CD1-CE 4.44Å; I149-M232 HydrophobicContact CD1-SD 3.28Å; I149-M232 WeakPolarHBondContact CD1-SD 3.21Å; I149-M232 HydrophobicContact CG1-SD 4.15Å; W152-M232 HydrophobicContact CE3-CE 4.13Å; W152-M232 HydrophobicContact CZ3-CE 3.92Å; L154-M232 HydrophobicContact CD2-CB 3.93Å; P155-M232 VanDerWaalsContact CA-O 3.31Å; P155-M232 WeakPolarHBondContact CA-O 3.31Å; T156-M232 HydrophobicContact CG2-CB 3.99Å; T156-M232 HydrophobicContact CG2-CE 3.77Å; T156-M232 HydrophobicContact CG2-SD 4.11Å; T156-M232 PolarHBondContact N-O 2.78Å; T156-M232 PolarHBondContact O-N 2.87Å; T158-M232 HydrophobicContact CG2-CE 4.14Å; T177-M232 HydrophobicContact CG2-CB 4.39Å; I179-M232 HydrophobicContact CG1-CG 4.12Å; I179-M232 HydrophobicContact CG2-CG 4.28Å; M232-I256 HydrophobicContact SD-CD1 4.1Å
233	R	88.8	Confident	73.2	Confident	28 Å²	28	64 Å²	64	11%	0.106	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.6	174.3	-59	-171.9	166.7	-85.5	0.8	110.4	P155 T177 Q178 I180 E202 I231 S235	P155-R233 HydrophobicContact CB-CG 4.07Å; T177-R233 CarbonylContact C-O 3.52Å; T177-R233 VanDerWaalsContact CA-O 3.3Å; T177-R233 WeakPolarHBondContact CA-O 3.17Å; T177-R233 VanDerWaalsContact CG2-O 3.31Å; T177-R233 WeakPolarHBondContact CG2-O 3.26Å; Q178-R233 HydrophobicContact CG-CB 3.74Å; Q178-R233 WeakPolarHBondContact CG-O 3.43Å; Q178-R233 PolarHBondContact N-O 2.78Å; Q178-R233 PolarHBondContact O-N 3.37Å; I180-R233 HydrophobicContact CD1-CB 4.38Å; I180-R233 HydrophobicContact CD1-CG 3.95Å; E202-R233 VanDerWaalsContact CD-NE 3.28Å; E202-R233 IonicContact OE1-CZ 3.32Å; E202-R233 VanDerWaalsContact OE1-CZ 3.32Å; E202-R233 IonicContact OE1-NE 3.08Å; E202-R233 PolarHBondContact OE1-NE 2.99Å; E202-R233 VanDerWaalsContact OE1-NE 3.08Å; E202-R233 IonicContact OE1-NH2 2.71Å; E202-R233 PolarHBondContact OE1-NH2 3.36Å; E202-R233 WeakPolarHBondContact OE2-CD 3.1Å; E202-R233 IonicContact OE2-CZ 3.55Å; E202-R233 IonicContact OE2-NE 2.73Å; E202-R233 PolarHBondContact OE2-NE 3.16Å; E202-R233 IonicContact OE2-NH2 3.65Å; I231-R233 HydrophobicContact CG2-CG 4.27Å; R233-S235 PolarHBondContact O-N 3.07Å
234	T	86.8	Confident	71	Confident	42 Å²	42	65.3 Å²	65.3	26%	0.258	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	136.5	161.9	48.1	0	0	0	0	109.7	L154 Q178	L154-T234 HydrophobicContact CD1-CG2 3.85Å; Q178-T234 PolarHBondContact NE2-O 2.7Å
235	S	81.6	Confident	69.2	Low	8 Å²	8	68.7 Å²	68.7	6%	0.056	36%	0.362	C	S	.	.			trans	-71.1	139.3	177.3	-173	0	0	0	0	109.9	P176 R233 S237	P176-S235 WeakPolarHBondContact O-CB 3.49Å; P176-S235 PolarHBondContact O-N 3.12Å; R233-S235 PolarHBondContact O-N 3.07Å; S235-S237 PolarHBondContact O-N 2.65Å; S235-S237 PolarHBondContact OG-OG 3.46Å; S235-S237 VanDerWaalsContact OG-OG 3.07Å
236	A	67.1	Low	67.6	Low	69 Å²	69	72.7 Å²	72.7	57%	0.57	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-72.9	-13.2	178.7	0	0	0	0	0	112.9	I238 V239	A236-I238 PolarHBondContact O-N 3.07Å; A236-I238 VanDerWaalsContact O-N 3.08Å; A236-V239 PolarHBondContact O-N 2.74Å
237	S	58.3	Low	65.9	Low	46 Å²	46	79.5 Å²	79.5	32%	0.322	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-56.3	-23.7	175.4	56.6	0	0	0	0	112.6	D213 S235 V239 N240	D213-S237 WeakPolarHBondContact OD2-CB 3.39Å; D213-S237 PolarHBondContact OD2-OG 3.24Å; S235-S237 PolarHBondContact O-N 2.65Å; S235-S237 PolarHBondContact OG-OG 3.46Å; S235-S237 VanDerWaalsContact OG-OG 3.07Å; S237-V239 VanDerWaalsContact C-N 3.3Å; S237-V239 PolarHBondContact O-N 3.15Å; S237-N240 PolarHBondContact O-N 2.72Å
238	I	50.2	Low	64.5	Low	53 Å²	53	82.1 Å²	82.1	27%	0.272	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-65.1	-29	175.2	-55.7	173.9	0	0	0	112.3	P176 A236 N240 Y241	P176-I238 HydrophobicContact CB-CD1 3.89Å; P176-I238 HydrophobicContact CB-CG1 3.87Å; P176-I238 HydrophobicContact CG-CD1 3.99Å; P176-I238 HydrophobicContact CG-CG1 3.88Å; A236-I238 PolarHBondContact O-N 3.07Å; A236-I238 VanDerWaalsContact O-N 3.08Å; I238-N240 PolarHBondContact O-N 2.6Å; I238-N240 VanDerWaalsContact O-N 3.12Å; I238-Y241 PolarHBondContact O-N 3.4Å
239	V	49.2	Very low	63.1	Low	126 Å²	126	83.8 Å²	83.8	76%	0.764	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-65.7	-21.9	-176.5	-172.1	0	0	0	0	111.9	A236 S237	A236-V239 PolarHBondContact O-N 2.74Å; S237-V239 VanDerWaalsContact C-N 3.3Å; S237-V239 PolarHBondContact O-N 3.15Å
240	N	45.2	Very low	62.3	Low	149 Å²	149	88.3 Å²	88.3	80%	0.797	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-88.8	-11.1	173.5	-84.9	0.7	0	0	0	114.3	S237 I238 S242	S237-N240 PolarHBondContact O-N 2.72Å; I238-N240 PolarHBondContact O-N 2.6Å; I238-N240 VanDerWaalsContact O-N 3.12Å; N240-S242 PolarHBondContact O-N 2.89Å
241	Y	43.4	Very low	61.8	Low	177 Å²	177	91.1 Å²	91.1	69%	0.694	49%	0.488	S	S	*	.			trans	-80.7	91.5	170.5	-81.5	-83.3	0	0	0	108.4	I238 Y243	I238-Y241 PolarHBondContact O-N 3.4Å; Y241-Y243 PolarHBondContact O-N 3.31Å
242	S	44.9	Very low	61.3	Low	108 Å²	108	91.2 Å²	91.2	76%	0.755	49%	0.489	S	S	*	.			trans	-63.1	17.9	173.4	51.4	0	0	0	0	114.8	N240	N240-S242 PolarHBondContact O-N 2.89Å
243	Y	40.7	Very low	61.1	Low	192 Å²	192	92.7 Å²	92.7	75%	0.753	50%	0.5	S	S	*	.			trans	-132.4	86.8	177.1	-81.3	-91.2	0	0	0	108.6	Y241	Y241-Y243 PolarHBondContact O-N 3.31Å
244	H	41.2	Very low	61.1	Low	160 Å²	160	91.4 Å²	91.4	74%	0.741	50%	0.495	S	S	*	.			trans	166	108.5	136	-83.7	-61.4	0	0	0	106.5	N246	H244-N246 PolarHBondContact O-N 2.74Å
245	L	46	Very low	61.1	Low	183 Å²	183	93.5 Å²	93.5	96%	0.958	50%	0.499	S	S	*	.			trans	-60.6	15.9	168.6	-93.8	111.5	0	0	0	113.9	E247	L245-E247 PolarHBondContact O-N 3.41Å
246	N	46.9	Very low	61.5	Low	130 Å²	130	93.2 Å²	93.2	70%	0.695	50%	0.497	S	S	*	.	S	Bend	trans	-87.6	114.6	173.4	-68.1	-6.3	0	0	0	106.3	H244	H244-N246 PolarHBondContact O-N 2.74Å
247	E	50.9	Low	62.4	Low	172 Å²	172	91.2 Å²	91.2	80%	0.804	48%	0.477	S	S	*	.			trans	-39.4	134.6	169.6	-69.4	-178.4	152.8	0	0	109.3	L245 S249	L245-E247 PolarHBondContact O-N 3.41Å; E247-S249 PolarHBondContact O-N 3.1Å
248	P	55.6	Low	63.8	Low	81 Å²	81	89.2 Å²	89.2	53%	0.526	46%	0.462	S	S	.	.			trans	-51.7	115.4	177.5	21.6	-31.6	0	0	0	106.9	T250	P248-T250 PolarHBondContact O-N 3.01Å
249	S	61.7	Low	65.6	Low	34 Å²	34	89.4 Å²	89.4	24%	0.238	46%	0.461	C	S	.	.			trans	-50.7	120.6	-174.2	54.5	0	0	0	0	107.6	H175 E247 V251	H175-S249 PolarHBondContact CD2-OG 2.85Å; H175-S249 VanDerWaalsContact CD2-OG 3.23Å; H175-S249 PolarHBondContact CE1-OG 2.63Å; H175-S249 VanDerWaalsContact CG-OG 3.26Å; H175-S249 PolarHBondContact ND1-OG 3.28Å; H175-S249 PolarHBondContact NE2-OG 3.19Å; E247-S249 PolarHBondContact O-N 3.1Å; S249-V251 PolarHBondContact O-N 2.97Å
250	T	72.9	Confident	67.3	Low	95 Å²	95	83.7 Å²	83.7	58%	0.583	43%	0.426	S	S	*	.	S	Bend	trans	-71.5	1.1	-179.6	55.3	0	0	0	0	111	S153 L154 P248	S153-T250 CarbonylContact C-O 3.53Å; S153-T250 WeakPolarHBondContact CA-O 3.48Å; L154-T250 PolarHBondContact N-O 3.48Å; P248-T250 PolarHBondContact O-N 3.01Å
251	V	82.7	Confident	69	Low	59 Å²	59	77.5 Å²	77.5	36%	0.358	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.5	-173.3	179.6	0	0	0	0	109.9	N151 W152 S249	N151-V251 HydrophobicContact CB-CG1 3.65Å; N151-V251 WeakPolarHBondContact O-CG1 3.33Å; W152-V251 CarbonylContact O-C 3.53Å; W152-V251 VanDerWaalsContact O-CA 3.26Å; W152-V251 WeakPolarHBondContact O-CA 3.25Å; S249-V251 PolarHBondContact O-N 2.97Å
252	G	81.4	Confident	70.6	Confident	2 Å²	2	69.9 Å²	69.9	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	148.7	-179.8	0	0	0	0	0	112.8	N151 W152	N151-G252 WeakPolarHBondContact CA-O 3.29Å; N151-G252 PolarHBondContact N-O 2.72Å; W152-G252 PolarHBondContact N-O 2.95Å; W152-G252 PolarHBondContact O-N 3.05Å
253	S	88	Confident	72.2	Confident	33 Å²	33	65.2 Å²	65.2	23%	0.231	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.6	167.3	-70.7	0	0	0	0	108.9	I149 N151 F173 S174	I149-S253 CarbonylContact O-C 3.56Å; I149-S253 WeakPolarHBondContact O-CA 3.4Å; N151-S253 PolarHBondContact N-OG 2.76Å; N151-S253 PolarHBondContact OD1-OG 2.83Å; N151-S253 VanDerWaalsContact OD1-OG 3.05Å; F173-S253 CarbonylContact C-O 3.47Å; F173-S253 VanDerWaalsContact CA-O 3.25Å; F173-S253 WeakPolarHBondContact CA-O 3.33Å; S174-S253 PolarHBondContact N-O 3.21Å; S174-S253 PolarHBondContact OG-N 3.39Å; S174-S253 PolarHBondContact OG-O 2.84Å
254	G	87.9	Confident	74.2	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-179.7	-177.2	0	0	0	0	0	113	I149 N172	I149-G254 WeakPolarHBondContact CB-O 3.41Å; I149-G254 PolarHBondContact N-O 3.05Å; I149-G254 PolarHBondContact O-N 3.4Å; N172-G254 WeakPolarHBondContact O-CA 3.5Å
255	Y	87.7	Confident	75.9	Confident	86 Å²	86	52.5 Å²	52.5	34%	0.337	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.7	-178.1	-63	-95	0	0	0	110.2	V148 A170 H171 N172 F173	V148-Y255 HydrophobicContact CB-CD1 4.42Å; V148-Y255 HydrophobicContact CB-CE1 4.25Å; V148-Y255 HydrophobicContact CG1-CD1 4.16Å; V148-Y255 HydrophobicContact CG1-CE1 3.61Å; V148-Y255 HydrophobicContact CG2-CD1 4.01Å; V148-Y255 HydrophobicContact CG2-CE1 3.85Å; A170-Y255 WeakPolarHBondContact CA-O 3.36Å; H171-Y255 PolarHBondContact N-O 2.76Å; H171-Y255 WeakPolarHBondContact NE2-CB 3.29Å; H171-Y255 PolarHBondContact O-N 3.23Å; N172-Y255 HydrophobicContact CB-CD2 3.89Å; N172-Y255 HydrophobicContact CB-CE2 4.39Å; F173-Y255 WeakPolarHBondContact CE2-O 3.32Å
256	I	88.6	Confident	77.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	102.6	168.9	-56.2	174.1	0	0	0	107.2	S146 L147 I149 I168 Y169 F173 I179 L230 M232 L258	S146-I256 CarbonylContact C-O 3.42Å; S146-I256 WeakPolarHBondContact CA-O 3.5Å; L147-I256 HydrophobicContact CB-CB 4.2Å; L147-I256 HydrophobicContact CD1-CB 4.49Å; L147-I256 PolarHBondContact N-O 2.76Å; L147-I256 PolarHBondContact O-N 2.92Å; I149-I256 HydrophobicContact CD1-CD1 3.67Å; I149-I256 HydrophobicContact CD1-CG1 3.86Å; I168-I256 HydrophobicContact CG2-CG2 3.42Å; I168-I256 VanDerWaalsContact CG2-CG2 3.42Å; Y169-I256 CarbonylContact O-C 3.51Å; Y169-I256 WeakPolarHBondContact O-CA 3.46Å; F173-I256 HydrophobicContact CE2-CG1 4.34Å; F173-I256 HydrophobicContact CZ-CD1 4.41Å; F173-I256 HydrophobicContact CZ-CG1 3.91Å; I179-I256 HydrophobicContact CD1-CD1 3.83Å; I179-I256 HydrophobicContact CD1-CG1 3.97Å; L230-I256 HydrophobicContact CD2-CD1 3.98Å; L230-I256 HydrophobicContact CD2-CG2 4.11Å; M232-I256 HydrophobicContact SD-CD1 4.1Å; I256-L258 HydrophobicContact CG2-CD2 4.16Å
257	D	88.1	Confident	79.2	Confident	28 Å²	28	47.4 Å²	47.4	15%	0.15	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.4	173.6	-71.5	-11.1	0	0	0	110.3	Y145 S146 I168 Y169 H171 F259	Y145-D257 CarbonylContact O-C 3.6Å; Y145-D257 VanDerWaalsContact O-CA 3.31Å; Y145-D257 WeakPolarHBondContact O-CA 3.42Å; S146-D257 WeakPolarHBondContact CB-OD1 3.49Å; S146-D257 PolarHBondContact OG-OD1 3.07Å; I168-D257 WeakPolarHBondContact CA-O 3.41Å; Y169-D257 HydrophobicContact CD1-CB 4.03Å; Y169-D257 PolarHBondContact N-O 2.78Å; Y169-D257 PolarHBondContact O-N 2.8Å; H171-D257 IonicContact CD2-OD2 3.5Å; H171-D257 IonicContact NE2-OD1 3.34Å; H171-D257 PolarHBondContact NE2-OD1 2.75Å; H171-D257 IonicContact NE2-OD2 3.13Å; H171-D257 PolarHBondContact NE2-OD2 2.7Å; H171-D257 VanDerWaalsContact NE2-OD2 3.13Å; D257-F259 HydrophobicContact CB-CE2 4.17Å
258	L	87.5	Confident	80.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	117.4	178.9	-56.8	174.7	0	0	0	107.9	Y145 L147 L160 A167 I168 I256 R260	Y145-L258 PolarHBondContact N-O 2.71Å; Y145-L258 PolarHBondContact O-N 2.85Å; L147-L258 HydrophobicContact CD1-CD1 3.98Å; L147-L258 HydrophobicContact CD2-CD1 4.13Å; L147-L258 HydrophobicContact CG-CD1 3.8Å; L147-L258 HydrophobicContact CG-CG 4.42Å; L160-L258 HydrophobicContact CD1-CD1 3.93Å; L160-L258 HydrophobicContact CD1-CD2 3.84Å; L160-L258 HydrophobicContact CD2-CD1 4.33Å; A167-L258 WeakPolarHBondContact O-CA 3.44Å; I168-L258 HydrophobicContact CB-CD2 4.3Å; I168-L258 HydrophobicContact CD1-CD2 4.44Å; I168-L258 HydrophobicContact CG1-CD2 3.9Å; I168-L258 HydrophobicContact CG2-CD2 3.97Å; I256-L258 HydrophobicContact CG2-CD2 4.16Å; L258-R260 HydrophobicContact CB-CG 3.74Å
259	F	87.9	Confident	81.9	Confident	56 Å²	56	41.5 Å²	41.5	25%	0.246	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	91.6	170.1	-60	-94.2	0	0	0	106.6	L142 N144 D166 A167 D257	L142-F259 HydrophobicContact CD2-CB 4.5Å; N144-F259 HydrophobicContact CB-CD1 4.49Å; N144-F259 HydrophobicContact CB-CE1 4.45Å; N144-F259 WeakPolarHBondContact OD1-CD1 3.32Å; N144-F259 WeakPolarHBondContact OD1-CE1 3.06Å; D166-F259 CarbonylContact C-O 3.57Å; D166-F259 VanDerWaalsContact CA-O 3.24Å; D166-F259 WeakPolarHBondContact CA-O 3.46Å; A167-F259 HydrophobicContact CB-CB 4.16Å; A167-F259 HydrophobicContact CB-CD2 4.28Å; A167-F259 PolarHBondContact N-O 2.68Å; A167-F259 PolarHBondContact O-N 3.14Å; D257-F259 HydrophobicContact CB-CE2 4.17Å
260	R	84.7	Confident	83	Confident	6 Å²	6	43.3 Å²	43.3	2%	0.023	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	130.3	-170.3	-47.9	176.4	67.8	176.7	-2.8	111.5	G92 D93 Q143 Y145 R161 D166 L258 R262	G92-R260 PolarHBondContact O-NH1 3.27Å; D93-R260 IonicContact OD1-CZ 2.93Å; D93-R260 VanDerWaalsContact OD1-CZ 3.28Å; D93-R260 IonicContact OD1-NH1 3.99Å; D93-R260 PolarHBondContact OD1-NH1 3.41Å; D93-R260 IonicContact OD1-NH2 2.91Å; D93-R260 PolarHBondContact OD1-NH2 2.73Å; Q143-R260 PolarHBondContact N-O 2.99Å; Q143-R260 PolarHBondContact O-N 2.85Å; Y145-R260 HydrophobicContact CD2-CB 4.25Å; Y145-R260 HydrophobicContact CD2-CG 3.91Å; Y145-R260 HydrophobicContact CE2-CB 3.9Å; Y145-R260 HydrophobicContact CE2-CG 4.05Å; R161-R260 PolarHBondContact O-NH2 2.84Å; D166-R260 WeakPolarHBondContact OD1-CA 3.48Å; D166-R260 IonicContact OD2-NE 3.58Å; L258-R260 HydrophobicContact CB-CG 3.74Å; R260-R262 HydrophobicContact CB-CG 4.33Å
261	T	80	Confident	83.8	Confident	20 Å²	20	41.7 Å²	41.7	12%	0.123	25%	0.246	C	C	.	.			trans	-74.5	121.5	159.2	62.6	0	0	0	0	108.3	L142 N163 D166	L142-T261 HydrophobicContact CD2-CG2 3.35Å; L142-T261 HydrophobicContact CG-CG2 4.13Å; N163-T261 WeakPolarHBondContact CB-OG1 3.1Å; N163-T261 PolarHBondContact ND2-O 2.93Å; D166-T261 WeakPolarHBondContact OD1-CA 3.35Å; D166-T261 WeakPolarHBondContact OD1-CB 3.37Å; D166-T261 PolarHBondContact OD1-N 2.51Å; D166-T261 PolarHBondContact OD1-OG1 2.6Å
262	R	77.8	Confident	84.1	Confident	16 Å²	16	41.5 Å²	41.5	6%	0.06	24%	0.243	C	C	.	.			trans	-119.6	152.8	177.9	-66.6	-172	78.8	-162	6.3	109.1	G92 Y139 G140 Y145 R260 A264 D293	G92-R262 PolarHBondContact O-NE 3.48Å; G92-R262 PolarHBondContact O-NH2 2.9Å; Y139-R262 CarbonylContact C-O 3.32Å; Y139-R262 WeakPolarHBondContact CA-O 2.95Å; G140-R262 PolarHBondContact N-O 3.24Å; Y145-R262 WeakPolarHBondContact OH-CD 3.42Å; R260-R262 HydrophobicContact CB-CG 4.33Å; R262-A264 PolarHBondContact O-N 3.06Å; R262-D293 IonicContact CZ-OD1 2.91Å; R262-D293 IonicContact CZ-OD2 3.28Å; R262-D293 IonicContact NH2-OD1 2.69Å; R262-D293 PolarHBondContact NH2-OD1 2.79Å; R262-D293 IonicContact NH2-OD2 3.05Å; R262-D293 PolarHBondContact NH2-OD2 3.32Å
263	W	79.3	Confident	84.4	Confident	10 Å²	10	41.7 Å²	41.7	4%	0.038	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-58.6	129	162.9	174.1	75.7	0	0	0	109.6	Q94 W131 P137 H138 P265 D269 I291	Q94-W263 PolarHBondContact NE2-O 2.69Å; Q94-W263 VanDerWaalsContact NE2-O 3.1Å; W131-W263 HydrophobicContact CB-CH2 3.39Å; W131-W263 HydrophobicContact CB-CZ2 4.33Å; W131-W263 HydrophobicContact CB-CZ3 3.66Å; W131-W263 AromaticContact CD1-CZ3 3.59Å; W131-W263 AromaticContact CD2-CH2 3.7Å; W131-W263 HydrophobicContact CD2-CH2 3.7Å; W131-W263 AromaticContact CD2-CZ3 3.5Å; W131-W263 HydrophobicContact CD2-CZ3 3.5Å; W131-W263 VanDerWaalsContact CD2-CZ3 3.5Å; W131-W263 AromaticContact CE2-CZ3 3.92Å; W131-W263 AromaticContact CE3-CH2 3.84Å; W131-W263 HydrophobicContact CE3-CH2 3.84Å; W131-W263 HydrophobicContact CE3-CZ3 4.02Å; W131-W263 HydrophobicContact CG-CE3 4.42Å; W131-W263 AromaticContact CG-CH2 3.52Å; W131-W263 HydrophobicContact CG-CH2 3.52Å; W131-W263 AromaticContact CG-CZ3 3.31Å; W131-W263 HydrophobicContact CG-CZ3 3.31Å; W131-W263 AromaticContact NE1-CZ3 3.92Å; P137-W263 HydrophobicContact CB-CB 4.2Å; P137-W263 HydrophobicContact CB-CG 4.03Å; H138-W263 CarbonylContact O-C 3.46Å; H138-W263 VanDerWaalsContact O-CA 3.29Å; H138-W263 WeakPolarHBondContact O-CA 3.23Å; H138-W263 VanDerWaalsContact O-CD1 3.27Å; W263-P265 HydrophobicContact CH2-CB 3.43Å; W263-P265 VanDerWaalsContact CH2-CB 3.43Å; W263-P265 HydrophobicContact CH2-CG 4.46Å; W263-P265 HydrophobicContact CZ2-CB 4.13Å; W263-P265 HydrophobicContact CZ3-CB 3.64Å; W263-P265 HydrophobicContact CZ3-CG 4.21Å; W263-D269 HydrophobicContact CH2-CB 4.07Å; W263-D269 HydrophobicContact CZ2-CB 3.95Å; W263-D269 WeakPolarHBondContact CZ2-OD2 3.24Å; W263-I291 HydrophobicContact CB-CD1 3.74Å; W263-I291 HydrophobicContact CD2-CD1 3.26Å; W263-I291 HydrophobicContact CE3-CD1 3.86Å; W263-I291 HydrophobicContact CE3-CG2 4.36Å; W263-I291 HydrophobicContact CG-CD1 3.21Å; W263-I291 HydrophobicContact CZ2-CD1 4.28Å
264	A	80.7	Confident	84.4	Confident	26 Å²	26	43.1 Å²	43.1	22%	0.215	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-100.7	128.3	171.3	0	0	0	0	0	109.4	H138 R262 N266	H138-A264 PolarHBondContact O-N 2.91Å; R262-A264 PolarHBondContact O-N 3.06Å; A264-N266 PolarHBondContact O-N 2.9Å
265	P	78	Confident	84.3	Confident	59 Å²	59	43.2 Å²	43.2	38%	0.383	25%	0.25	S	S	.	.	P	Polyproline II helix	trans	-63.8	131.2	174.5	25.6	-32	0	0	0	110.4	W131 W263	W131-P265 HydrophobicContact CD2-CB 4.46Å; W131-P265 HydrophobicContact CE3-CB 3.81Å; W131-P265 HydrophobicContact CH2-CB 4.11Å; W131-P265 HydrophobicContact CH2-CG 3.97Å; W131-P265 HydrophobicContact CZ2-CG 4.46Å; W131-P265 HydrophobicContact CZ3-CB 3.6Å; W131-P265 HydrophobicContact CZ3-CG 3.98Å; W263-P265 HydrophobicContact CH2-CB 3.43Å; W263-P265 VanDerWaalsContact CH2-CB 3.43Å; W263-P265 HydrophobicContact CH2-CG 4.46Å; W263-P265 HydrophobicContact CZ2-CB 4.13Å; W263-P265 HydrophobicContact CZ3-CB 3.64Å; W263-P265 HydrophobicContact CZ3-CG 4.21Å
266	N	82.1	Confident	84.2	Confident	66 Å²	66	41.5 Å²	41.5	35%	0.353	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-71.1	154.7	161.8	-61.5	-62.9	0	0	0	109.1	A264 C268 D269	A264-N266 PolarHBondContact O-N 2.9Å; N266-C268 PolarHBondContact O-N 3.42Å; N266-D269 VanDerWaalsContact CB-OD2 3.22Å; N266-D269 WeakPolarHBondContact CB-OD2 3.5Å; N266-D269 PolarHBondContact N-OD2 2.71Å; N266-D269 PolarHBondContact ND2-OD2 2.84Å; N266-D269 WeakPolarHBondContact O-CB 3.48Å; N266-D269 PolarHBondContact O-N 2.79Å
267	P	78.9	Confident	84	Confident	141 Å²	141	47 Å²	47	92%	0.916	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-22.5	173.3	-26.4	34.8	0	0	0	114
268	C	81.6	Confident	83.9	Confident	116 Å²	116	49 Å²	49	78%	0.784	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.8	179.1	-60.7	0	0	0	0	114.1	N266 P270	N266-C268 PolarHBondContact O-N 3.42Å; C268-P270 WeakPolarHBondContact O-CD 3.27Å
269	D	83.1	Confident	84	Confident	12 Å²	12	52 Å²	52	6%	0.064	31%	0.314	C	S	.	.			trans	-89.2	100.9	-179.5	-68.8	-36.4	0	0	0	109.7	T132 P134 W263 N266	T132-D269 WeakPolarHBondContact O-CB 3.3Å; P134-D269 WeakPolarHBondContact CD-OD1 3.4Å; W263-D269 HydrophobicContact CH2-CB 4.07Å; W263-D269 HydrophobicContact CZ2-CB 3.95Å; W263-D269 WeakPolarHBondContact CZ2-OD2 3.24Å; N266-D269 VanDerWaalsContact CB-OD2 3.22Å; N266-D269 WeakPolarHBondContact CB-OD2 3.5Å; N266-D269 PolarHBondContact N-OD2 2.71Å; N266-D269 PolarHBondContact ND2-OD2 2.84Å; N266-D269 WeakPolarHBondContact O-CB 3.48Å; N266-D269 PolarHBondContact O-N 2.79Å
270	P	85.3	Confident	84.1	Confident	72 Å²	72	52.8 Å²	52.8	47%	0.468	32%	0.321	S	S	.	.			trans	-71	142	-176	27.7	-36.2	0	0	0	112.2	T132 C268 I272	T132-P270 HydrophobicContact CG2-CG 4.5Å; T132-P270 PolarHBondContact N-O 3.32Å; T132-P270 VanDerWaalsContact N-O 3.1Å; T132-P270 WeakPolarHBondContact OG1-CD 3.46Å; T132-P270 WeakPolarHBondContact OG1-CG 3.32Å; C268-P270 WeakPolarHBondContact O-CD 3.27Å; P270-I272 PolarHBondContact O-N 3.18Å
271	V	88.3	Confident	84.3	Confident	61 Å²	61	53.4 Å²	53.4	37%	0.37	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	109.7	163.2	-177.5	0	0	0	0	107.6	W131 C273 D274	W131-V271 HydrophobicContact CD2-CG2 4.01Å; W131-V271 HydrophobicContact CE3-CB 4.48Å; W131-V271 HydrophobicContact CE3-CG2 3.43Å; W131-V271 VanDerWaalsContact CE3-CG2 3.43Å; W131-V271 HydrophobicContact CH2-CG2 3.53Å; W131-V271 HydrophobicContact CZ2-CG2 4.1Å; W131-V271 HydrophobicContact CZ3-CG2 3.17Å; V271-C273 VanDerWaalsContact C-N 3.35Å; V271-C273 VanDerWaalsContact CG1-C 3.44Å; V271-C273 WeakPolarHBondContact CG1-O 3.44Å; V271-D274 HydrophobicContact CG1-CB 4.01Å
272	I	89.1	Confident	84.8	Confident	56 Å²	56	59.4 Å²	59.4	29%	0.287	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-14.6	174.1	52.5	169.9	0	0	0	112.4	V130 T132 P270 I283 P287	V130-I272 HydrophobicContact CB-CG1 4.13Å; V130-I272 HydrophobicContact CG1-CD1 3.96Å; V130-I272 HydrophobicContact CG1-CG1 4.04Å; V130-I272 VanDerWaalsContact O-CG1 3.25Å; V130-I272 WeakPolarHBondContact O-CG1 3.17Å; V130-I272 PolarHBondContact O-N 3.01Å; T132-I272 HydrophobicContact CG2-CB 4.35Å; T132-I272 HydrophobicContact CG2-CD1 3.82Å; T132-I272 HydrophobicContact CG2-CG1 4.1Å; T132-I272 HydrophobicContact CG2-CG2 3.42Å; T132-I272 VanDerWaalsContact CG2-CG2 3.42Å; P270-I272 PolarHBondContact O-N 3.18Å; I272-I283 HydrophobicContact CD1-CD1 3.65Å; I272-I283 HydrophobicContact CD1-CG1 4.17Å; I272-I283 HydrophobicContact CD1-CG2 4.29Å; I272-I283 HydrophobicContact CG1-CD1 4.27Å; I272-P287 HydrophobicContact CD1-CG 3.78Å
273	C	88.9	Confident	85.3	Confident	6 Å²	6	59.3 Å²	59.3	4%	0.041	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	120.5	176.6	-170.3	0	0	0	0	110.8	R129 V130 V271 C281	R129-C273 CarbonylContact C-O 3.41Å; R129-C273 WeakPolarHBondContact CA-O 3.24Å; V130-C273 HydrophobicContact CB-CB 3.56Å; V130-C273 HydrophobicContact CG2-CB 3.66Å; V130-C273 PolarHBondContact N-O 3.47Å; V130-C273 PolarHBondContact O-N 3.37Å; V271-C273 VanDerWaalsContact C-N 3.35Å; V271-C273 VanDerWaalsContact CG1-C 3.44Å; V271-C273 WeakPolarHBondContact CG1-O 3.44Å; C273-C281 WeakPolarHBondContact CA-SG 3.35Å; C273-C281 HydrophobicContact CB-CB 4.09Å; C273-C281 WeakPolarHBondContact CB-SG 3.47Å; C273-C281 WeakPolarHBondContact SG-CB 3.41Å; C273-C281 CovalentContact SG-SG 2Å; C273-C281 PolarHBondContact SG-SG 2.96Å
274	D	88	Confident	85.6	Confident	62 Å²	62	64.8 Å²	64.8	33%	0.332	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	101.7	170.2	-165.8	6.6	0	0	0	110.3	R129 V271 T276	R129-D274 WeakPolarHBondContact CG-OD1 3.23Å; R129-D274 IonicContact CZ-OD1 3.94Å; R129-D274 IonicContact NE-OD1 3.07Å; R129-D274 PolarHBondContact NE-OD1 3.19Å; R129-D274 IonicContact NE-OD2 3.73Å; R129-D274 IonicContact NH2-OD1 2.69Å; R129-D274 IonicContact NH2-OD2 2.63Å; V271-D274 HydrophobicContact CG1-CB 4.01Å; D274-T276 PolarHBondContact O-N 2.8Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.35Å; D274-T276 PolarHBondContact OD1-N 3.15Å; D274-T276 PolarHBondContact OD1-OG1 2.66Å; D274-T276 VanDerWaalsContact OD1-OG1 3.12Å; D274-T276 PolarHBondContact OD2-OG1 2.91Å
275	G	85.2	Confident	85.8	Confident	4 Å²	4	67.5 Å²	67.5	4%	0.041	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	16.5	177.7	0	0	0	0	0	113.7	L126 K127 I128 T277 T278	L126-G275 CarbonylContact C-O 3.56Å; L126-G275 VanDerWaalsContact CA-O 3.27Å; L126-G275 WeakPolarHBondContact CA-O 3.44Å; L126-G275 WeakPolarHBondContact CB-O 3Å; K127-G275 PolarHBondContact N-O 2.84Å; I128-G275 WeakPolarHBondContact O-CA 3.43Å; I128-G275 PolarHBondContact O-N 2.8Å; G275-T277 VanDerWaalsContact C-N 3.28Å; G275-T277 PolarHBondContact O-N 3.36Å; G275-T278 WeakPolarHBondContact CA-O 3.27Å
276	T	85.2	Confident	86.1	Confident	50 Å²	50	64.9 Å²	64.9	31%	0.307	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.6	171.7	47.6	0	0	0	0	112.2	D274	D274-T276 PolarHBondContact O-N 2.8Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.35Å; D274-T276 PolarHBondContact OD1-N 3.15Å; D274-T276 PolarHBondContact OD1-OG1 2.66Å; D274-T276 VanDerWaalsContact OD1-OG1 3.12Å; D274-T276 PolarHBondContact OD2-OG1 2.91Å
277	T	84.1	Confident	86.1	Confident	116 Å²	116	62.8 Å²	62.8	71%	0.712	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-20.2	-177.2	53.6	0	0	0	0	114	G275	G275-T277 VanDerWaalsContact C-N 3.28Å; G275-T277 PolarHBondContact O-N 3.36Å
278	T	87.1	Confident	86.2	Confident	70 Å²	70	62.5 Å²	62.5	43%	0.429	36%	0.36	S	S	.	.			trans	-135.9	135.7	-173.6	52.6	0	0	0	0	111.7	G275 L280	G275-T278 WeakPolarHBondContact CA-O 3.27Å; T278-L280 VanDerWaalsContact C-N 3.32Å
279	T	88.1	Confident	86.2	Confident	66 Å²	66	57.5 Å²	57.5	41%	0.405	33%	0.326	S	S	.	.	S	Bend	trans	-80.7	-14.2	174.7	51.3	0	0	0	0	113.6	R122 S123 L126	R122-T279 CarbonylContact C-O 3.54Å; R122-T279 WeakPolarHBondContact CA-O 3.41Å; S123-T279 PolarHBondContact N-O 2.78Å; S123-T279 VanDerWaalsContact O-CB 3.26Å; S123-T279 WeakPolarHBondContact O-CB 3.33Å; L126-T279 HydrophobicContact CD2-CG2 3.86Å; L126-T279 HydrophobicContact CG-CG2 4.49Å
280	L	90.6	Very high	86.3	Confident	74 Å²	74	56.9 Å²	56.9	39%	0.387	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.5	-178.8	167.6	65.1	0	0	0	109.9	E120 R122 T278 K282	E120-L280 HydrophobicContact CG-CD1 3.48Å; E120-L280 VanDerWaalsContact CG-CD1 3.48Å; E120-L280 WeakPolarHBondContact OE1-CD1 3.48Å; R122-L280 HydrophobicContact CG-CD1 3.52Å; T278-L280 VanDerWaalsContact C-N 3.32Å; L280-K282 HydrophobicContact CD1-CG 4.43Å
281	C	89.5	Confident	86.3	Confident	18 Å²	18	53.6 Å²	53.6	12%	0.122	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	130.1	-178.9	-158.5	0	0	0	0	111.3	E120 I121 C273	E120-C281 CarbonylContact C-O 3.59Å; E120-C281 WeakPolarHBondContact CA-O 3.38Å; I121-C281 HydrophobicContact CB-CB 4.4Å; I121-C281 PolarHBondContact N-O 2.89Å; I121-C281 PolarHBondContact O-N 2.68Å; C273-C281 WeakPolarHBondContact CA-SG 3.35Å; C273-C281 HydrophobicContact CB-CB 4.09Å; C273-C281 WeakPolarHBondContact CB-SG 3.47Å; C273-C281 WeakPolarHBondContact SG-CB 3.41Å; C273-C281 CovalentContact SG-SG 2Å; C273-C281 PolarHBondContact SG-SG 2.96Å
282	K	90	Very high	86.3	Confident	147 Å²	147	50.8 Å²	50.8	64%	0.639	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.6	-179.1	-67.4	-176.9	177.3	-179.8	0	109.5	E120 L280	E120-K282 HydrophobicContact CB-CG 4.5Å; E120-K282 HydrophobicContact CG-CG 4.14Å; E120-K282 WeakPolarHBondContact OE2-CE 3.32Å; L280-K282 HydrophobicContact CD1-CG 4.43Å
283	I	88.2	Confident	86.2	Confident	13 Å²	13	48.6 Å²	48.6	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	111.6	179.1	-59.5	154.1	0	0	0	107.1	H118 L119 I121 I272 S285	H118-I283 VanDerWaalsContact CA-O 3.3Å; H118-I283 WeakPolarHBondContact CA-O 3.25Å; H118-I283 VanDerWaalsContact CB-O 3.3Å; H118-I283 WeakPolarHBondContact CB-O 3.22Å; L119-I283 HydrophobicContact CB-CB 4.23Å; L119-I283 HydrophobicContact CB-CD1 4.19Å; L119-I283 HydrophobicContact CD1-CD1 4.43Å; L119-I283 PolarHBondContact N-O 2.97Å; L119-I283 PolarHBondContact O-N 2.87Å; I121-I283 HydrophobicContact CD1-CD1 3.73Å; I121-I283 HydrophobicContact CG1-CD1 4.45Å; I272-I283 HydrophobicContact CD1-CD1 3.65Å; I272-I283 HydrophobicContact CD1-CG1 4.17Å; I272-I283 HydrophobicContact CD1-CG2 4.29Å; I272-I283 HydrophobicContact CG1-CD1 4.27Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 VanDerWaalsContact CG2-O 3.28Å; I283-S285 WeakPolarHBondContact CG2-O 3.1Å; I283-S285 PolarHBondContact O-N 3.09Å
284	T	85.4	Confident	86.2	Confident	126 Å²	126	48.6 Å²	48.6	77%	0.773	27%	0.273	S	S	*	.	S	Bend	trans	-68.5	-29.7	-174	50.5	0	0	0	0	113.5
285	S	85.9	Confident	85.7	Confident	82 Å²	82	46.5 Å²	46.5	57%	0.573	26%	0.262	S	S	*	.	S	Bend	trans	-128.7	109.7	176	176.9	0	0	0	0	109.6	N117 I283 P287	N117-S285 CarbonylContact O-C 3.53Å; N117-S285 WeakPolarHBondContact O-CA 3.47Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 VanDerWaalsContact CG2-O 3.28Å; I283-S285 WeakPolarHBondContact CG2-O 3.1Å; I283-S285 PolarHBondContact O-N 3.09Å; S285-P287 WeakPolarHBondContact O-CD 3.41Å
286	S	83.4	Confident	85	Confident	5 Å²	5	47.2 Å²	47.2	4%	0.035	27%	0.265	C	S	.	.			trans	-59.4	122.4	178.2	-175.1	0	0	0	0	110.5	C116 N117 L119	C116-S286 WeakPolarHBondContact O-CB 3.33Å; N117-S286 PolarHBondContact O-N 3.26Å; L119-S286 WeakPolarHBondContact CD1-OG 3.49Å
287	P	83.2	Confident	84.1	Confident	21 Å²	21	50.4 Å²	50.4	14%	0.136	28%	0.277	C	S	.	.			trans	-68.2	158.6	172	32.4	-38	0	0	0	110.7	T132 I272 S285 S289 Y290	T132-P287 HydrophobicContact CG2-CB 3.77Å; T132-P287 HydrophobicContact CG2-CG 4.07Å; I272-P287 HydrophobicContact CD1-CG 3.78Å; S285-P287 WeakPolarHBondContact O-CD 3.41Å; P287-S289 VanDerWaalsContact C-N 3.29Å; P287-S289 PolarHBondContact O-N 2.88Å; P287-Y290 HydrophobicContact CG-CD1 3.75Å; P287-Y290 HydrophobicContact CG-CG 4.06Å
288	K	80.5	Confident	83.1	Confident	135 Å²	135	49.2 Å²	49.2	59%	0.587	27%	0.269	S	S	*	.	S	Bend	trans	-64.4	-35.5	174.7	-67.3	-172.3	166.6	-162.1	0	112.6	G98 E99 S113	G98-K288 CarbonylContact C-O 3.59Å; G98-K288 WeakPolarHBondContact CA-O 3.31Å; E99-K288 HydrophobicContact CG-CB 4.3Å; E99-K288 PolarHBondContact N-O 3.04Å; E99-K288 VanDerWaalsContact OE1-CD 3.27Å; E99-K288 WeakPolarHBondContact OE1-CD 3.3Å; E99-K288 VanDerWaalsContact OE1-CG 3.27Å; E99-K288 WeakPolarHBondContact OE1-CG 3.22Å; E99-K288 IonicContact OE1-NZ 3.97Å; S113-K288 WeakPolarHBondContact CB-O 3.03Å; S113-K288 PolarHBondContact OG-O 3.46Å
289	S	81	Confident	81.5	Confident	11 Å²	11	54.6 Å²	54.6	8%	0.077	29%	0.292	C	S	.	.	S	Bend	trans	-148.9	139.6	177.4	37.1	0	0	0	0	110.7	I97 T133 P287	I97-S289 CarbonylContact O-C 3.58Å; I97-S289 VanDerWaalsContact O-CA 3.3Å; I97-S289 WeakPolarHBondContact O-CA 3.14Å; T133-S289 PolarHBondContact N-O 2.88Å; T133-S289 VanDerWaalsContact N-O 3.16Å; T133-S289 PolarHBondContact O-OG 3.47Å; P287-S289 VanDerWaalsContact C-N 3.29Å; P287-S289 PolarHBondContact O-N 2.88Å
290	Y	84.8	Confident	79.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	153.7	-176.8	61.2	-85.1	0	0	0	111.7	I97 L119 V130 W131 P287 I292	I97-Y290 HydrophobicContact CB-CD1 4.29Å; I97-Y290 HydrophobicContact CB-CD2 4.27Å; I97-Y290 HydrophobicContact CB-CE1 3.82Å; I97-Y290 HydrophobicContact CB-CE2 3.8Å; I97-Y290 HydrophobicContact CD1-CE2 3.67Å; I97-Y290 WeakPolarHBondContact CD1-OH 3.29Å; I97-Y290 HydrophobicContact CG1-CE2 4.15Å; I97-Y290 HydrophobicContact CG2-CD1 4.48Å; I97-Y290 HydrophobicContact CG2-CE1 3.65Å; I97-Y290 HydrophobicContact CG2-CE2 4.32Å; I97-Y290 WeakPolarHBondContact CG2-OH 3.36Å; I97-Y290 PolarHBondContact N-O 2.9Å; I97-Y290 PolarHBondContact O-N 2.87Å; I97-Y290 VanDerWaalsContact O-O 3.11Å; L119-Y290 HydrophobicContact CD1-CD1 4.38Å; L119-Y290 HydrophobicContact CD1-CE1 3.7Å; L119-Y290 HydrophobicContact CD1-CE2 4.39Å; V130-Y290 HydrophobicContact CG1-CD2 3.67Å; V130-Y290 HydrophobicContact CG1-CE2 4.5Å; V130-Y290 HydrophobicContact CG1-CG 4.31Å; W131-Y290 CarbonylContact O-C 3.56Å; W131-Y290 WeakPolarHBondContact O-CA 3.17Å; W131-Y290 WeakPolarHBondContact O-CB 3.22Å; P287-Y290 HydrophobicContact CG-CD1 3.75Å; P287-Y290 HydrophobicContact CG-CG 4.06Å; Y290-I292 HydrophobicContact CD2-CG1 4.07Å; Y290-I292 HydrophobicContact CE2-CD1 4.05Å; Y290-I292 HydrophobicContact CE2-CG1 4.01Å
291	I	86.3	Confident	78.2	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.9	178.5	-67.3	169	0	0	0	108.3	Q94 V95 L96 V130 W131 T133 P137 W263	Q94-I291 HydrophobicContact CB-CG2 4.02Å; Q94-I291 HydrophobicContact CG-CG2 4.14Å; V95-I291 CarbonylContact O-C 3.42Å; V95-I291 WeakPolarHBondContact O-CA 3.1Å; L96-I291 HydrophobicContact CB-CG1 4.24Å; L96-I291 HydrophobicContact CD1-CD1 4.02Å; L96-I291 HydrophobicContact CD1-CG1 3.47Å; L96-I291 VanDerWaalsContact CD1-CG1 3.47Å; L96-I291 HydrophobicContact CG-CG1 4.46Å; V130-I291 VanDerWaalsContact CA-O 3.29Å; V130-I291 WeakPolarHBondContact CA-O 3.04Å; W131-I291 HydrophobicContact CB-CB 4.5Å; W131-I291 PolarHBondContact N-O 2.97Å; W131-I291 PolarHBondContact O-N 3.37Å; T133-I291 HydrophobicContact CG2-CD1 3.99Å; T133-I291 HydrophobicContact CG2-CG1 3.97Å; P137-I291 HydrophobicContact CB-CD1 4.25Å; W263-I291 HydrophobicContact CB-CD1 3.74Å; W263-I291 HydrophobicContact CD2-CD1 3.26Å; W263-I291 HydrophobicContact CE3-CD1 3.86Å; W263-I291 HydrophobicContact CE3-CG2 4.36Å; W263-I291 HydrophobicContact CG-CD1 3.21Å; W263-I291 HydrophobicContact CZ2-CD1 4.28Å
292	I	87.8	Confident	76.8	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.1	167.8	-55.3	178	0	0	0	107.2	L89 Q94 V95 I97 I121 I128 R129 V130 Y290 V309 I311	L89-I292 HydrophobicContact CD1-CG2 3.73Å; Q94-I292 CarbonylContact C-O 3.59Å; Q94-I292 WeakPolarHBondContact CA-O 3.4Å; V95-I292 PolarHBondContact N-O 3.42Å; V95-I292 PolarHBondContact O-N 2.91Å; I97-I292 HydrophobicContact CD1-CD1 4.01Å; I121-I292 HydrophobicContact CD1-CD1 4.4Å; I128-I292 HydrophobicContact CG2-CG2 3.76Å; R129-I292 WeakPolarHBondContact O-CA 3.41Å; V130-I292 HydrophobicContact CG1-CG1 4.2Å; V130-I292 HydrophobicContact CG2-CG1 4.16Å; V130-I292 HydrophobicContact CG2-CG2 4.48Å; Y290-I292 HydrophobicContact CD2-CG1 4.07Å; Y290-I292 HydrophobicContact CE2-CD1 4.05Å; Y290-I292 HydrophobicContact CE2-CG1 4.01Å; I292-V309 HydrophobicContact CD1-CG1 4.47Å; I292-V309 HydrophobicContact CG2-CG1 4.45Å; I292-I311 HydrophobicContact CD1-CD1 3.34Å; I292-I311 HydrophobicContact CD1-CG1 3.97Å
293	D	87.5	Confident	75.8	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.053	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124	-176.4	-177.8	-24.3	0	0	0	109.3	Q94 I128 R129 R262 T295	Q94-D293 HydrophobicContact CG-CB 4.02Å; Q94-D293 PolarHBondContact NE2-OD2 2.85Å; I128-D293 CarbonylContact C-O 3.6Å; I128-D293 WeakPolarHBondContact CA-O 3.45Å; R129-D293 PolarHBondContact N-O 2.83Å; R129-D293 PolarHBondContact O-N 3.43Å; R262-D293 IonicContact CZ-OD1 2.91Å; R262-D293 IonicContact CZ-OD2 3.28Å; R262-D293 IonicContact NH2-OD1 2.69Å; R262-D293 PolarHBondContact NH2-OD1 2.79Å; R262-D293 IonicContact NH2-OD2 3.05Å; R262-D293 PolarHBondContact NH2-OD2 3.32Å; D293-T295 HydrophobicContact CB-CG2 4.36Å; D293-T295 PolarHBondContact O-N 2.9Å; D293-T295 WeakPolarHBondContact OD1-CA 3.4Å; D293-T295 PolarHBondContact OD1-N 2.81Å
294	Y	87.8	Confident	75	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.027	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	96.1	164	-171.3	-164.9	0	0	0	110	L89 K91 G92 D93 L126 K127 I128 D305 A307	L89-Y294 HydrophobicContact CB-CD1 4.49Å; K91-Y294 HydrophobicContact CB-CD1 4.06Å; K91-Y294 HydrophobicContact CB-CE1 3.89Å; K91-Y294 HydrophobicContact CG-CD1 4.15Å; K91-Y294 HydrophobicContact CG-CE1 3.86Å; K91-Y294 HydrophobicContact CG-CE2 4.31Å; K91-Y294 HydrophobicContact CG-CG 4.44Å; G92-Y294 WeakPolarHBondContact CA-O 3.05Å; G92-Y294 PolarHBondContact N-O 3.37Å; D93-Y294 PolarHBondContact O-N 3.25Å; L126-Y294 WeakPolarHBondContact O-CE2 3.44Å; K127-Y294 HydrophobicContact CB-CD2 4.33Å; K127-Y294 HydrophobicContact CB-CE2 4.03Å; I128-Y294 HydrophobicContact CD1-CD2 3.56Å; I128-Y294 HydrophobicContact CD1-CE2 4.33Å; I128-Y294 HydrophobicContact CD1-CG 3.68Å; Y294-D305 PolarHBondContact OH-OD2 2.91Å; Y294-A307 HydrophobicContact CD1-CB 3.85Å; Y294-A307 HydrophobicContact CE1-CB 3.78Å; Y294-A307 HydrophobicContact CE2-CB 4.44Å; Y294-A307 HydrophobicContact CG-CB 4.3Å
295	T	78.1	Confident	74.8	Confident	17 Å²	17	48.7 Å²	48.7	10%	0.104	27%	0.27	C	S	.	.			trans	-68.2	144.6	-165.3	59	0	0	0	0	114	K127 R129 D293	K127-T295 WeakPolarHBondContact CB-OG1 3.46Å; K127-T295 WeakPolarHBondContact O-CB 3.2Å; K127-T295 PolarHBondContact O-N 3.17Å; K127-T295 PolarHBondContact O-OG1 3.24Å; R129-T295 HydrophobicContact CB-CG2 3.9Å; R129-T295 HydrophobicContact CG-CG2 3.62Å; D293-T295 HydrophobicContact CB-CG2 4.36Å; D293-T295 PolarHBondContact O-N 2.9Å; D293-T295 WeakPolarHBondContact OD1-CA 3.4Å; D293-T295 PolarHBondContact OD1-N 2.81Å
296	V	70.7	Confident	74.6	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.115	27%	0.268	C	S	.	.			trans	-124.2	144.6	174.4	-167.7	0	0	0	0	107.5	K91 G92 Y145 T298 P302	K91-V296 HydrophobicContact CB-CG2 4.23Å; K91-V296 HydrophobicContact CD-CG1 4.3Å; K91-V296 HydrophobicContact CD-CG2 3.99Å; K91-V296 HydrophobicContact CG-CG2 3.72Å; G92-V296 VanDerWaalsContact CA-CG2 3.44Å; Y145-V296 HydrophobicContact CE1-CB 4.46Å; V296-T298 PolarHBondContact O-N 2.84Å; V296-P302 HydrophobicContact CG1-CB 4.31Å; V296-P302 HydrophobicContact CG1-CG 3.94Å
297	E	66.5	Low	74.8	Confident	117 Å²	117	51 Å²	51	55%	0.547	27%	0.267	S	S	.	.			trans	-71.4	122.9	164.2	-73.8	154.7	-134	0	0	108.9	K127 T300	K127-E297 IonicContact NZ-OE1 3.82Å; K127-E297 PolarHBondContact NZ-OE1 2.89Å; E297-T300 HydrophobicContact CB-CG2 4.37Å; E297-T300 PolarHBondContact O-N 3.44Å; E297-T300 PolarHBondContact O-OG1 2.83Å
298	T	61.9	Low	75.1	Confident	91 Å²	91	53.3 Å²	53.3	56%	0.558	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	139.8	-179.1	49.3	0	0	0	0	111.4	V296 T300	V296-T298 PolarHBondContact O-N 2.84Å; T298-T300 PolarHBondContact O-N 3.04Å
299	M	54	Low	75.5	Confident	184 Å²	184	47 Å²	47	91%	0.906	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	5.2	177.6	-53.4	-169.1	167.8	0	0	117
300	T	55.5	Low	75.9	Confident	60 Å²	60	48 Å²	48	37%	0.368	25%	0.254	S	S	.	.			trans	-93.1	127.8	167	60.2	0	0	0	0	109.1	E297 T298 P302	E297-T300 HydrophobicContact CB-CG2 4.37Å; E297-T300 PolarHBondContact O-N 3.44Å; E297-T300 PolarHBondContact O-OG1 2.83Å; T298-T300 PolarHBondContact O-N 3.04Å; T300-P302 WeakPolarHBondContact O-CD 3.37Å; T300-P302 VanDerWaalsContact O-N 3.13Å
301	A	54.5	Low	76	Confident	59 Å²	59	48 Å²	48	49%	0.488	25%	0.254	S	S	.	.			trans	-71.6	99	169.8	0	0	0	0	0	107.7	V148	V148-A301 HydrophobicContact CG2-CB 4.22Å
302	P	60.6	Low	76.1	Confident	12 Å²	12	49.1 Å²	49.1	8%	0.078	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-77.2	142.3	-177.6	33.7	-25.8	0	0	0	108.5	K91 V296 T300	K91-P302 HydrophobicContact CD-CB 3.41Å; K91-P302 VanDerWaalsContact CD-CB 3.41Å; K91-P302 HydrophobicContact CD-CG 3.92Å; V296-P302 HydrophobicContact CG1-CB 4.31Å; V296-P302 HydrophobicContact CG1-CG 3.94Å; T300-P302 WeakPolarHBondContact O-CD 3.37Å; T300-P302 VanDerWaalsContact O-N 3.13Å
303	N	68	Low	76	Confident	96 Å²	96	49.5 Å²	49.5	51%	0.513	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-54.8	146.9	162.7	-65.5	-25.4	0	0	0	108.6	D305	N303-D305 PolarHBondContact O-N 3.27Å; N303-D305 VanDerWaalsContact O-N 3.08Å
304	L	72.1	Confident	75.9	Confident	44 Å²	44	53 Å²	53	23%	0.23	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-56.7	121.6	173.1	-175.9	78.3	0	0	0	108.7	L147 W152	L147-L304 HydrophobicContact CD1-CD1 4.37Å; L147-L304 HydrophobicContact CD2-CD1 3.69Å; W152-L304 HydrophobicContact CH2-CD2 3.06Å; W152-L304 HydrophobicContact CH2-CG 4.46Å; W152-L304 HydrophobicContact CZ2-CB 4.42Å; W152-L304 HydrophobicContact CZ2-CD2 3.4Å; W152-L304 HydrophobicContact CZ3-CD2 4.14Å
305	D	80.2	Confident	75.7	Confident	49 Å²	49	54.2 Å²	54.2	26%	0.262	28%	0.284	S	S	.	.			trans	-143.9	148	179.3	-172.4	27.6	0	0	0	108.8	T90 K91 Y294 N303	T90-D305 WeakPolarHBondContact CA-O 3.3Å; K91-D305 PolarHBondContact N-O 2.86Å; Y294-D305 PolarHBondContact OH-OD2 2.91Å; N303-D305 PolarHBondContact O-N 3.27Å; N303-D305 VanDerWaalsContact O-N 3.08Å
306	Y	83.2	Confident	75.9	Confident	135 Å²	135	57 Å²	57	53%	0.529	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.9	-175.5	59.7	-89.6	0	0	0	111.2	L89	L89-Y306 CarbonylContact O-C 3.51Å; L89-Y306 VanDerWaalsContact O-CA 3.27Å; L89-Y306 WeakPolarHBondContact O-CA 3.44Å
307	A	86.2	Confident	76.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.1	176.7	0	0	0	0	0	109.2	L89 N124 K125 I128 Y294	L89-A307 PolarHBondContact N-O 3.08Å; L89-A307 PolarHBondContact O-N 3.05Å; N124-A307 WeakPolarHBondContact OD1-CA 3.31Å; K125-A307 HydrophobicContact CB-CB 3.95Å; K125-A307 HydrophobicContact CG-CB 4.18Å; I128-A307 HydrophobicContact CD1-CB 3.81Å; I128-A307 HydrophobicContact CG1-CB 4.45Å; Y294-A307 HydrophobicContact CD1-CB 3.85Å; Y294-A307 HydrophobicContact CE1-CB 3.78Å; Y294-A307 HydrophobicContact CE2-CB 4.44Å; Y294-A307 HydrophobicContact CG-CB 4.3Å
308	N	89.9	Confident	77	Confident	70 Å²	70	63.6 Å²	63.6	37%	0.374	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.7	168.6	-64.2	-30.9	0	0	0	107.4	T88 S123 N124	T88-N308 PolarHBondContact OG1-OD1 2.85Å; S123-N308 VanDerWaalsContact CA-O 3.31Å; S123-N308 WeakPolarHBondContact CA-O 3.43Å; S123-N308 PolarHBondContact OG-O 3.37Å; N124-N308 PolarHBondContact N-O 3.42Å; N124-N308 VanDerWaalsContact N-O 3.12Å; N124-N308 PolarHBondContact OD1-N 2.76Å; N124-N308 PolarHBondContact OD1-O 2.95Å
309	V	88.7	Confident	77.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.8	178.5	-176.1	0	0	0	0	108.6	I87 L89 I121 R122 I128 I292 I311	I87-V309 PolarHBondContact N-O 2.86Å; I87-V309 PolarHBondContact O-N 2.62Å; L89-V309 HydrophobicContact CD1-CG2 3.75Å; L89-V309 HydrophobicContact CG-CG2 4.17Å; I121-V309 HydrophobicContact CG2-CG1 3.66Å; R122-V309 CarbonylContact O-C 3.54Å; R122-V309 WeakPolarHBondContact O-CA 3.42Å; I128-V309 HydrophobicContact CD1-CG2 3.87Å; I128-V309 HydrophobicContact CG1-CG2 4.09Å; I128-V309 HydrophobicContact CG2-CG2 4.39Å; I292-V309 HydrophobicContact CD1-CG1 4.47Å; I292-V309 HydrophobicContact CG2-CG1 4.45Å; V309-I311 HydrophobicContact CG1-CG1 4.08Å
310	H	89.9	Confident	78.9	Confident	33 Å²	33	53.4 Å²	53.4	15%	0.153	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116	176.7	-174.9	81.1	0	0	0	109.6	P84 I85 D86 R122 I312	P84-H310 WeakPolarHBondContact CB-CE1 3.29Å; I85-H310 WeakPolarHBondContact O-CA 3.44Å; D86-H310 IonicContact OD1-CE1 3.83Å; D86-H310 IonicContact OD1-CG 3.91Å; D86-H310 IonicContact OD1-ND1 3.97Å; D86-H310 PolarHBondContact OD1-ND1 2.83Å; D86-H310 IonicContact OD2-ND1 3.89Å; R122-H310 HydrophobicContact CB-CB 4.21Å; R122-H310 PolarHBondContact N-O 2.86Å; R122-H310 PolarHBondContact O-N 3.16Å; H310-I312 VanDerWaalsContact CD2-CG1 3.4Å; H310-I312 WeakPolarHBondContact CD2-CG1 3.37Å; H310-I312 WeakPolarHBondContact NE2-CG1 3.44Å
311	I	87.7	Confident	79.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.2	-176.8	-52.6	167.9	0	0	0	108.5	P84 I85 I87 I97 R112 I121 I292 V309	P84-I311 WeakPolarHBondContact CA-O 3.31Å; I85-I311 HydrophobicContact CB-CB 4.46Å; I85-I311 PolarHBondContact N-O 2.71Å; I85-I311 PolarHBondContact O-N 2.86Å; I87-I311 HydrophobicContact CD1-CD1 3.53Å; I87-I311 HydrophobicContact CG1-CD1 4.17Å; I97-I311 HydrophobicContact CD1-CD1 3.64Å; R112-I311 PolarHBondContact NH2-O 2.91Å; I121-I311 HydrophobicContact CG1-CG2 4.42Å; I292-I311 HydrophobicContact CD1-CD1 3.34Å; I292-I311 HydrophobicContact CD1-CG1 3.97Å; V309-I311 HydrophobicContact CG1-CG1 4.08Å
312	I	87.7	Confident	81	Confident	27 Å²	27	53.5 Å²	53.5	14%	0.138	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.4	175.6	-55	169.1	0	0	0	108.2	P84 L119 E120 H310 Y314	P84-I312 HydrophobicContact CB-CG1 4.47Å; L119-I312 WeakPolarHBondContact CA-O 3.36Å; E120-I312 HydrophobicContact CB-CB 4.18Å; E120-I312 PolarHBondContact N-O 3Å; E120-I312 PolarHBondContact O-N 3.42Å; H310-I312 VanDerWaalsContact CD2-CG1 3.4Å; H310-I312 WeakPolarHBondContact CD2-CG1 3.37Å; H310-I312 WeakPolarHBondContact NE2-CG1 3.44Å; I312-Y314 HydrophobicContact CB-CE2 4.31Å; I312-Y314 HydrophobicContact CG2-CD2 4.05Å; I312-Y314 HydrophobicContact CG2-CE2 3.63Å
313	C	85.5	Confident	81.7	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.061	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.2	170.9	173.4	0	0	0	0	109.2	R112 C116 L119	R112-C313 HydrophobicContact CG-CB 4.13Å; R112-C313 VanDerWaalsContact CZ-CB 3.41Å; R112-C313 VanDerWaalsContact NH2-N 3.15Å; C116-C313 WeakPolarHBondContact CA-SG 3.25Å; C116-C313 HydrophobicContact CB-CB 4.2Å; C116-C313 WeakPolarHBondContact CB-SG 3.45Å; C116-C313 WeakPolarHBondContact SG-CB 3.41Å; C116-C313 CovalentContact SG-SG 2Å; C116-C313 PolarHBondContact SG-SG 2.98Å; L119-C313 HydrophobicContact CD2-CB 4.39Å
314	Y	86	Confident	82	Confident	82 Å²	82	57.5 Å²	57.5	32%	0.322	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.9	168.5	-65.6	-97.8	0	0	0	109	N117 H118 E120 I312	N117-Y314 PolarHBondContact N-O 3.11Å; H118-Y314 VanDerWaalsContact CD2-CB 3.44Å; H118-Y314 WeakPolarHBondContact CD2-CB 2.92Å; H118-Y314 AromaticContact CD2-CD2 3Å; H118-Y314 WeakPolarHBondContact CD2-CD2 3.32Å; H118-Y314 AromaticContact CD2-CE2 3.59Å; H118-Y314 AromaticContact CD2-CG 3.25Å; H118-Y314 WeakPolarHBondContact CE1-CB 3.44Å; H118-Y314 AromaticContact CE1-CD1 3.78Å; H118-Y314 AromaticContact CE1-CG 3.38Å; H118-Y314 AromaticContact CG-CD2 3.84Å; H118-Y314 AromaticContact CG-CG 3.92Å; H118-Y314 VanDerWaalsContact ND1-CB 3.29Å; H118-Y314 WeakPolarHBondContact ND1-CB 3.07Å; H118-Y314 AromaticContact ND1-CG 3.97Å; H118-Y314 WeakPolarHBondContact NE2-CB 3.43Å; H118-Y314 AromaticContact NE2-CD1 3.23Å; H118-Y314 WeakPolarHBondContact NE2-CD1 3.34Å; H118-Y314 AromaticContact NE2-CD2 3.18Å; H118-Y314 WeakPolarHBondContact NE2-CD2 3.33Å; H118-Y314 AromaticContact NE2-CE1 3.78Å; H118-Y314 AromaticContact NE2-CE2 3.73Å; H118-Y314 AromaticContact NE2-CG 2.87Å; H118-Y314 AromaticContact NE2-CZ 3.99Å; H118-Y314 PolarHBondContact O-N 2.91Å; E120-Y314 HydrophobicContact CB-CE2 3.99Å; E120-Y314 PolarHBondContact OE2-OH 3.25Å; I312-Y314 HydrophobicContact CB-CE2 4.31Å; I312-Y314 HydrophobicContact CG2-CD2 4.05Å; I312-Y314 HydrophobicContact CG2-CE2 3.63Å
315	P	82.6	Confident	82.3	Confident	34 Å²	34	57.2 Å²	57.2	22%	0.221	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	148.1	-168.2	26.2	-33.9	0	0	0	112.2	L82 T115 L320	L82-P315 HydrophobicContact CD1-CB 3.97Å; L82-P315 HydrophobicContact CD1-CG 4.49Å; L82-P315 HydrophobicContact CD2-CB 4.45Å; T115-P315 CarbonylContact O-C 3.59Å; T115-P315 WeakPolarHBondContact O-CA 3.11Å; P315-L320 HydrophobicContact CB-CD2 4.35Å; P315-L320 HydrophobicContact CB-CG 4.3Å; P315-L320 HydrophobicContact CG-CD1 4.11Å; P315-L320 HydrophobicContact CG-CD2 3.82Å; P315-L320 HydrophobicContact CG-CG 4.01Å
316	R	82.7	Confident	82.2	Confident	74 Å²	74	58.6 Å²	58.6	28%	0.279	28%	0.282	S	S	.	.			trans	-65.5	144.8	169.4	-61.3	173.5	179.5	-166.9	-3.1	110	L114 T115 C116 N117 W318 I319 L320	L114-R316 PolarHBondContact O-NE 2.53Å; T115-R316 WeakPolarHBondContact O-CG 3.47Å; T115-R316 PolarHBondContact O-N 2.72Å; C116-R316 PolarHBondContact O-NE 2.72Å; N117-R316 HydrophobicContact CB-CB 4.41Å; N117-R316 HydrophobicContact CB-CG 3.71Å; R316-W318 VanDerWaalsContact CB-CD1 3.45Å; R316-W318 HydrophobicContact CB-CG 4.4Å; R316-W318 PolarHBondContact O-N 3.25Å; R316-W318 VanDerWaalsContact O-N 3.16Å; R316-I319 HydrophobicContact CB-CD1 4.24Å; R316-I319 PolarHBondContact O-N 3.05Å; R316-I319 VanDerWaalsContact O-N 3.08Å; R316-L320 PolarHBondContact O-N 3Å
317	H	81.1	Confident	81.7	Confident	151 Å²	151	53 Å²	53	70%	0.699	26%	0.262	S	S	*	.	H	α-helix	trans	-57.7	-32.5	-177	-61.9	-63.4	0	0	0	113.7	I319 L320 G321	H317-I319 VanDerWaalsContact C-N 3.32Å; H317-I319 PolarHBondContact O-N 2.77Å; H317-L320 PolarHBondContact O-N 2.85Å; H317-G321 PolarHBondContact O-N 3.19Å
318	W	80	Confident	81.3	Confident	124 Å²	124	56.8 Å²	56.8	47%	0.47	29%	0.286	S	S	.	.	H	α-helix	trans	-66	-33.3	179.3	68.6	-94.2	0	0	0	112.7	R316 G321 I322	R316-W318 VanDerWaalsContact CB-CD1 3.45Å; R316-W318 HydrophobicContact CB-CG 4.4Å; R316-W318 PolarHBondContact O-N 3.25Å; R316-W318 VanDerWaalsContact O-N 3.16Å; W318-G321 CarbonylContact O-C 3.55Å; W318-G321 PolarHBondContact O-N 3.43Å; W318-I322 HydrophobicContact CE3-CD1 3.5Å; W318-I322 HydrophobicContact CE3-CG1 4.43Å; W318-I322 HydrophobicContact CZ3-CD1 3.58Å; W318-I322 WeakPolarHBondContact O-CG1 3.36Å; W318-I322 PolarHBondContact O-N 2.86Å
319	I	79.3	Confident	80.8	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-70.3	-43.1	176.1	-74.8	142.3	0	0	0	110.8	F77 L82 T115 R316 H317 G321 I322 M323	F77-I319 HydrophobicContact CE1-CG2 4.37Å; L82-I319 HydrophobicContact CD1-CG2 4.05Å; T115-I319 HydrophobicContact CG2-CD1 3.43Å; T115-I319 VanDerWaalsContact CG2-CD1 3.43Å; T115-I319 HydrophobicContact CG2-CG1 4.18Å; T115-I319 WeakPolarHBondContact O-CD1 3.28Å; R316-I319 HydrophobicContact CB-CD1 4.24Å; R316-I319 PolarHBondContact O-N 3.05Å; R316-I319 VanDerWaalsContact O-N 3.08Å; H317-I319 VanDerWaalsContact C-N 3.32Å; H317-I319 PolarHBondContact O-N 2.77Å; I319-G321 PolarHBondContact O-N 3.09Å; I319-I322 PolarHBondContact O-N 3.32Å; I319-M323 HydrophobicContact CG2-CG 4.4Å; I319-M323 WeakPolarHBondContact O-CB 3.4Å; I319-M323 VanDerWaalsContact O-CG 3.23Å; I319-M323 WeakPolarHBondContact O-CG 3.08Å; I319-M323 PolarHBondContact O-N 2.92Å
320	L	75.1	Confident	80.1	Confident	54 Å²	54	59.9 Å²	59.9	28%	0.283	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-43.9	171.3	-64.4	177	0	0	0	109.9	P315 R316 H317 I322 M323 F324	P315-L320 HydrophobicContact CB-CD2 4.35Å; P315-L320 HydrophobicContact CB-CG 4.3Å; P315-L320 HydrophobicContact CG-CD1 4.11Å; P315-L320 HydrophobicContact CG-CD2 3.82Å; P315-L320 HydrophobicContact CG-CG 4.01Å; R316-L320 PolarHBondContact O-N 3Å; H317-L320 PolarHBondContact O-N 2.85Å; L320-I322 PolarHBondContact O-N 2.99Å; L320-M323 PolarHBondContact O-N 3.46Å; L320-F324 HydrophobicContact CB-CD2 4.19Å; L320-F324 HydrophobicContact CB-CE2 4.09Å; L320-F324 HydrophobicContact CD2-CE2 4.36Å; L320-F324 WeakPolarHBondContact O-CB 3.45Å; L320-F324 WeakPolarHBondContact O-CD2 3.02Å; L320-F324 WeakPolarHBondContact O-CG 3.4Å; L320-F324 PolarHBondContact O-N 3.32Å
321	G	77.6	Confident	79.5	Confident	38 Å²	38	61 Å²	61	39%	0.392	31%	0.309	S	S	.	.	H	α-helix	trans	-56.9	-46.3	174.4	0	0	0	0	0	113.3	H317 W318 I319 F324 S325	H317-G321 PolarHBondContact O-N 3.19Å; W318-G321 CarbonylContact O-C 3.55Å; W318-G321 PolarHBondContact O-N 3.43Å; I319-G321 PolarHBondContact O-N 3.09Å; G321-F324 PolarHBondContact O-N 3.47Å; G321-S325 WeakPolarHBondContact O-CB 3.49Å; G321-S325 PolarHBondContact O-N 3.4Å; G321-S325 PolarHBondContact O-OG 2.84Å
322	I	77.7	Confident	79.2	Confident	83 Å²	83	64.9 Å²	64.9	43%	0.426	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-45.4	175.5	-69.3	174	0	0	0	110.7	W318 I319 L320 F324 S325 L326	W318-I322 HydrophobicContact CE3-CD1 3.5Å; W318-I322 HydrophobicContact CE3-CG1 4.43Å; W318-I322 HydrophobicContact CZ3-CD1 3.58Å; W318-I322 WeakPolarHBondContact O-CG1 3.36Å; W318-I322 PolarHBondContact O-N 2.86Å; I319-I322 PolarHBondContact O-N 3.32Å; L320-I322 PolarHBondContact O-N 2.99Å; I322-F324 PolarHBondContact O-N 3.04Å; I322-S325 WeakPolarHBondContact CA-OG 3.36Å; I322-S325 PolarHBondContact O-N 3.38Å; I322-S325 PolarHBondContact O-OG 3.16Å; I322-L326 WeakPolarHBondContact O-CB 3.13Å; I322-L326 PolarHBondContact O-N 3.43Å
323	M	75.2	Confident	78.8	Confident	34 Å²	34	65.8 Å²	65.8	17%	0.167	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-41.9	179.7	-70.3	-68.7	161	0	0	112.4	A74 F77 I319 L320	A74-M323 HydrophobicContact CB-CB 4.15Å; A74-M323 HydrophobicContact CB-CG 4.43Å; A74-M323 HydrophobicContact CB-SD 3.68Å; F77-M323 HydrophobicContact CB-CE 4.02Å; F77-M323 HydrophobicContact CB-SD 4.4Å; F77-M323 HydrophobicContact CD1-CE 3.1Å; F77-M323 HydrophobicContact CD1-SD 4.15Å; F77-M323 HydrophobicContact CD2-CE 4.08Å; F77-M323 HydrophobicContact CE1-CE 3.42Å; F77-M323 VanDerWaalsContact CE1-CE 3.42Å; F77-M323 HydrophobicContact CE2-CE 4.35Å; F77-M323 HydrophobicContact CG-CE 3.46Å; F77-M323 VanDerWaalsContact CG-CE 3.46Å; F77-M323 HydrophobicContact CG-SD 4.42Å; F77-M323 HydrophobicContact CZ-CE 4.05Å; I319-M323 HydrophobicContact CG2-CG 4.4Å; I319-M323 WeakPolarHBondContact O-CB 3.4Å; I319-M323 VanDerWaalsContact O-CG 3.23Å; I319-M323 WeakPolarHBondContact O-CG 3.08Å; I319-M323 PolarHBondContact O-N 2.92Å; L320-M323 PolarHBondContact O-N 3.46Å
324	F	73.8	Confident	78.3	Confident	159 Å²	159	66.9 Å²	66.9	70%	0.697	35%	0.346	S	S	*	.	H	α-helix	trans	-80.1	-23.1	179.1	-69.1	-59.4	0	0	0	113.5	L320 G321 I322 P327	L320-F324 HydrophobicContact CB-CD2 4.19Å; L320-F324 HydrophobicContact CB-CE2 4.09Å; L320-F324 HydrophobicContact CD2-CE2 4.36Å; L320-F324 WeakPolarHBondContact O-CB 3.45Å; L320-F324 WeakPolarHBondContact O-CD2 3.02Å; L320-F324 WeakPolarHBondContact O-CG 3.4Å; L320-F324 PolarHBondContact O-N 3.32Å; G321-F324 PolarHBondContact O-N 3.47Å; I322-F324 PolarHBondContact O-N 3.04Å; F324-P327 WeakPolarHBondContact O-CD 3.5Å
325	S	78.6	Confident	78	Confident	37 Å²	37	67.4 Å²	67.4	26%	0.259	35%	0.353	S	S	.	.	H	α-helix	trans	-89.1	-18.6	176.1	60.9	0	0	0	0	113.6	G321 I322 P327 T328 I329	G321-S325 WeakPolarHBondContact O-CB 3.49Å; G321-S325 PolarHBondContact O-N 3.4Å; G321-S325 PolarHBondContact O-OG 2.84Å; I322-S325 WeakPolarHBondContact CA-OG 3.36Å; I322-S325 PolarHBondContact O-N 3.38Å; I322-S325 PolarHBondContact O-OG 3.16Å; S325-P327 VanDerWaalsContact C-CD 3.46Å; S325-P327 VanDerWaalsContact C-N 3.34Å; S325-T328 PolarHBondContact O-N 2.84Å; S325-T328 VanDerWaalsContact O-N 3.08Å; S325-T328 PolarHBondContact O-OG1 3.03Å; S325-I329 VanDerWaalsContact O-CG1 3.29Å; S325-I329 WeakPolarHBondContact O-CG1 3.49Å; S325-I329 PolarHBondContact O-N 2.94Å
326	L	78.4	Confident	77.9	Confident	78 Å²	78	70.6 Å²	70.6	41%	0.408	37%	0.368	S	S	.	.	H	α-helix	trans	-52.6	-45.1	177.6	-153.1	86.8	0	0	0	112.6	S70 I322 T328 I329 V330	S70-L326 WeakPolarHBondContact OG-CD2 3.17Å; I322-L326 WeakPolarHBondContact O-CB 3.13Å; I322-L326 PolarHBondContact O-N 3.43Å; L326-T328 PolarHBondContact O-N 2.78Å; L326-I329 PolarHBondContact O-N 2.8Å; L326-V330 WeakPolarHBondContact O-CB 3.41Å; L326-V330 WeakPolarHBondContact O-CG2 3.43Å; L326-V330 PolarHBondContact O-N 3.13Å
327	P	72.7	Confident	77.7	Confident	18 Å²	18	71.7 Å²	71.7	12%	0.117	38%	0.379	C	S	.	.	H	α-helix	trans	-60.8	-43.1	176.5	-21.4	32.1	0	0	0	112.8	S70 F324 S325 V330 I331	S70-P327 WeakPolarHBondContact OG-CD 3.32Å; S70-P327 WeakPolarHBondContact OG-CG 3.42Å; F324-P327 WeakPolarHBondContact O-CD 3.5Å; S325-P327 VanDerWaalsContact C-CD 3.46Å; S325-P327 VanDerWaalsContact C-N 3.34Å; P327-V330 PolarHBondContact O-N 2.77Å; P327-I331 WeakPolarHBondContact O-CB 3.42Å; P327-I331 WeakPolarHBondContact O-CD1 3.46Å; P327-I331 WeakPolarHBondContact O-CG1 3.34Å; P327-I331 PolarHBondContact O-N 2.74Å
328	T	77.5	Confident	77.4	Confident	80 Å²	80	67.4 Å²	67.4	49%	0.491	36%	0.36	S	S	.	.	H	α-helix	trans	-70.4	-39.8	-178.4	58.2	0	0	0	0	111.2	S325 L326 V330 I331 V332	S325-T328 PolarHBondContact O-N 2.84Å; S325-T328 VanDerWaalsContact O-N 3.08Å; S325-T328 PolarHBondContact O-OG1 3.03Å; L326-T328 PolarHBondContact O-N 2.78Å; T328-V330 VanDerWaalsContact C-N 3.34Å; T328-V330 PolarHBondContact O-N 3.34Å; T328-I331 PolarHBondContact O-N 2.72Å; T328-V332 WeakPolarHBondContact O-CB 3.28Å; T328-V332 VanDerWaalsContact O-CG2 3.27Å; T328-V332 WeakPolarHBondContact O-CG2 3.35Å; T328-V332 PolarHBondContact O-N 2.67Å
329	I	78.6	Confident	77.3	Confident	98 Å²	98	67.3 Å²	67.3	50%	0.503	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-42.9	174.4	-66	166.5	0	0	0	110.5	S325 L326 V332 S333	S325-I329 VanDerWaalsContact O-CG1 3.29Å; S325-I329 WeakPolarHBondContact O-CG1 3.49Å; S325-I329 PolarHBondContact O-N 2.94Å; L326-I329 PolarHBondContact O-N 2.8Å; I329-V332 PolarHBondContact O-N 3.04Å; I329-S333 VanDerWaalsContact O-CB 3.24Å; I329-S333 WeakPolarHBondContact O-CB 3.19Å; I329-S333 PolarHBondContact O-N 2.89Å; I329-S333 PolarHBondContact O-OG 2.8Å
330	V	75	Confident	77.2	Confident	38 Å²	38	76 Å²	76	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-64.7	-42.9	176.7	173.1	0	0	0	0	111	L66 L326 P327 T328 S333 L334	L66-V330 HydrophobicContact CB-CG1 3.83Å; L66-V330 HydrophobicContact CD1-CG1 4.06Å; L66-V330 HydrophobicContact CG-CG1 4.43Å; L326-V330 WeakPolarHBondContact O-CB 3.41Å; L326-V330 WeakPolarHBondContact O-CG2 3.43Å; L326-V330 PolarHBondContact O-N 3.13Å; P327-V330 PolarHBondContact O-N 2.77Å; T328-V330 VanDerWaalsContact C-N 3.34Å; T328-V330 PolarHBondContact O-N 3.34Å; V330-S333 WeakPolarHBondContact CA-OG 3.19Å; V330-S333 PolarHBondContact O-OG 3.45Å; V330-L334 HydrophobicContact CG1-CD1 4.01Å; V330-L334 WeakPolarHBondContact O-CB 3.34Å; V330-L334 WeakPolarHBondContact O-CD1 3.39Å; V330-L334 WeakPolarHBondContact O-CG 3.4Å; V330-L334 PolarHBondContact O-N 3.25Å
331	I	77.7	Confident	77.3	Confident	57 Å²	57	76.3 Å²	76.3	29%	0.292	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-48.5	176.4	-68.5	162.8	0	0	0	111.2	P327 T328 L334 I335	P327-I331 WeakPolarHBondContact O-CB 3.42Å; P327-I331 WeakPolarHBondContact O-CD1 3.46Å; P327-I331 WeakPolarHBondContact O-CG1 3.34Å; P327-I331 PolarHBondContact O-N 2.74Å; T328-I331 PolarHBondContact O-N 2.72Å; I331-L334 PolarHBondContact O-N 3.24Å; I331-I335 HydrophobicContact CG2-CD1 3.78Å; I331-I335 VanDerWaalsContact O-CG1 3.28Å; I331-I335 WeakPolarHBondContact O-CG1 3.07Å; I331-I335 PolarHBondContact O-N 2.92Å
332	V	79.6	Confident	77.3	Confident	80 Å²	80	77.9 Å²	77.9	49%	0.485	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-43.8	-179.6	171.3	0	0	0	0	111.1	T328 I329 L334 I335 L336	T328-V332 WeakPolarHBondContact O-CB 3.28Å; T328-V332 VanDerWaalsContact O-CG2 3.27Å; T328-V332 WeakPolarHBondContact O-CG2 3.35Å; T328-V332 PolarHBondContact O-N 2.67Å; I329-V332 PolarHBondContact O-N 3.04Å; V332-L334 PolarHBondContact O-N 3.06Å; V332-I335 PolarHBondContact O-N 3.36Å; V332-L336 HydrophobicContact CG1-CD1 3.93Å; V332-L336 HydrophobicContact CG1-CG 4.34Å; V332-L336 WeakPolarHBondContact O-CB 3.22Å; V332-L336 WeakPolarHBondContact O-CG 3.29Å; V332-L336 PolarHBondContact O-N 3.31Å
333	S	80	Confident	77.2	Confident	46 Å²	46	80 Å²	80	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-62.4	-40.9	177.8	56.5	0	0	0	0	111.9	I329 V330 L336 I337	I329-S333 VanDerWaalsContact O-CB 3.24Å; I329-S333 WeakPolarHBondContact O-CB 3.19Å; I329-S333 PolarHBondContact O-N 2.89Å; I329-S333 PolarHBondContact O-OG 2.8Å; V330-S333 WeakPolarHBondContact CA-OG 3.19Å; V330-S333 PolarHBondContact O-OG 3.45Å; S333-L336 PolarHBondContact O-N 3.15Å; S333-I337 WeakPolarHBondContact O-CB 3.47Å; S333-I337 WeakPolarHBondContact O-CD1 3.35Å; S333-I337 WeakPolarHBondContact O-CG1 3.35Å; S333-I337 PolarHBondContact O-N 3.11Å
334	L	75.8	Confident	77.1	Confident	32 Å²	32	85.5 Å²	85.5	17%	0.168	43%	0.43	C	S	.	.	H	α-helix	trans	-62.7	-45	173	-70.4	164.5	0	0	0	112.3	L62 L66 V330 I331 V332 L336 I337 M338	L62-L334 HydrophobicContact CD2-CD2 4.09Å; L66-L334 HydrophobicContact CD1-CD1 3.37Å; L66-L334 HydrophobicContact CD1-CD2 4.17Å; L66-L334 HydrophobicContact CD1-CG 4.28Å; V330-L334 HydrophobicContact CG1-CD1 4.01Å; V330-L334 WeakPolarHBondContact O-CB 3.34Å; V330-L334 WeakPolarHBondContact O-CD1 3.39Å; V330-L334 WeakPolarHBondContact O-CG 3.4Å; V330-L334 PolarHBondContact O-N 3.25Å; I331-L334 PolarHBondContact O-N 3.24Å; V332-L334 PolarHBondContact O-N 3.06Å; L334-L336 VanDerWaalsContact C-N 3.29Å; L334-L336 PolarHBondContact O-N 2.89Å; L334-I337 PolarHBondContact O-N 3.11Å; L334-M338 VanDerWaalsContact O-CB 3.32Å; L334-M338 WeakPolarHBondContact O-CB 3.2Å; L334-M338 VanDerWaalsContact O-CG 3.23Å; L334-M338 WeakPolarHBondContact O-CG 3.49Å; L334-M338 PolarHBondContact O-N 2.96Å
335	I	78.5	Confident	77.1	Confident	93 Å²	93	81.4 Å²	81.4	48%	0.477	41%	0.413	S	S	.	.	H	α-helix	trans	-59.4	-42.7	177.1	-68.4	166.4	0	0	0	110.4	I331 V332 M338 H339	I331-I335 HydrophobicContact CG2-CD1 3.78Å; I331-I335 VanDerWaalsContact O-CG1 3.28Å; I331-I335 WeakPolarHBondContact O-CG1 3.07Å; I331-I335 PolarHBondContact O-N 2.92Å; V332-I335 PolarHBondContact O-N 3.36Å; I335-M338 PolarHBondContact O-N 3.1Å; I335-H339 WeakPolarHBondContact O-CB 3.41Å; I335-H339 PolarHBondContact O-N 2.82Å
336	L	81.2	Confident	76.9	Confident	101 Å²	101	86.5 Å²	86.5	53%	0.529	43%	0.431	S	S	.	.	H	α-helix	trans	-68.4	-44.1	178.3	-71.6	173.8	0	0	0	112.8	V332 S333 L334 M338 H339 R340	V332-L336 HydrophobicContact CG1-CD1 3.93Å; V332-L336 HydrophobicContact CG1-CG 4.34Å; V332-L336 WeakPolarHBondContact O-CB 3.22Å; V332-L336 WeakPolarHBondContact O-CG 3.29Å; V332-L336 PolarHBondContact O-N 3.31Å; S333-L336 PolarHBondContact O-N 3.15Å; L334-L336 VanDerWaalsContact C-N 3.29Å; L334-L336 PolarHBondContact O-N 2.89Å; L336-M338 VanDerWaalsContact C-N 3.27Å; L336-M338 PolarHBondContact O-N 2.91Å; L336-H339 PolarHBondContact O-N 2.73Å; L336-R340 WeakPolarHBondContact O-CB 3.17Å; L336-R340 WeakPolarHBondContact O-CG 3.4Å; L336-R340 PolarHBondContact O-N 3.5Å
337	I	79.3	Confident	76.5	Confident	98 Å²	98	89.1 Å²	89.1	50%	0.503	44%	0.439	S	S	.	.	H	α-helix	trans	-57.9	-45.6	174.2	-70.4	164	0	0	0	109.2	S333 L334 R340 C341	S333-I337 WeakPolarHBondContact O-CB 3.47Å; S333-I337 WeakPolarHBondContact O-CD1 3.35Å; S333-I337 WeakPolarHBondContact O-CG1 3.35Å; S333-I337 PolarHBondContact O-N 3.11Å; L334-I337 PolarHBondContact O-N 3.11Å; I337-R340 PolarHBondContact O-N 2.81Å; I337-C341 WeakPolarHBondContact O-CB 3.48Å; I337-C341 PolarHBondContact O-N 2.82Å; I337-C341 PolarHBondContact O-SG 3.34Å
338	M	73.4	Confident	76	Confident	61 Å²	61	94.5 Å²	94.5	30%	0.3	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-45.9	176.9	-75.2	-58.9	-53	0	0	112.5	I59 L334 I335 L336 R340 C341 I342	I59-M338 HydrophobicContact CD1-CE 3.7Å; I59-M338 HydrophobicContact CD1-CG 4.4Å; I59-M338 HydrophobicContact CD1-SD 4.45Å; I59-M338 HydrophobicContact CG1-CE 4.32Å; L334-M338 VanDerWaalsContact O-CB 3.32Å; L334-M338 WeakPolarHBondContact O-CB 3.2Å; L334-M338 VanDerWaalsContact O-CG 3.23Å; L334-M338 WeakPolarHBondContact O-CG 3.49Å; L334-M338 PolarHBondContact O-N 2.96Å; I335-M338 PolarHBondContact O-N 3.1Å; L336-M338 VanDerWaalsContact C-N 3.27Å; L336-M338 PolarHBondContact O-N 2.91Å; M338-R340 VanDerWaalsContact C-N 3.27Å; M338-R340 PolarHBondContact O-N 2.73Å; M338-C341 PolarHBondContact O-N 3.26Å; M338-C341 VanDerWaalsContact O-N 3.16Å; M338-I342 HydrophobicContact CE-CD1 4.47Å; M338-I342 VanDerWaalsContact O-CG1 3.31Å; M338-I342 WeakPolarHBondContact O-CG1 3.39Å; M338-I342 PolarHBondContact O-N 3.45Å
339	H	78.2	Confident	74.9	Confident	122 Å²	122	96.9 Å²	96.9	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-59.9	-41	177.5	-169.1	85.1	0	0	0	111.3	I335 L336 K343	I335-H339 WeakPolarHBondContact O-CB 3.41Å; I335-H339 PolarHBondContact O-N 2.82Å; L336-H339 PolarHBondContact O-N 2.73Å; H339-K343 VanDerWaalsContact O-CB 3.31Å; H339-K343 WeakPolarHBondContact O-CB 3.25Å; H339-K343 PolarHBondContact O-N 2.89Å
340	R	77.8	Confident	73.9	Confident	190 Å²	190	99.5 Å²	99.5	72%	0.717	47%	0.474	S	S	*	.	H	α-helix	trans	-64.6	-43.8	173.7	-73.5	-178.1	175.8	-172.1	-0.4	112.1	L336 I337 M338 K343 K344	L336-R340 WeakPolarHBondContact O-CB 3.17Å; L336-R340 WeakPolarHBondContact O-CG 3.4Å; L336-R340 PolarHBondContact O-N 3.5Å; I337-R340 PolarHBondContact O-N 2.81Å; M338-R340 VanDerWaalsContact C-N 3.27Å; M338-R340 PolarHBondContact O-N 2.73Å; R340-K343 PolarHBondContact O-N 2.71Å; R340-K344 PolarHBondContact O-N 3.08Å
341	C	77.3	Confident	72.8	Confident	59 Å²	59	105.4 Å²	105.4	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-44.6	176.8	-72.6	0	0	0	0	112.2	I337 M338 K344 Q345	I337-C341 WeakPolarHBondContact O-CB 3.48Å; I337-C341 PolarHBondContact O-N 2.82Å; I337-C341 PolarHBondContact O-SG 3.34Å; M338-C341 PolarHBondContact O-N 3.26Å; M338-C341 VanDerWaalsContact O-N 3.16Å; C341-K344 PolarHBondContact O-N 3.46Å; C341-Q345 WeakPolarHBondContact O-CG 3.32Å; C341-Q345 PolarHBondContact O-N 2.97Å
342	I	77.1	Confident	71.5	Confident	72 Å²	72	105.1 Å²	105.1	37%	0.369	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.2	-67	166.3	0	0	0	110.4	M338 Q345 K346	M338-I342 HydrophobicContact CE-CD1 4.47Å; M338-I342 VanDerWaalsContact O-CG1 3.31Å; M338-I342 WeakPolarHBondContact O-CG1 3.39Å; M338-I342 PolarHBondContact O-N 3.45Å; I342-Q345 PolarHBondContact O-N 2.99Å; I342-K346 HydrophobicContact CG2-CD 4.3Å; I342-K346 HydrophobicContact CG2-CG 4.48Å; I342-K346 WeakPolarHBondContact O-CB 3.47Å; I342-K346 WeakPolarHBondContact O-CG 3.31Å; I342-K346 PolarHBondContact O-N 3.2Å
343	K	75.3	Confident	70.2	Confident	126 Å²	126	106.2 Å²	106.2	55%	0.548	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-39.3	177.5	-168.7	174.5	-177.3	175.5	0	111.9	H339 R340 K347	H339-K343 VanDerWaalsContact O-CB 3.31Å; H339-K343 WeakPolarHBondContact O-CB 3.25Å; H339-K343 PolarHBondContact O-N 2.89Å; R340-K343 PolarHBondContact O-N 2.71Å; K343-K347 WeakPolarHBondContact O-CG 3.3Å; K343-K347 PolarHBondContact O-N 2.83Å; K343-K347 VanDerWaalsContact O-N 3.08Å
344	K	73.9	Confident	68.9	Low	151 Å²	151	107.4 Å²	107.4	66%	0.657	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-46.9	173.1	-79.4	-171.6	175.9	-172.8	0	111.8	R340 C341 K346 K347 Q348	R340-K344 PolarHBondContact O-N 3.08Å; C341-K344 PolarHBondContact O-N 3.46Å; K344-K346 PolarHBondContact O-N 3.19Å; K344-K347 PolarHBondContact O-N 3.47Å; K344-Q348 PolarHBondContact O-N 3.36Å
345	Q	73.6	Confident	67.6	Low	73 Å²	73	109.2 Å²	109.2	34%	0.341	52%	0.524	S	S	.	.	H	α-helix	trans	-58.9	-47.6	175.9	-76	-176.7	-3.9	0	0	111.5	C341 I342 K347 Q348 F349	C341-Q345 WeakPolarHBondContact O-CG 3.32Å; C341-Q345 PolarHBondContact O-N 2.97Å; I342-Q345 PolarHBondContact O-N 2.99Å; Q345-K347 VanDerWaalsContact C-N 3.28Å; Q345-K347 PolarHBondContact O-N 3.21Å; Q345-Q348 PolarHBondContact O-N 3.05Å; Q345-Q348 VanDerWaalsContact O-N 3.12Å; Q345-F349 HydrophobicContact CB-CD2 4.42Å; Q345-F349 HydrophobicContact CB-CE2 4.33Å; Q345-F349 WeakPolarHBondContact O-CD2 3.42Å; Q345-F349 PolarHBondContact O-N 3.45Å
346	K	73.9	Confident	66.1	Low	144 Å²	144	110.7 Å²	110.7	63%	0.626	53%	0.531	S	S	*	.	H	α-helix	trans	-60.2	-35.3	176.9	-74.2	-175.6	178.2	-172.5	0	112.9	I342 K344 K350	I342-K346 HydrophobicContact CG2-CD 4.3Å; I342-K346 HydrophobicContact CG2-CG 4.48Å; I342-K346 WeakPolarHBondContact O-CB 3.47Å; I342-K346 WeakPolarHBondContact O-CG 3.31Å; I342-K346 PolarHBondContact O-N 3.2Å; K344-K346 PolarHBondContact O-N 3.19Å; K346-K350 PolarHBondContact O-N 2.91Å
347	K	69.5	Low	64.4	Low	133 Å²	133	114 Å²	114	58%	0.578	54%	0.544	S	S	*	.	H	α-helix	trans	-69.1	-41.7	173.7	-77.8	-173.6	175.3	-166	0	112	K343 K344 Q345 K350 F351	K343-K347 WeakPolarHBondContact O-CG 3.3Å; K343-K347 PolarHBondContact O-N 2.83Å; K343-K347 VanDerWaalsContact O-N 3.08Å; K344-K347 PolarHBondContact O-N 3.47Å; Q345-K347 VanDerWaalsContact C-N 3.28Å; Q345-K347 PolarHBondContact O-N 3.21Å; K347-K350 PolarHBondContact O-N 3.21Å; K347-F351 PolarHBondContact O-N 2.76Å
348	Q	61.8	Low	62.5	Low	131 Å²	131	116.9 Å²	116.9	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-62.8	-46.9	175.8	-75.9	177.4	-26.3	0	0	111.3	K344 Q345 K350 F351 S352	K344-Q348 PolarHBondContact O-N 3.36Å; Q345-Q348 PolarHBondContact O-N 3.05Å; Q345-Q348 VanDerWaalsContact O-N 3.12Å; Q348-K350 PolarHBondContact O-N 2.85Å; Q348-F351 WeakPolarHBondContact O-CB 3.26Å; Q348-F351 PolarHBondContact O-N 3.4Å; Q348-F351 VanDerWaalsContact O-N 3.07Å; Q348-S352 PolarHBondContact O-N 2.98Å; Q348-S352 PolarHBondContact O-OG 2.9Å
349	F	56.5	Low	60.7	Low	129 Å²	129	118.5 Å²	118.5	57%	0.566	57%	0.569	S	S	*	*	H	α-helix	trans	-61	-40.8	175.5	-76.1	-67.4	0	0	0	112.7	Q345 F351 S352 D353	Q345-F349 HydrophobicContact CB-CD2 4.42Å; Q345-F349 HydrophobicContact CB-CE2 4.33Å; Q345-F349 WeakPolarHBondContact O-CD2 3.42Å; Q345-F349 PolarHBondContact O-N 3.45Å; F349-F351 VanDerWaalsContact C-N 3.3Å; F349-F351 PolarHBondContact O-N 3.2Å; F349-S352 WeakPolarHBondContact O-CB 3.31Å; F349-S352 PolarHBondContact O-N 3.04Å; F349-D353 PolarHBondContact O-N 3.07Å
350	K	55.9	Low	58.9	Low	154 Å²	154	117.7 Å²	117.7	67%	0.67	57%	0.574	S	S	*	*	H	α-helix	trans	-61.4	-37	172.9	-85.1	-168.7	173.3	-166.1	0	112.9	K346 K347 Q348 T354	K346-K350 PolarHBondContact O-N 2.91Å; K347-K350 PolarHBondContact O-N 3.21Å; Q348-K350 PolarHBondContact O-N 2.85Å; K350-T354 WeakPolarHBondContact O-CB 3.49Å; K350-T354 PolarHBondContact O-N 2.8Å; K350-T354 PolarHBondContact O-OG1 2.82Å
351	F	52.5	Low	57	Low	161 Å²	161	117.8 Å²	117.8	71%	0.706	58%	0.58	S	S	*	*	H	α-helix	trans	-68.6	-38	174.3	-101.1	-81.4	0	0	0	111.8	K347 Q348 F349 T354 S355	K347-F351 PolarHBondContact O-N 2.76Å; Q348-F351 WeakPolarHBondContact O-CB 3.26Å; Q348-F351 PolarHBondContact O-N 3.4Å; Q348-F351 VanDerWaalsContact O-N 3.07Å; F349-F351 VanDerWaalsContact C-N 3.3Å; F349-F351 PolarHBondContact O-N 3.2Å; F351-T354 WeakPolarHBondContact CA-OG1 3.5Å; F351-T354 PolarHBondContact O-OG1 2.92Å; F351-S355 WeakPolarHBondContact O-CB 3.13Å; F351-S355 PolarHBondContact O-N 2.9Å; F351-S355 PolarHBondContact O-OG 3.12Å
352	S	51.3	Low	55.2	Low	51 Å²	51	120.4 Å²	120.4	36%	0.357	59%	0.594	S	S	.	*	H	α-helix	trans	-61.4	-50.1	173.2	-40.9	0	0	0	0	111.3	Q348 F349 T354 S355 I356	Q348-S352 PolarHBondContact O-N 2.98Å; Q348-S352 PolarHBondContact O-OG 2.9Å; F349-S352 WeakPolarHBondContact O-CB 3.31Å; F349-S352 PolarHBondContact O-N 3.04Å; S352-T354 VanDerWaalsContact C-N 3.32Å; S352-T354 PolarHBondContact O-N 3.22Å; S352-S355 PolarHBondContact O-N 2.83Å; S352-S355 PolarHBondContact O-OG 3.23Å; S352-I356 WeakPolarHBondContact O-CG1 3.5Å; S352-I356 PolarHBondContact O-N 3.04Å; S352-I356 VanDerWaalsContact O-N 3.08Å
353	D	51.2	Low	53.3	Low	103 Å²	103	124.4 Å²	124.4	55%	0.551	62%	0.617	S	S	*	*	H	α-helix	trans	-64.5	-37.2	-178.6	-69.3	-21.6	0	0	0	111.9	F349 Q357	F349-D353 PolarHBondContact O-N 3.07Å; D353-Q357 PolarHBondContact O-N 3.07Å
354	T	52.3	Low	51.3	Low	72 Å²	72	126.3 Å²	126.3	44%	0.442	63%	0.625	S	S	.	*	H	α-helix	trans	-73.7	-32.4	175.7	43.1	0	0	0	0	112.9	K350 F351 S352 Q357 Q358	K350-T354 WeakPolarHBondContact O-CB 3.49Å; K350-T354 PolarHBondContact O-N 2.8Å; K350-T354 PolarHBondContact O-OG1 2.82Å; F351-T354 WeakPolarHBondContact CA-OG1 3.5Å; F351-T354 PolarHBondContact O-OG1 2.92Å; S352-T354 VanDerWaalsContact C-N 3.32Å; S352-T354 PolarHBondContact O-N 3.22Å; T354-Q357 PolarHBondContact O-N 3Å; T354-Q358 PolarHBondContact O-N 3Å
355	S	49.6	Very low	49.4	Very low	69 Å²	69	125.9 Å²	125.9	48%	0.483	63%	0.63	S	S	.	*	H	α-helix	trans	-68.6	-32.9	174.2	68.1	0	0	0	0	113.1	F351 S352 Q357 Q358	F351-S355 WeakPolarHBondContact O-CB 3.13Å; F351-S355 PolarHBondContact O-N 2.9Å; F351-S355 PolarHBondContact O-OG 3.12Å; S352-S355 PolarHBondContact O-N 2.83Å; S352-S355 PolarHBondContact O-OG 3.23Å; S355-Q357 VanDerWaalsContact C-N 3.32Å; S355-Q358 PolarHBondContact O-N 2.99Å
356	I	47.4	Very low	47.4	Very low	124 Å²	124	130.5 Å²	130.5	64%	0.636	66%	0.656	S	S	*	*	H	α-helix	trans	-72	-28.9	176.5	-65.1	167.7	0	0	0	111.1	S352	S352-I356 WeakPolarHBondContact O-CG1 3.5Å; S352-I356 PolarHBondContact O-N 3.04Å; S352-I356 VanDerWaalsContact O-N 3.08Å
357	Q	45.5	Very low	45.5	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	67%	0.666	S	S	*	*	H	α-helix	trans	-84.2	-8.4	175.3	-74.3	-175.6	-18.2	0	0	114.1	D353 T354 S355	D353-Q357 PolarHBondContact O-N 3.07Å; T354-Q357 PolarHBondContact O-N 3Å; S355-Q357 VanDerWaalsContact C-N 3.32Å
358	Q	38.8	Very low	43.7	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.743	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	28.7	177.9	-83.7	-170.7	-20.7	0	0	113.8	T354 S355 P360	T354-Q358 PolarHBondContact O-N 3Å; S355-Q358 PolarHBondContact O-N 2.99Å; Q358-P360 WeakPolarHBondContact O-CD 3.36Å
359	T	35.4	Very low	42.3	Very low	95 Å²	95	135.8 Å²	135.8	58%	0.583	69%	0.692	S	S	*	*			trans	-82	94.9	146.9	49.2	0	0	0	0	106.7	F361	T359-F361 PolarHBondContact O-N 2.86Å
360	P	40.3	Very low	41	Very low	106 Å²	106	140.1 Å²	140.1	69%	0.688	71%	0.71	S	S	*	*			trans	-57.4	115.9	167.6	25.5	-32.7	0	0	0	106	Q358 T362	Q358-P360 WeakPolarHBondContact O-CD 3.36Å; P360-T362 PolarHBondContact O-N 2.58Å
361	F	38.1	Very low	39.7	Very low	192 Å²	192	135.8 Å²	135.8	84%	0.842	71%	0.71	S	S	*	*			trans	-52.4	99.9	162.9	-83.6	-97.4	0	0	0	106	T359 D363	T359-F361 PolarHBondContact O-N 2.86Å; F361-D363 PolarHBondContact O-N 3.36Å
362	T	39.1	Very low	38.6	Very low	113 Å²	113	137.5 Å²	137.5	69%	0.693	72%	0.717	S	S	*	*			trans	-61.7	98.6	162.8	38.5	0	0	0	0	105.3	P360 F364	P360-T362 PolarHBondContact O-N 2.58Å; T362-F364 PolarHBondContact O-N 3.08Å
363	D	36.7	Very low	37.8	Very low	157 Å²	157	146.3 Å²	146.3	84%	0.84	74%	0.744	S	S	*	*			trans	-65.4	47.2	170.9	-121	-11.8	0	0	0	110.4	F361 N365	F361-D363 PolarHBondContact O-N 3.36Å; D363-N365 PolarHBondContact O-N 2.96Å
364	F	34.4	Very low	36.8	Very low	166 Å²	166	147.6 Å²	147.6	73%	0.728	76%	0.756	S	S	*	*			trans	-88.6	85	176.6	-98.9	-85.2	0	0	0	108.9	T362 I366	T362-F364 PolarHBondContact O-N 3.08Å; F364-I366 PolarHBondContact O-N 3.48Å
365	N	32.9	Very low	35.9	Very low	142 Å²	142	149.1 Å²	149.1	76%	0.759	78%	0.776	S	S	*	*			trans	46.5	58.7	141.1	-79.9	-34	0	0	0	116.8	D363 K367	D363-N365 PolarHBondContact O-N 2.96Å; N365-K367 PolarHBondContact O-N 3.44Å; N365-K367 VanDerWaalsContact O-N 3.07Å
366	I	33.1	Very low	35.2	Very low	170 Å²	170	151.3 Å²	151.3	87%	0.872	79%	0.791	S	S	*	*			trans	-84.2	63.6	158.9	-53.3	177.3	0	0	0	108.6	F364	F364-I366 PolarHBondContact O-N 3.48Å
367	K	33.3	Very low	34.4	Very low	193 Å²	193	153 Å²	153	84%	0.839	80%	0.801	S	S	*	*	S	Bend	trans	-138	61.5	162.5	-94.4	-168.1	-179.7	177.4	0	108.8	N365	N365-K367 PolarHBondContact O-N 3.44Å; N365-K367 VanDerWaalsContact O-N 3.07Å
368	Q	31.4	Very low	33.8	Very low	181 Å²	181	154 Å²	154	85%	0.846	81%	0.806	S	S	*	*	S	Bend	trans	163.8	89.5	147.2	-96.4	174.5	-12.8	0	0	109.5
369	T	31.9	Very low	33.6	Very low	145 Å²	145	153.5 Å²	153.5	89%	0.89	81%	0.808	S	S	*	*			trans	-169.8	84.2	138.8	10.5	0	0	0	0	108.8	G371	T369-G371 PolarHBondContact O-N 3.39Å
370	K	29.7	Very low	33.6	Very low	219 Å²	219	156.8 Å²	156.8	95%	0.952	82%	0.817	S	S	*	*			trans	-62	110.4	152.8	-85.4	178.4	171.8	178.2	0	106.5
371	G	29.4	Very low	33.2	Very low	64 Å²	64	159.3 Å²	159.3	66%	0.66	83%	0.825	S	S	*	*			trans	172.5	92.7	174	0	0	0	0	0	113.4	T369	T369-G371 PolarHBondContact O-N 3.39Å
372	K	28.9	Very low	33.1	Very low	196 Å²	196	157.4 Å²	157.4	85%	0.852	82%	0.818	S	S	*	*			trans	26	106.5	153.5	-75.7	176.6	171.5	177	0	117
373	Y	34.5	Very low	33.2	Very low	237 Å²	237	156.5 Å²	156.5	93%	0.929	82%	0.822	S	S	*	*				-147.1	134.9	129.8	-86.7	-74.5	0	0	0	110.3
374	T	29.9	Very low	33.3	Very low	130 Å²	130	158.2 Å²	158.2	80%	0.798	82%	0.822	S	S	*	*			trans	-74.6	157.8	-171.7	33.3	0	0	0	0	113.6
375	A	33.2	Very low	33.3	Very low	104 Å²	104	159.1 Å²	159.1	86%	0.86	83%	0.829	S	S	*	*			trans	-49.5	138.1	175	0	0	0	0	0	115
376	S	34.4	Very low	33.4	Very low	115 Å²	115	161.2 Å²	161.2	80%	0.804	83%	0.831	S	S	*	*			trans	-142.9	110.8	151.4	61.5	0	0	0	0	109.7
377	N	31.9	Very low	33.6	Very low	160 Å²	160	160.3 Å²	160.3	86%	0.856	83%	0.828	S	S	*	*			trans	-52.7	140.4	156.1	-89.7	-30	0	0	0	109.9
378	E	32.2	Very low	33.6	Very low	189 Å²	189	158.8 Å²	158.8	88%	0.883	83%	0.829	S	S	*	*				-170.7	137.5	120	-110.6	176.7	168.4	0	0	113.4
379	N	35.3	Very low	34.1	Very low	150 Å²	150	160 Å²	160	80%	0.802	85%	0.848	S	S	*	*			trans	-62.1	129.2	174.4	-69.7	-51.3	0	0	0	111.8
380	Q	35.1	Very low	34.2	Very low	164 Å²	164	160.8 Å²	160.8	77%	0.766	85%	0.846	S	S	*	*			trans	-133.2	89.4	154.1	-74.3	-171.9	-17.3	0	0	110.3	H382	Q380-H382 PolarHBondContact O-N 2.85Å
381	N	32.9	Very low	34.4	Very low	158 Å²	158	157.7 Å²	157.7	85%	0.845	84%	0.841	S	S	*	*			trans	-69.3	100.6	164	-88.1	-33.4	0	0	0	109	A383	N381-A383 PolarHBondContact O-N 2.95Å
382	H	35.9	Very low	34.7	Very low	152 Å²	152	162.9 Å²	162.9	70%	0.704	85%	0.851	S	S	*	*			trans	-85.4	82.2	167.1	-71.8	-80.6	0	0	0	109.9	Q380 F384	Q380-H382 PolarHBondContact O-N 2.85Å; H382-F384 PolarHBondContact O-N 3.12Å
383	A	39.8	Very low	35	Very low	94 Å²	94	161 Å²	161	78%	0.777	85%	0.851	S	S	*	*			trans	-85.6	90.3	167.4	0	0	0	0	0	109.4	N381 E385	N381-A383 PolarHBondContact O-N 2.95Å; A383-E385 PolarHBondContact O-N 2.82Å
384	F	39	Very low	35.1	Very low	194 Å²	194	156.3 Å²	156.3	85%	0.851	85%	0.846	S	S	*	*			trans	8.4	103.5	154.3	-72.4	-92.8	0	0	0	117.4	H382	H382-F384 PolarHBondContact O-N 3.12Å
385	E	34	Very low	35.4	Very low	185 Å²	185	158 Å²	158	86%	0.864	85%	0.849	S	S	*	*			trans	-68.4	130.3	162.8	-170.5	167.4	-165.2	0	0	109.8	A383	A383-E385 PolarHBondContact O-N 2.82Å
386	F	35.3	Very low	35.6	Very low	185 Å²	185	161.9 Å²	161.9	81%	0.811	85%	0.848	S	S	*	*			trans	-92.8	109	177.3	-102.2	-93.5	0	0	0	108.7	L388	F386-L388 PolarHBondContact O-N 3.07Å
387	D	38.6	Very low	35.7	Very low	151 Å²	151	165.5 Å²	165.5	81%	0.807	85%	0.852	S	S	*	*			trans	-73.1	111.9	164.8	-100.1	-26.4	0	0	0	109.4
388	L	31.9	Very low	36	Very low	161 Å²	161	165.9 Å²	165.9	84%	0.843	85%	0.851	S	S	*	*			trans	-87	120.3	158.8	-91.1	102.4	0	0	0	107.8	F386	F386-L388 PolarHBondContact O-N 3.07Å
389	V	41.8	Very low	36.3	Very low	208 Å²	208	163.8 Å²	163.8	100%	1.261	85%	0.848	S	S	*	*			trans	-105.6	0	157.9	-179.2	0	0	0	0	108.3

Retrieved 389 of 389 residues in 507.7 ms (Link to these results)

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