A0A077Z811_TRITR Loading...

Cysteine protease

Cysteine protease that plays a key role in autophagy by mediating both proteolytic activation and delipidation of ATG8 family proteins.

AlphaFold DB , UniProt , Accession A0A077Z811, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 422 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	37.4	Very low	54 Å²	54	95.5 Å²	95.5	27%	0.266	48%	0.481	S	S	.	.				0	58.6	0	-158.3	-165.5	-62.3	0	0	109.9	R37 E82 K280	M1-R37 PolarHBondContact O-NH2 2.59Å; M1-E82 WeakPolarHBondContact CE-O 3.36Å; M1-K280 PolarHBondContact N-O 2.67Å
2	G	31.4	Very low	36.9	Very low	14 Å²	14	94.8 Å²	94.8	14%	0.144	50%	0.501	C	S	.	.			trans	-117.9	113.4	166.5	0	0	0	0	0	106.8	L277 S278	G2-L277 CarbonylContact C-O 3.54Å; G2-L277 WeakPolarHBondContact CA-O 3.27Å; G2-S278 CarbonylContact O-C 3.57Å; G2-S278 WeakPolarHBondContact O-CA 3.2Å
3	R	51.9	Low	36.6	Very low	79 Å²	79	99.6 Å²	99.6	30%	0.298	53%	0.527	S	S	.	.			trans	-116.3	123.2	-165.4	-68.8	-176.6	-170.1	-132.6	0.2	110.7	Y5 D33	R3-Y5 HydrophobicContact CB-CD1 4.36Å; R3-Y5 HydrophobicContact CB-CD2 4.35Å; R3-Y5 HydrophobicContact CB-CE1 3.71Å; R3-Y5 HydrophobicContact CB-CE2 3.69Å; R3-Y5 WeakPolarHBondContact CD-OH 3.39Å; R3-Y5 HydrophobicContact CG-CE1 4.48Å; R3-Y5 WeakPolarHBondContact O-CD2 3.3Å; R3-Y5 VanDerWaalsContact O-CE2 3.27Å; R3-Y5 WeakPolarHBondContact O-CE2 3.47Å; R3-Y5 PolarHBondContact O-N 3.42Å; R3-D33 IonicContact NE-OD1 3.63Å
4	Q	42.1	Very low	36.7	Very low	81 Å²	81	107.6 Å²	107.6	38%	0.379	55%	0.546	S	S	.	.	B	Isolated β-bridge	trans	-76.5	112.3	163.7	176.3	179.9	-10	0	0	108.4	C6 W299	Q4-C6 HydrophobicContact CG-CB 4.4Å; Q4-C6 PolarHBondContact O-N 3.1Å; Q4-W299 HydrophobicContact CB-CH2 4.42Å; Q4-W299 HydrophobicContact CB-CZ2 3.87Å; Q4-W299 HydrophobicContact CG-CH2 3.78Å; Q4-W299 HydrophobicContact CG-CZ2 3.75Å
5	Y	45.7	Very low	36.4	Very low	27 Å²	27	117.2 Å²	117.2	11%	0.106	57%	0.573	C	S	.	*			trans	-97.5	84.8	176.6	-56.6	-77.2	0	0	0	109.7	R3 F30 D33 H300 I305	R3-Y5 HydrophobicContact CB-CD1 4.36Å; R3-Y5 HydrophobicContact CB-CD2 4.35Å; R3-Y5 HydrophobicContact CB-CE1 3.71Å; R3-Y5 HydrophobicContact CB-CE2 3.69Å; R3-Y5 WeakPolarHBondContact CD-OH 3.39Å; R3-Y5 HydrophobicContact CG-CE1 4.48Å; R3-Y5 WeakPolarHBondContact O-CD2 3.3Å; R3-Y5 VanDerWaalsContact O-CE2 3.27Å; R3-Y5 WeakPolarHBondContact O-CE2 3.47Å; R3-Y5 PolarHBondContact O-N 3.42Å; Y5-F30 HydrophobicContact CD1-CB 3.54Å; Y5-F30 HydrophobicContact CD1-CD2 4.01Å; Y5-F30 HydrophobicContact CD1-CG 4.06Å; Y5-F30 AromaticContact CD2-CD2 3.57Å; Y5-F30 HydrophobicContact CD2-CD2 3.57Å; Y5-F30 HydrophobicContact CD2-CE2 4.05Å; Y5-F30 HydrophobicContact CD2-CG 4.2Å; Y5-F30 HydrophobicContact CE1-CB 3.66Å; Y5-F30 AromaticContact CE1-CD2 3.8Å; Y5-F30 HydrophobicContact CE1-CD2 3.8Å; Y5-F30 HydrophobicContact CE1-CG 4.16Å; Y5-F30 AromaticContact CE2-CD2 3.35Å; Y5-F30 HydrophobicContact CE2-CD2 3.35Å; Y5-F30 AromaticContact CE2-CE2 3.82Å; Y5-F30 HydrophobicContact CE2-CE2 3.82Å; Y5-F30 HydrophobicContact CE2-CG 4.31Å; Y5-F30 HydrophobicContact CG-CB 4Å; Y5-F30 AromaticContact CG-CD2 3.87Å; Y5-F30 HydrophobicContact CG-CD2 3.87Å; Y5-F30 HydrophobicContact CG-CG 4.04Å; Y5-F30 AromaticContact CZ-CD2 3.45Å; Y5-F30 VanDerWaalsContact CZ-CD2 3.45Å; Y5-D33 PolarHBondContact OH-OD2 3.15Å; Y5-H300 PolarHBondContact O-CE1 3.16Å; Y5-H300 PolarHBondContact O-ND1 2.84Å; Y5-I305 HydrophobicContact CD2-CD1 3.87Å; Y5-I305 HydrophobicContact CE2-CD1 4.23Å
6	C	36.1	Very low	36.7	Very low	60 Å²	60	116.4 Å²	116.4	41%	0.405	57%	0.572	S	S	.	*			trans	-101.2	129.5	179.1	-142.4	0	0	0	0	111.9	Q4	Q4-C6 HydrophobicContact CG-CB 4.4Å; Q4-C6 PolarHBondContact O-N 3.1Å
7	R	34.8	Very low	36.5	Very low	182 Å²	182	121.5 Å²	121.5	69%	0.687	59%	0.594	S	S	*	*			trans	-78.1	128.8	166.5	-169.3	-176.1	-166.7	-161.6	12.4	107.8	E9	R7-E9 WeakPolarHBondContact CD-OE1 3.4Å; R7-E9 IonicContact CZ-OE1 2.79Å; R7-E9 IonicContact NE-OE1 2.88Å; R7-E9 IonicContact NH1-OE1 2.68Å; R7-E9 PolarHBondContact NH1-OE1 3.19Å; R7-E9 PolarHBondContact O-N 3.1Å
8	K	30.3	Very low	36.9	Very low	196 Å²	196	121.9 Å²	121.9	85%	0.852	59%	0.589	S	S	*	*			trans	-62.4	101.5	170.5	-75.1	-174.6	176	-177.3	0	109.7
9	E	35.8	Very low	37	Very low	93 Å²	93	125.3 Å²	125.3	44%	0.435	60%	0.604	S	S	.	*			trans	-127.4	118.2	164.8	-77.5	167.9	177.1	0	0	105.7	R7 L11 R301	R7-E9 WeakPolarHBondContact CD-OE1 3.4Å; R7-E9 IonicContact CZ-OE1 2.79Å; R7-E9 IonicContact NE-OE1 2.88Å; R7-E9 IonicContact NH1-OE1 2.68Å; R7-E9 PolarHBondContact NH1-OE1 3.19Å; R7-E9 PolarHBondContact O-N 3.1Å; E9-L11 PolarHBondContact O-N 3.28Å; E9-R301 IonicContact OE2-NH2 2.83Å; E9-R301 PolarHBondContact OE2-NH2 2.85Å
10	A	30.5	Very low	36.9	Very low	109 Å²	109	128.9 Å²	128.9	90%	0.901	62%	0.62	S	S	*	*			trans	-69.6	97.7	-172.5	0	0	0	0	0	111	A12	A10-A12 PolarHBondContact O-N 2.8Å
11	L	40.6	Very low	36.8	Very low	156 Å²	156	127.5 Å²	127.5	82%	0.817	63%	0.63	S	S	*	*			trans	-84.3	88.1	171.8	-72.4	174.1	0	0	0	109.4	E9 N13	E9-L11 PolarHBondContact O-N 3.28Å; L11-N13 PolarHBondContact O-N 2.91Å
12	A	32.5	Very low	37.2	Very low	87 Å²	87	128.4 Å²	128.4	72%	0.719	65%	0.646	S	S	*	*			trans	-55.4	138.6	168.2	0	0	0	0	0	110.6	A10	A10-A12 PolarHBondContact O-N 2.8Å
13	N	32	Very low	37.8	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	67%	0.67	S	S	*	*			trans	68.5	75.3	174.6	-54.9	-29.8	0	0	0	116.8	L11	L11-N13 PolarHBondContact O-N 2.91Å
14	R	37.7	Very low	37.4	Very low	211 Å²	211	136 Å²	136	80%	0.796	69%	0.69	S	S	*	*			trans	-148.7	133.6	137.7	-130.1	177.6	-70.1	-173.5	0.8	111.9	D16	R14-D16 WeakPolarHBondContact CD-OD2 3.49Å; R14-D16 PolarHBondContact O-N 3.11Å
15	R	32.5	Very low	38	Very low	252 Å²	252	133.4 Å²	133.4	95%	0.951	69%	0.685	S	S	*	*			trans	-86.7	72.7	177.5	-72.4	179.7	175.7	160.1	-3.2	110
16	D	41.5	Very low	39.2	Very low	105 Å²	105	136.2 Å²	136.2	56%	0.561	70%	0.702	S	S	*	*			trans	-124.6	119.8	173.1	-68.6	-57.7	0	0	0	108.9	R14 Y18	R14-D16 WeakPolarHBondContact CD-OD2 3.49Å; R14-D16 PolarHBondContact O-N 3.11Å; D16-Y18 HydrophobicContact CB-CD2 4.31Å; D16-Y18 HydrophobicContact CB-CE2 4.43Å; D16-Y18 PolarHBondContact O-N 3.07Å
17	Q	33.3	Very low	41.3	Very low	202 Å²	202	140 Å²	140	94%	0.944	72%	0.715	S	S	*	*			trans	-73.1	89	-178.9	-71	174.5	-16.8	0	0	110.5
18	Y	43.1	Very low	43.6	Very low	130 Å²	130	136.2 Å²	136.2	51%	0.51	71%	0.709	S	S	.	*			trans	-106.8	134.4	158	-77	-93.2	0	0	0	108.2	D16 E20 Y368	D16-Y18 HydrophobicContact CB-CD2 4.31Å; D16-Y18 HydrophobicContact CB-CE2 4.43Å; D16-Y18 PolarHBondContact O-N 3.07Å; Y18-E20 VanDerWaalsContact C-N 3.31Å; Y18-E20 PolarHBondContact O-N 3.43Å; Y18-Y368 PolarHBondContact OH-OH 3.03Å
19	E	38.7	Very low	46	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	68%	0.684	S	S	*	*			trans	-68.2	92.8	169.1	-73.4	-169.4	136.5	0	0	109.4	A21	E19-A21 PolarHBondContact O-N 3.39Å
20	E	36	Very low	48.5	Very low	198 Å²	198	126.5 Å²	126.5	93%	0.925	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	4.2	-172.4	-118.3	179	166.3	0	0	114.8	Y18	Y18-E20 VanDerWaalsContact C-N 3.31Å; Y18-E20 PolarHBondContact O-N 3.43Å
21	A	33.9	Very low	51.2	Low	100 Å²	100	123.7 Å²	123.7	83%	0.826	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-15.2	-165.8	0	0	0	0	0	115.6	E19	E19-A21 PolarHBondContact O-N 3.39Å
22	A	40.3	Very low	53.3	Low	72 Å²	72	118.4 Å²	118.4	60%	0.595	61%	0.612	S	S	*	*	S	Bend	trans	-78.7	-33.7	-160.2	0	0	0	0	0	117
23	F	45.3	Very low	55.8	Low	151 Å²	151	114.9 Å²	114.9	66%	0.662	58%	0.581	S	S	*	*			trans	-145.5	118.7	-174.6	-75	-79.4	0	0	0	114.9
24	S	43.1	Very low	58.6	Low	102 Å²	102	107.5 Å²	107.5	71%	0.713	54%	0.541	S	S	*	.			trans	-121.2	67.3	170.9	65.2	0	0	0	0	112
25	G	55	Low	61.1	Low	27 Å²	27	98.4 Å²	98.4	28%	0.278	51%	0.51	S	S	.	.			trans	-76.3	134.5	165.6	0	0	0	0	0	110.3
26	N	70.1	Confident	63.8	Low	86 Å²	86	87.1 Å²	87.1	46%	0.46	47%	0.47	S	S	.	.			trans	-77.4	179.1	174.9	75	16.8	0	0	0	110.8	D28 D29 F30	N26-D28 PolarHBondContact O-N 2.87Å; N26-D28 WeakPolarHBondContact OD1-CA 3.25Å; N26-D28 WeakPolarHBondContact OD1-CB 3.43Å; N26-D28 PolarHBondContact OD1-N 3.3Å; N26-D29 PolarHBondContact N-OD2 3.01Å; N26-D29 VanDerWaalsContact N-OD2 3.1Å; N26-D29 PolarHBondContact OD1-N 2.85Å; N26-D29 PolarHBondContact OD1-OD2 3.19Å; N26-F30 PolarHBondContact O-N 3.06Å
27	M	79.9	Confident	66.2	Low	138 Å²	138	82.7 Å²	82.7	68%	0.68	45%	0.445	S	S	*	.	H	α-helix	trans	-66.8	-27.9	179.9	-178.4	164.1	167.2	0	0	112.5	F30 L31	M27-F30 WeakPolarHBondContact O-CB 3.49Å; M27-L31 HydrophobicContact CE-CD1 4.14Å; M27-L31 HydrophobicContact CG-CD1 4.26Å; M27-L31 VanDerWaalsContact O-CG 3.32Å; M27-L31 WeakPolarHBondContact O-CG 3.37Å; M27-L31 PolarHBondContact O-N 3.05Å
28	D	83	Confident	69.2	Low	104 Å²	104	73.4 Å²	73.4	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-75.6	-41.3	179.9	-52.2	-52.1	0	0	0	111.1	N26 F30 L31 V32	N26-D28 PolarHBondContact O-N 2.87Å; N26-D28 WeakPolarHBondContact OD1-CA 3.25Å; N26-D28 WeakPolarHBondContact OD1-CB 3.43Å; N26-D28 PolarHBondContact OD1-N 3.3Å; D28-F30 VanDerWaalsContact C-N 3.27Å; D28-F30 PolarHBondContact O-N 3.42Å; D28-L31 PolarHBondContact O-N 2.93Å; D28-L31 VanDerWaalsContact O-N 3.1Å; D28-V32 WeakPolarHBondContact O-CG2 3.42Å; D28-V32 PolarHBondContact O-N 3.38Å
29	D	82.3	Confident	71.8	Confident	60 Å²	60	68.7 Å²	68.7	32%	0.321	38%	0.383	S	S	.	.	H	α-helix	trans	-54.6	-44.9	170.8	-73.9	-47.1	0	0	0	111.4	N26 D33	N26-D29 PolarHBondContact N-OD2 3.01Å; N26-D29 VanDerWaalsContact N-OD2 3.1Å; N26-D29 PolarHBondContact OD1-N 2.85Å; N26-D29 PolarHBondContact OD1-OD2 3.19Å; D29-D33 WeakPolarHBondContact O-CB 3.44Å; D29-D33 PolarHBondContact O-N 2.8Å
30	F	86.3	Confident	74.6	Confident	24 Å²	24	59.9 Å²	59.9	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-49.7	173.6	166.7	-124.1	0	0	0	111.8	Y5 N26 M27 D28 V32 D33 F34 I305 P331	Y5-F30 HydrophobicContact CD1-CB 3.54Å; Y5-F30 HydrophobicContact CD1-CD2 4.01Å; Y5-F30 HydrophobicContact CD1-CG 4.06Å; Y5-F30 AromaticContact CD2-CD2 3.57Å; Y5-F30 HydrophobicContact CD2-CD2 3.57Å; Y5-F30 HydrophobicContact CD2-CE2 4.05Å; Y5-F30 HydrophobicContact CD2-CG 4.2Å; Y5-F30 HydrophobicContact CE1-CB 3.66Å; Y5-F30 AromaticContact CE1-CD2 3.8Å; Y5-F30 HydrophobicContact CE1-CD2 3.8Å; Y5-F30 HydrophobicContact CE1-CG 4.16Å; Y5-F30 AromaticContact CE2-CD2 3.35Å; Y5-F30 HydrophobicContact CE2-CD2 3.35Å; Y5-F30 AromaticContact CE2-CE2 3.82Å; Y5-F30 HydrophobicContact CE2-CE2 3.82Å; Y5-F30 HydrophobicContact CE2-CG 4.31Å; Y5-F30 HydrophobicContact CG-CB 4Å; Y5-F30 AromaticContact CG-CD2 3.87Å; Y5-F30 HydrophobicContact CG-CD2 3.87Å; Y5-F30 HydrophobicContact CG-CG 4.04Å; Y5-F30 AromaticContact CZ-CD2 3.45Å; Y5-F30 VanDerWaalsContact CZ-CD2 3.45Å; N26-F30 PolarHBondContact O-N 3.06Å; M27-F30 WeakPolarHBondContact O-CB 3.49Å; D28-F30 VanDerWaalsContact C-N 3.27Å; D28-F30 PolarHBondContact O-N 3.42Å; F30-V32 VanDerWaalsContact C-N 3.29Å; F30-V32 PolarHBondContact O-N 3.25Å; F30-D33 PolarHBondContact O-N 3.35Å; F30-F34 HydrophobicContact CD2-CB 4.33Å; F30-F34 HydrophobicContact CE2-CB 3.91Å; F30-F34 HydrophobicContact CE2-CD2 4.26Å; F30-F34 HydrophobicContact CE2-CG 4.35Å; F30-F34 HydrophobicContact CZ-CB 4.31Å; F30-F34 HydrophobicContact CZ-CD2 4.42Å; F30-F34 HydrophobicContact CZ-CG 4.44Å; F30-F34 VanDerWaalsContact O-CB 3.26Å; F30-F34 WeakPolarHBondContact O-CB 3.32Å; F30-F34 PolarHBondContact O-N 3.3Å; F30-I305 HydrophobicContact CE2-CD1 3.81Å; F30-I305 HydrophobicContact CE2-CG2 4.06Å; F30-I305 HydrophobicContact CZ-CD1 4Å; F30-I305 HydrophobicContact CZ-CG2 3.93Å; F30-P331 HydrophobicContact CE1-CB 4.16Å; F30-P331 HydrophobicContact CE1-CG 3.76Å; F30-P331 HydrophobicContact CZ-CB 3.71Å; F30-P331 HydrophobicContact CZ-CG 3.83Å
31	L	87.2	Confident	77.5	Confident	51 Å²	51	50.5 Å²	50.5	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-33.4	-177.2	-73.2	173.8	0	0	0	112	M27 D28 S35 P331	M27-L31 HydrophobicContact CE-CD1 4.14Å; M27-L31 HydrophobicContact CG-CD1 4.26Å; M27-L31 VanDerWaalsContact O-CG 3.32Å; M27-L31 WeakPolarHBondContact O-CG 3.37Å; M27-L31 PolarHBondContact O-N 3.05Å; D28-L31 PolarHBondContact O-N 2.93Å; D28-L31 VanDerWaalsContact O-N 3.1Å; L31-S35 WeakPolarHBondContact O-CB 3.49Å; L31-S35 PolarHBondContact O-N 3.38Å; L31-S35 PolarHBondContact O-OG 3.02Å; L31-P331 HydrophobicContact CD2-CG 3.98Å
32	V	85.7	Confident	80.5	Confident	45 Å²	45	46.1 Å²	46.1	27%	0.273	26%	0.26	S	S	.	.	H	α-helix	trans	-70.9	-44.7	174.5	176.6	0	0	0	0	111.5	D28 F30 S35 S36 R86	D28-V32 WeakPolarHBondContact O-CG2 3.42Å; D28-V32 PolarHBondContact O-N 3.38Å; F30-V32 VanDerWaalsContact C-N 3.29Å; F30-V32 PolarHBondContact O-N 3.25Å; V32-S35 PolarHBondContact O-N 3.2Å; V32-S36 WeakPolarHBondContact O-CB 3.45Å; V32-S36 PolarHBondContact O-N 2.91Å; V32-S36 PolarHBondContact O-OG 3.27Å; V32-R86 HydrophobicContact CG1-CG 4.36Å; V32-R86 VanDerWaalsContact CG1-NH1 3.34Å
33	D	85.5	Confident	83.3	Confident	12 Å²	12	42.9 Å²	42.9	6%	0.064	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-36.6	175.2	-174.2	87	0	0	0	112.6	R3 Y5 D29 F30 S36 R37	R3-D33 IonicContact NE-OD1 3.63Å; Y5-D33 PolarHBondContact OH-OD2 3.15Å; D29-D33 WeakPolarHBondContact O-CB 3.44Å; D29-D33 PolarHBondContact O-N 2.8Å; F30-D33 PolarHBondContact O-N 3.35Å; D33-S36 PolarHBondContact O-OG 3.13Å; D33-R37 IonicContact OD2-NE 2.7Å; D33-R37 IonicContact OD2-NH2 2.73Å
34	F	91	Very high	85.8	Confident	2 Å²	2	40 Å²	40	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-71.3	-41.7	175.4	-176.1	-92	0	0	0	111.7	F30 S36 V297 I305 M307 C328 P331	F30-F34 HydrophobicContact CD2-CB 4.33Å; F30-F34 HydrophobicContact CE2-CB 3.91Å; F30-F34 HydrophobicContact CE2-CD2 4.26Å; F30-F34 HydrophobicContact CE2-CG 4.35Å; F30-F34 HydrophobicContact CZ-CB 4.31Å; F30-F34 HydrophobicContact CZ-CD2 4.42Å; F30-F34 HydrophobicContact CZ-CG 4.44Å; F30-F34 VanDerWaalsContact O-CB 3.26Å; F30-F34 WeakPolarHBondContact O-CB 3.32Å; F30-F34 PolarHBondContact O-N 3.3Å; F34-S36 VanDerWaalsContact C-N 3.32Å; F34-S36 PolarHBondContact O-N 2.63Å; F34-V297 HydrophobicContact CD2-CG2 3.94Å; F34-V297 HydrophobicContact CE2-CG2 3.84Å; F34-I305 HydrophobicContact CD2-CG2 3.91Å; F34-I305 HydrophobicContact CE2-CG2 3.86Å; F34-M307 HydrophobicContact CD1-CE 4.42Å; F34-M307 HydrophobicContact CD2-CE 4.31Å; F34-M307 HydrophobicContact CE1-CE 4.08Å; F34-M307 HydrophobicContact CE2-CE 3.95Å; F34-M307 HydrophobicContact CE2-CG 3.82Å; F34-M307 HydrophobicContact CZ-CE 3.81Å; F34-M307 HydrophobicContact CZ-CG 3.73Å; F34-M307 WeakPolarHBondContact O-CE 3.43Å; F34-C328 VanDerWaalsContact CD1-O 3.29Å; F34-C328 WeakPolarHBondContact CD1-O 3.48Å; F34-C328 HydrophobicContact CE1-CB 3.82Å; F34-C328 VanDerWaalsContact CE1-O 3.27Å; F34-C328 WeakPolarHBondContact CE1-O 3.12Å; F34-C328 HydrophobicContact CZ-CB 4.34Å; F34-P331 HydrophobicContact CD1-CB 3.86Å; F34-P331 HydrophobicContact CD1-CG 4.23Å; F34-P331 HydrophobicContact CD2-CB 3.98Å; F34-P331 VanDerWaalsContact CE1-CA 3.48Å; F34-P331 HydrophobicContact CE1-CB 3.72Å; F34-P331 HydrophobicContact CE1-CG 4.38Å; F34-P331 HydrophobicContact CE2-CB 3.85Å; F34-P331 HydrophobicContact CG-CB 3.99Å; F34-P331 VanDerWaalsContact CZ-CA 3.44Å; F34-P331 HydrophobicContact CZ-CB 3.74Å
35	S	89.9	Confident	88.4	Confident	20 Å²	20	38 Å²	38	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-79.8	-8.5	-177.4	-55	0	0	0	0	114	L31 V32 H327 C328	L31-S35 WeakPolarHBondContact O-CB 3.49Å; L31-S35 PolarHBondContact O-N 3.38Å; L31-S35 PolarHBondContact O-OG 3.02Å; V32-S35 PolarHBondContact O-N 3.2Å; S35-H327 WeakPolarHBondContact O-CB 2.94Å; S35-H327 PolarHBondContact O-ND1 3.1Å; S35-C328 PolarHBondContact OG-O 3.22Å
36	S	88.9	Confident	90.4	Very high	15 Å²	15	37.1 Å²	37.1	11%	0.105	20%	0.204	C	C	.	.	H	α-helix	trans	-84.7	-20.8	172.9	65.6	0	0	0	0	113.2	V32 D33 F34 W85 P87 H327	V32-S36 WeakPolarHBondContact O-CB 3.45Å; V32-S36 PolarHBondContact O-N 2.91Å; V32-S36 PolarHBondContact O-OG 3.27Å; D33-S36 PolarHBondContact O-OG 3.13Å; F34-S36 VanDerWaalsContact C-N 3.32Å; F34-S36 PolarHBondContact O-N 2.63Å; S36-W85 WeakPolarHBondContact O-CZ3 3.48Å; S36-P87 VanDerWaalsContact CB-CD 3.41Å; S36-H327 PolarHBondContact O-CE1 3.21Å; S36-H327 VanDerWaalsContact O-CE1 3.25Å
37	R	92.1	Very high	91.7	Very high	13 Å²	13	37.4 Å²	37.4	5%	0.049	20%	0.202	C	C	.	.	S	Bend	trans	-74.8	137.5	-177.8	-70.6	171.6	-174.3	-92.6	6.5	111.6	M1 D33 W39 E73 M307	M1-R37 PolarHBondContact O-NH2 2.59Å; D33-R37 IonicContact OD2-NE 2.7Å; D33-R37 IonicContact OD2-NH2 2.73Å; R37-W39 PolarHBondContact O-N 2.78Å; R37-W39 VanDerWaalsContact O-N 3.09Å; R37-E73 IonicContact CZ-OE1 3.85Å; R37-E73 IonicContact CZ-OE2 3.17Å; R37-E73 IonicContact NH1-OE1 3.84Å; R37-E73 PolarHBondContact NH1-OE1 3.32Å; R37-E73 IonicContact NH1-OE2 3.83Å; R37-E73 PolarHBondContact NH1-OE2 2.87Å; R37-M307 HydrophobicContact CB-CE 3.5Å; R37-M307 VanDerWaalsContact CB-CE 3.5Å; R37-M307 HydrophobicContact CB-SD 4.17Å
38	I	95.5	Very high	92.5	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.036	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-68.1	108.5	-177.8	-64.8	165.3	0	0	0	110.3	L40 M69 A72 M76 Y102 I105 V106 C326	I38-L40 HydrophobicContact CG2-CD1 4.23Å; I38-L40 HydrophobicContact CG2-CD2 4.19Å; I38-L40 HydrophobicContact CG2-CG 3.96Å; I38-M69 WeakPolarHBondContact O-CG 3.1Å; I38-A72 HydrophobicContact CB-CB 3.92Å; I38-A72 HydrophobicContact CD1-CB 3.95Å; I38-A72 HydrophobicContact CG2-CB 3.91Å; I38-M76 HydrophobicContact CD1-CG 3.7Å; I38-M76 HydrophobicContact CD1-SD 3.66Å; I38-Y102 HydrophobicContact CD1-CD2 4.41Å; I38-Y102 HydrophobicContact CD1-CE2 4.28Å; I38-Y102 HydrophobicContact CG1-CE2 4.09Å; I38-I105 HydrophobicContact CD1-CG2 4.17Å; I38-V106 HydrophobicContact CD1-CG2 3.6Å; I38-V106 HydrophobicContact CG1-CG2 3.92Å; I38-V106 HydrophobicContact CG2-CG2 4.38Å; I38-C326 CarbonylContact C-O 3.52Å; I38-C326 WeakPolarHBondContact CA-O 3.39Å
39	W	97.6	Very high	93.1	Very high	30 Å²	30	33.6 Å²	33.6	11%	0.114	17%	0.173	C	C	.	.			trans	-92.7	117	175.5	178.7	47.5	0	0	0	111.4	R37 M307 D308 Y311 C326 C328	R37-W39 PolarHBondContact O-N 2.78Å; R37-W39 VanDerWaalsContact O-N 3.09Å; W39-M307 HydrophobicContact CB-SD 4.21Å; W39-D308 WeakPolarHBondContact CZ2-O 3.33Å; W39-D308 PolarHBondContact NE1-O 3.37Å; W39-Y311 AromaticContact CH2-CD1 3.67Å; W39-Y311 HydrophobicContact CH2-CD1 3.67Å; W39-Y311 HydrophobicContact CH2-CG 4.14Å; W39-Y311 HydrophobicContact CZ2-CD1 4.41Å; W39-Y311 HydrophobicContact CZ3-CD1 4.44Å; W39-C326 PolarHBondContact N-O 3.29Å; W39-C326 WeakPolarHBondContact O-CA 3.36Å; W39-C328 HydrophobicContact CB-CB 3.84Å; W39-C328 HydrophobicContact CD2-CB 3.66Å; W39-C328 HydrophobicContact CE3-CB 3.79Å; W39-C328 HydrophobicContact CG-CB 3.7Å
40	L	98	Very high	93.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.005	18%	0.183	C	C	.	.			trans	-115.3	116.9	175.5	-60	170.1	0	0	0	108.6	I38 Q68 M69 F109 L316	I38-L40 HydrophobicContact CG2-CD1 4.23Å; I38-L40 HydrophobicContact CG2-CD2 4.19Å; I38-L40 HydrophobicContact CG2-CG 3.96Å; L40-Q68 HydrophobicContact CD1-CB 3.45Å; L40-Q68 VanDerWaalsContact CD1-CB 3.45Å; L40-Q68 HydrophobicContact CD1-CG 4.44Å; L40-M69 HydrophobicContact CB-CG 3.83Å; L40-M69 HydrophobicContact CG-CG 4.27Å; L40-M69 PolarHBondContact N-SD 2.94Å; L40-M69 WeakPolarHBondContact O-CE 3.36Å; L40-F109 HydrophobicContact CD1-CB 3.77Å; L40-F109 HydrophobicContact CD1-CD1 3.8Å; L40-F109 HydrophobicContact CD1-CG 3.78Å; L40-F109 HydrophobicContact CD2-CB 4.35Å; L40-L316 HydrophobicContact CD2-CD2 4.32Å
41	S	97.2	Very high	93.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.216	C	C	.	.			trans	-113	-179.5	-179.6	78	0	0	0	0	111	R65 P309 Y311 Q313	S41-R65 PolarHBondContact O-NE 3.11Å; S41-P309 CarbonylContact C-O 3.59Å; S41-P309 WeakPolarHBondContact CA-O 3.36Å; S41-P309 WeakPolarHBondContact CB-O 3.32Å; S41-Y311 WeakPolarHBondContact CB-O 3.24Å; S41-Y311 PolarHBondContact OG-O 3.16Å; S41-Q313 PolarHBondContact OG-NE2 3.23Å
42	Y	97.9	Very high	94.2	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.035	22%	0.215	C	C	.	.			trans	-52.6	141.7	169.4	-70.1	-42.8	0	0	0	111.5	D57 C58 G59 C62 P309 H310 Y311 S312 Q313	Y42-D57 VanDerWaalsContact CD1-O 3.29Å; Y42-D57 WeakPolarHBondContact CD1-O 3.15Å; Y42-D57 WeakPolarHBondContact CD1-OD2 3.41Å; Y42-D57 WeakPolarHBondContact CE1-O 3.41Å; Y42-C58 HydrophobicContact CD2-CB 4.49Å; Y42-C58 HydrophobicContact CG-CB 4.39Å; Y42-G59 VanDerWaalsContact CZ-N 3.32Å; Y42-G59 PolarHBondContact OH-N 2.74Å; Y42-C62 HydrophobicContact CE1-CB 4.1Å; Y42-C62 VanDerWaalsContact CE1-N 3.35Å; Y42-C62 WeakPolarHBondContact OH-CB 3.21Å; Y42-P309 PolarHBondContact N-O 3.22Å; Y42-H310 HydrophobicContact CE2-CB 4.13Å; Y42-H310 AromaticContact CE2-CD2 3.64Å; Y42-H310 AromaticContact CZ-CD2 3.91Å; Y42-Y311 PolarHBondContact N-O 3.07Å; Y42-Y311 VanDerWaalsContact O-O 3.06Å; Y42-S312 WeakPolarHBondContact O-CA 2.99Å; Y42-Q313 PolarHBondContact O-N 3.06Å
43	R	98.3	Very high	94.7	Very high	4 Å²	4	41 Å²	41	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155.1	179.7	-61.2	-83.1	170.7	175.4	-1.2	111	F46 S56 D57 D111 Q313 R314 S325	R43-F46 HydrophobicContact CB-CD1 3.92Å; R43-F46 HydrophobicContact CB-CE1 4.08Å; R43-S56 WeakPolarHBondContact O-CA 3.42Å; R43-S56 VanDerWaalsContact O-CB 3.32Å; R43-S56 WeakPolarHBondContact O-CB 3.44Å; R43-S56 PolarHBondContact O-OG 2.83Å; R43-D57 PolarHBondContact N-OD1 2.85Å; R43-D57 PolarHBondContact O-N 2.96Å; R43-D111 WeakPolarHBondContact CB-OD2 3.43Å; R43-D111 WeakPolarHBondContact CD-OD2 3.31Å; R43-D111 WeakPolarHBondContact CG-OD2 3.12Å; R43-Q313 CarbonylContact C-O 3.55Å; R43-Q313 WeakPolarHBondContact CA-O 3.17Å; R43-R314 WeakPolarHBondContact CD-O 3.19Å; R43-R314 PolarHBondContact NH1-O 3Å; R43-S325 PolarHBondContact NH1-OG 2.86Å; R43-S325 PolarHBondContact NH2-O 3.31Å; R43-S325 PolarHBondContact NH2-OG 3.19Å
44	F	98.1	Very high	95.2	Very high	89 Å²	89	43 Å²	43	39%	0.39	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156	174.9	70	-91	0	0	0	111.7	F46 T55 S312 Q313 R314 A315	F44-F46 VanDerWaalsContact C-N 3.35Å; F44-T55 CarbonylContact C-O 3.53Å; F44-T55 WeakPolarHBondContact CA-O 3.25Å; F44-S312 WeakPolarHBondContact CD1-OG 3.4Å; F44-Q313 VanDerWaalsContact CD1-C 3.46Å; F44-Q313 WeakPolarHBondContact CD1-O 3.43Å; F44-Q313 WeakPolarHBondContact CE1-O 3.4Å; F44-Q313 PolarHBondContact N-O 3.07Å; F44-R314 HydrophobicContact CE1-CG 4.41Å; F44-R314 HydrophobicContact CE2-CG 4.03Å; F44-R314 HydrophobicContact CZ-CG 3.77Å; F44-A315 PolarHBondContact O-N 3.19Å
45	G	97.3	Very high	95.5	Very high	60 Å²	60	45.7 Å²	45.7	62%	0.619	26%	0.262	S	S	*	.	S	Bend	trans	78.3	19.3	-177.9	0	0	0	0	0	113.7	T55	G45-T55 PolarHBondContact N-O 3.06Å
46	F	97.5	Very high	95.9	Very high	9 Å²	9	46.2 Å²	46.2	4%	0.039	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-82.1	169	170.2	51.6	-122.4	0	0	0	111.7	R43 F44 I49 T55 D57 D111 I119 H120 A315	R43-F46 HydrophobicContact CB-CD1 3.92Å; R43-F46 HydrophobicContact CB-CE1 4.08Å; F44-F46 VanDerWaalsContact C-N 3.35Å; F46-I49 HydrophobicContact CE2-CD1 3.97Å; F46-I49 HydrophobicContact CE2-CG1 3.97Å; F46-I49 HydrophobicContact CZ-CD1 4.31Å; F46-T55 VanDerWaalsContact CD2-C 3.46Å; F46-T55 WeakPolarHBondContact CD2-O 3.31Å; F46-T55 PolarHBondContact N-O 3.1Å; F46-T55 WeakPolarHBondContact O-CB 3.33Å; F46-T55 WeakPolarHBondContact O-CG2 3.42Å; F46-D57 HydrophobicContact CE1-CB 4.26Å; F46-D57 HydrophobicContact CZ-CB 4.11Å; F46-D57 VanDerWaalsContact CZ-N 3.34Å; F46-D111 HydrophobicContact CB-CB 3.6Å; F46-D111 WeakPolarHBondContact CB-O 3.4Å; F46-D111 HydrophobicContact CD1-CB 3.75Å; F46-D111 HydrophobicContact CG-CB 4.01Å; F46-I119 HydrophobicContact CD1-CG2 4.46Å; F46-I119 HydrophobicContact CE1-CG2 4.05Å; F46-I119 HydrophobicContact CZ-CG2 4.1Å; F46-H120 AromaticContact CD2-CE1 3.76Å; F46-H120 AromaticContact CD2-NE2 3.92Å; F46-A315 HydrophobicContact CB-CB 3.69Å
47	E	96.1	Very high	96.3	Very high	92 Å²	92	45.5 Å²	45.5	43%	0.43	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-57.7	146.6	177.8	-62.5	-165.1	170	0	0	112.7	I49 K113 H120	E47-I49 PolarHBondContact O-N 2.87Å; E47-K113 IonicContact OE2-NZ 3.8Å; E47-K113 PolarHBondContact OE2-NZ 3.47Å; E47-H120 PolarHBondContact O-NE2 2.83Å
48	R	97.2	Very high	96.5	Very high	157 Å²	157	48.1 Å²	48.1	59%	0.592	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-54.1	128.2	177.8	-68.4	-178.6	-177.8	176.3	2.7	111.4	M54 T55	R48-M54 WeakPolarHBondContact CA-O 3.28Å; R48-T55 HydrophobicContact CG-CG2 3.75Å
49	I	96.6	Very high	96.4	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.026	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-63.5	137	173	-62.4	173.3	0	0	0	109	F46 E47 G51 T52 M54 W60 V123 P134	F46-I49 HydrophobicContact CE2-CD1 3.97Å; F46-I49 HydrophobicContact CE2-CG1 3.97Å; F46-I49 HydrophobicContact CZ-CD1 4.31Å; E47-I49 PolarHBondContact O-N 2.87Å; I49-G51 PolarHBondContact O-N 2.95Å; I49-T52 PolarHBondContact O-N 2.95Å; I49-T52 PolarHBondContact O-OG1 2.71Å; I49-M54 HydrophobicContact CD1-CB 4.23Å; I49-M54 PolarHBondContact N-O 2.95Å; I49-W60 HydrophobicContact CD1-CH2 3.69Å; I49-W60 HydrophobicContact CD1-CZ2 3.69Å; I49-V123 HydrophobicContact CG2-CB 4.42Å; I49-V123 HydrophobicContact CG2-CG1 3.79Å; I49-P134 HydrophobicContact CG2-CB 3.9Å; I49-P134 HydrophobicContact CG2-CG 4.09Å
50	A	92.9	Very high	96.2	Very high	65 Å²	65	49 Å²	49	54%	0.537	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	121.2	-172.8	0	0	0	0	0	112.1	R127	A50-R127 PolarHBondContact O-NH1 2.84Å
51	G	91.3	Very high	96.2	Very high	77 Å²	77	49 Å²	49	79%	0.794	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	8.6	-178.6	0	0	0	0	0	115.8	I49	I49-G51 PolarHBondContact O-N 2.95Å
52	T	94.1	Very high	96.1	Very high	39 Å²	39	49 Å²	49	24%	0.239	30%	0.295	C	S	.	.	S	Bend	trans	-139.3	174.8	173.4	73.9	0	0	0	0	113	I49 M54 P134	I49-T52 PolarHBondContact O-N 2.95Å; I49-T52 PolarHBondContact O-OG1 2.71Å; T52-M54 VanDerWaalsContact C-N 3.32Å; T52-M54 HydrophobicContact CG2-SD 4.37Å; T52-M54 WeakPolarHBondContact OG1-CB 3.4Å; T52-M54 WeakPolarHBondContact OG1-CG 3.47Å; T52-M54 PolarHBondContact OG1-N 3.14Å; T52-P134 HydrophobicContact CG2-CB 3.76Å; T52-P134 HydrophobicContact CG2-CG 3.91Å
53	H	95.2	Very high	96.1	Very high	155 Å²	155	48.6 Å²	48.6	72%	0.718	29%	0.293	S	S	*	.			trans	-90.2	8.4	170.2	-60.7	-75.3	0	0	0	113.3	T55	H53-T55 PolarHBondContact O-N 3.39Å
54	M	96.3	Very high	96	Very high	54 Å²	54	48.4 Å²	48.4	27%	0.266	29%	0.292	S	S	.	.			trans	-77.5	124.2	-171	-58.5	176.3	78.3	0	0	111.7	R48 I49 T52 W60 P134	R48-M54 WeakPolarHBondContact CA-O 3.28Å; I49-M54 HydrophobicContact CD1-CB 4.23Å; I49-M54 PolarHBondContact N-O 2.95Å; T52-M54 VanDerWaalsContact C-N 3.32Å; T52-M54 HydrophobicContact CG2-SD 4.37Å; T52-M54 WeakPolarHBondContact OG1-CB 3.4Å; T52-M54 WeakPolarHBondContact OG1-CG 3.47Å; T52-M54 PolarHBondContact OG1-N 3.14Å; M54-W60 HydrophobicContact CE-CD2 4.42Å; M54-W60 HydrophobicContact CE-CZ2 3.84Å; M54-P134 HydrophobicContact SD-CB 4.34Å
55	T	97.8	Very high	96	Very high	59 Å²	59	44.2 Å²	44.2	36%	0.362	27%	0.274	S	S	.	.			trans	-122.9	15.9	177.5	56	0	0	0	0	112.4	F44 G45 F46 R48 H53	F44-T55 CarbonylContact C-O 3.53Å; F44-T55 WeakPolarHBondContact CA-O 3.25Å; G45-T55 PolarHBondContact N-O 3.06Å; F46-T55 VanDerWaalsContact CD2-C 3.46Å; F46-T55 WeakPolarHBondContact CD2-O 3.31Å; F46-T55 PolarHBondContact N-O 3.1Å; F46-T55 WeakPolarHBondContact O-CB 3.33Å; F46-T55 WeakPolarHBondContact O-CG2 3.42Å; R48-T55 HydrophobicContact CG-CG2 3.75Å; H53-T55 PolarHBondContact O-N 3.39Å
56	S	97.9	Very high	96	Very high	30 Å²	30	41.3 Å²	41.3	21%	0.21	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-149.1	147.5	173.6	-177.9	0	0	0	0	111.2	R43 C58 W60	R43-S56 WeakPolarHBondContact O-CA 3.42Å; R43-S56 VanDerWaalsContact O-CB 3.32Å; R43-S56 WeakPolarHBondContact O-CB 3.44Å; R43-S56 PolarHBondContact O-OG 2.83Å; S56-C58 WeakPolarHBondContact OG-CB 3.44Å; S56-C58 PolarHBondContact OG-N 3.49Å; S56-W60 PolarHBondContact O-NE1 2.84Å
57	D	97.3	Very high	96.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.243	C	C	.	.			trans	-97.7	6.5	173.4	72.6	-63.1	0	0	0	114.3	Y42 R43 F46 G59 W60 G61 R65 I119	Y42-D57 VanDerWaalsContact CD1-O 3.29Å; Y42-D57 WeakPolarHBondContact CD1-O 3.15Å; Y42-D57 WeakPolarHBondContact CD1-OD2 3.41Å; Y42-D57 WeakPolarHBondContact CE1-O 3.41Å; R43-D57 PolarHBondContact N-OD1 2.85Å; R43-D57 PolarHBondContact O-N 2.96Å; F46-D57 HydrophobicContact CE1-CB 4.26Å; F46-D57 HydrophobicContact CZ-CB 4.11Å; F46-D57 VanDerWaalsContact CZ-N 3.34Å; D57-G59 PolarHBondContact O-N 3.41Å; D57-W60 VanDerWaalsContact CA-CE2 3.46Å; D57-W60 HydrophobicContact CB-CD2 4.47Å; D57-W60 HydrophobicContact CB-CH2 3.98Å; D57-W60 HydrophobicContact CB-CZ2 3.64Å; D57-W60 PolarHBondContact O-N 3.3Å; D57-G61 PolarHBondContact O-N 3.06Å; D57-R65 VanDerWaalsContact CG-NH2 3.3Å; D57-R65 IonicContact OD1-CZ 2.78Å; D57-R65 IonicContact OD1-NE 2.74Å; D57-R65 IonicContact OD1-NH2 2.75Å; D57-R65 PolarHBondContact OD1-NH2 3.45Å; D57-R65 WeakPolarHBondContact OD2-CG 3.26Å; D57-R65 IonicContact OD2-CZ 3.83Å; D57-R65 IonicContact OD2-NE 3.25Å; D57-R65 PolarHBondContact OD2-NE 3.09Å; D57-R65 IonicContact OD2-NH2 3.86Å; D57-I119 HydrophobicContact CB-CD1 4.28Å; D57-I119 HydrophobicContact CB-CG1 3.98Å
58	C	96.2	Very high	96.2	Very high	69 Å²	69	36.6 Å²	36.6	47%	0.466	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	131.2	179	-166	0	0	0	0	112.2	Y42 S56 W60	Y42-C58 HydrophobicContact CD2-CB 4.49Å; Y42-C58 HydrophobicContact CG-CB 4.39Å; S56-C58 WeakPolarHBondContact OG-CB 3.44Å; S56-C58 PolarHBondContact OG-N 3.49Å; C58-W60 VanDerWaalsContact C-N 3.34Å; C58-W60 VanDerWaalsContact O-CD1 3.29Å; C58-W60 PolarHBondContact O-N 3.49Å
59	G	93.4	Very high	96.2	Very high	37 Å²	37	29.1 Å²	29.1	38%	0.381	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-7.9	177.7	0	0	0	0	0	116.2	Y42 D57	Y42-G59 VanDerWaalsContact CZ-N 3.32Å; Y42-G59 PolarHBondContact OH-N 2.74Å; D57-G59 PolarHBondContact O-N 3.41Å
60	W	94.7	Very high	96.3	Very high	19 Å²	19	28.9 Å²	28.9	7%	0.072	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139	-29.6	-179.9	61.5	-87.9	0	0	0	115.1	I49 M54 S56 D57 C58 C62 L64 I119 V123 G135 R137	I49-W60 HydrophobicContact CD1-CH2 3.69Å; I49-W60 HydrophobicContact CD1-CZ2 3.69Å; M54-W60 HydrophobicContact CE-CD2 4.42Å; M54-W60 HydrophobicContact CE-CZ2 3.84Å; S56-W60 PolarHBondContact O-NE1 2.84Å; D57-W60 VanDerWaalsContact CA-CE2 3.46Å; D57-W60 HydrophobicContact CB-CD2 4.47Å; D57-W60 HydrophobicContact CB-CH2 3.98Å; D57-W60 HydrophobicContact CB-CZ2 3.64Å; D57-W60 PolarHBondContact O-N 3.3Å; C58-W60 VanDerWaalsContact C-N 3.34Å; C58-W60 VanDerWaalsContact O-CD1 3.29Å; C58-W60 PolarHBondContact O-N 3.49Å; W60-C62 PolarHBondContact O-N 3.21Å; W60-L64 HydrophobicContact CZ3-CD1 4.13Å; W60-I119 HydrophobicContact CH2-CD1 4.36Å; W60-I119 HydrophobicContact CH2-CG1 4.14Å; W60-I119 HydrophobicContact CZ3-CD1 4.34Å; W60-V123 HydrophobicContact CH2-CG2 3.72Å; W60-V123 HydrophobicContact CZ3-CG2 3.7Å; W60-G135 VanDerWaalsContact CB-O 3.3Å; W60-G135 WeakPolarHBondContact CB-O 3.34Å; W60-R137 HydrophobicContact CB-CG 4.33Å
61	G	96.2	Very high	96.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.168	C	C	.	.			trans	-75.5	-7.2	-175.6	0	0	0	0	0	117.1	D57 T63 L64 R65	D57-G61 PolarHBondContact O-N 3.06Å; G61-T63 PolarHBondContact O-N 2.98Å; G61-T63 VanDerWaalsContact O-N 3.17Å; G61-L64 WeakPolarHBondContact O-CA 3.22Å; G61-L64 WeakPolarHBondContact O-CB 3.42Å; G61-L64 PolarHBondContact O-N 3.34Å; G61-R65 PolarHBondContact O-N 2.92Å
62	C	96.5	Very high	96.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-50.7	-48.5	-168	51.9	0	0	0	0	114	Y42 W60 L64 R65 S66 S291 A293 P309	Y42-C62 HydrophobicContact CE1-CB 4.1Å; Y42-C62 VanDerWaalsContact CE1-N 3.35Å; Y42-C62 WeakPolarHBondContact OH-CB 3.21Å; W60-C62 PolarHBondContact O-N 3.21Å; C62-L64 VanDerWaalsContact C-N 3.29Å; C62-L64 PolarHBondContact O-N 3.13Å; C62-R65 PolarHBondContact O-N 3.19Å; C62-S66 PolarHBondContact O-N 2.69Å; C62-S66 PolarHBondContact O-OG 3.39Å; C62-S291 VanDerWaalsContact SG-CA 3.54Å; C62-A293 HydrophobicContact CB-CB 4.23Å; C62-P309 HydrophobicContact CB-CG 3.91Å
63	T	96.4	Very high	97	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.1	-29	179.9	-32	0	0	0	0	112.8	G61 G67 H138 P140 T143 I286 A293	G61-T63 PolarHBondContact O-N 2.98Å; G61-T63 VanDerWaalsContact O-N 3.17Å; T63-G67 PolarHBondContact O-N 3.41Å; T63-H138 VanDerWaalsContact CB-O 3.23Å; T63-H138 WeakPolarHBondContact CB-O 3.34Å; T63-H138 WeakPolarHBondContact CG2-O 3.46Å; T63-H138 PolarHBondContact OG1-O 3.22Å; T63-P140 HydrophobicContact CG2-CG 4.4Å; T63-T143 PolarHBondContact O-OG1 3Å; T63-I286 HydrophobicContact CG2-CG2 4.05Å; T63-A293 HydrophobicContact CG2-CB 4Å; T63-A293 WeakPolarHBondContact OG1-CB 3.21Å
64	L	97.2	Very high	97.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-71.8	-42.7	173.9	-60.1	179.2	0	0	0	110	W60 G61 C62 G67 Q68 I119 L122 V123 H138 T143 L146	W60-L64 HydrophobicContact CZ3-CD1 4.13Å; G61-L64 WeakPolarHBondContact O-CA 3.22Å; G61-L64 WeakPolarHBondContact O-CB 3.42Å; G61-L64 PolarHBondContact O-N 3.34Å; C62-L64 VanDerWaalsContact C-N 3.29Å; C62-L64 PolarHBondContact O-N 3.13Å; L64-G67 CarbonylContact O-C 3.52Å; L64-G67 WeakPolarHBondContact O-CA 3.18Å; L64-G67 PolarHBondContact O-N 2.87Å; L64-G67 VanDerWaalsContact O-N 3.12Å; L64-Q68 WeakPolarHBondContact O-CG 3.4Å; L64-Q68 PolarHBondContact O-N 3.16Å; L64-I119 HydrophobicContact CB-CD1 3.91Å; L64-I119 HydrophobicContact CD1-CD1 3.67Å; L64-I119 HydrophobicContact CG-CD1 4.45Å; L64-L122 HydrophobicContact CB-CD1 4.12Å; L64-L122 HydrophobicContact CD1-CB 4.45Å; L64-V123 HydrophobicContact CD1-CG2 4.47Å; L64-H138 HydrophobicContact CD2-CB 3.99Å; L64-H138 HydrophobicContact CG-CB 4.45Å; L64-T143 HydrophobicContact CD2-CG2 4.41Å; L64-L146 HydrophobicContact CD2-CD1 3.53Å
65	R	98	Very high	97.1	Very high	1 Å²	1	11 Å²	11	0%	0.004	8%	0.075	C	C	.	.	H	α-helix	trans	-61	-43.2	173.3	-62.8	-51.7	-174.7	170.8	3.2	112.7	S41 D57 G61 C62 G67 Q68 M69 D111 P309	S41-R65 PolarHBondContact O-NE 3.11Å; D57-R65 VanDerWaalsContact CG-NH2 3.3Å; D57-R65 IonicContact OD1-CZ 2.78Å; D57-R65 IonicContact OD1-NE 2.74Å; D57-R65 IonicContact OD1-NH2 2.75Å; D57-R65 PolarHBondContact OD1-NH2 3.45Å; D57-R65 WeakPolarHBondContact OD2-CG 3.26Å; D57-R65 IonicContact OD2-CZ 3.83Å; D57-R65 IonicContact OD2-NE 3.25Å; D57-R65 PolarHBondContact OD2-NE 3.09Å; D57-R65 IonicContact OD2-NH2 3.86Å; G61-R65 PolarHBondContact O-N 2.92Å; C62-R65 PolarHBondContact O-N 3.19Å; R65-G67 VanDerWaalsContact C-N 3.29Å; R65-G67 PolarHBondContact O-N 3.14Å; R65-Q68 WeakPolarHBondContact O-CB 3.42Å; R65-Q68 PolarHBondContact O-N 3.06Å; R65-M69 WeakPolarHBondContact O-CG 3.16Å; R65-M69 PolarHBondContact O-N 3.2Å; R65-D111 IonicContact CZ-OD1 3.33Å; R65-D111 VanDerWaalsContact CZ-OD1 3.25Å; R65-D111 IonicContact NH1-OD1 2.95Å; R65-D111 PolarHBondContact NH1-OD1 3.07Å; R65-D111 IonicContact NH2-OD1 3.22Å; R65-D111 PolarHBondContact NH2-OD1 3.09Å; R65-P309 HydrophobicContact CB-CB 3.72Å; R65-P309 HydrophobicContact CG-CB 4.43Å
66	S	97.7	Very high	96.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.8	-38.2	171.5	-59.7	0	0	0	0	112.6	C62 M69 L70 M294	C62-S66 PolarHBondContact O-N 2.69Å; C62-S66 PolarHBondContact O-OG 3.39Å; S66-M69 PolarHBondContact O-N 2.84Å; S66-L70 PolarHBondContact O-N 2.64Å; S66-L70 VanDerWaalsContact O-N 3.11Å; S66-M294 VanDerWaalsContact OG-C 3.27Å; S66-M294 PolarHBondContact OG-O 3Å
67	G	98.2	Very high	96.5	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63.1	-44.6	172.3	0	0	0	0	0	113.3	T63 L64 R65 M69 L70 L71	T63-G67 PolarHBondContact O-N 3.41Å; L64-G67 CarbonylContact O-C 3.52Å; L64-G67 WeakPolarHBondContact O-CA 3.18Å; L64-G67 PolarHBondContact O-N 2.87Å; L64-G67 VanDerWaalsContact O-N 3.12Å; R65-G67 VanDerWaalsContact C-N 3.29Å; R65-G67 PolarHBondContact O-N 3.14Å; G67-M69 VanDerWaalsContact C-N 3.32Å; G67-M69 PolarHBondContact O-N 3.22Å; G67-L70 PolarHBondContact O-N 2.64Å; G67-L71 PolarHBondContact O-N 2.9Å
68	Q	98.6	Very high	96.3	Very high	1 Å²	1	9.2 Å²	9.2	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-59.7	-41.7	174.2	-68.1	-179.1	-42.1	0	0	111.4	L40 L64 R65 L71 A72 F109 F117 L122	L40-Q68 HydrophobicContact CD1-CB 3.45Å; L40-Q68 VanDerWaalsContact CD1-CB 3.45Å; L40-Q68 HydrophobicContact CD1-CG 4.44Å; L64-Q68 WeakPolarHBondContact O-CG 3.4Å; L64-Q68 PolarHBondContact O-N 3.16Å; R65-Q68 WeakPolarHBondContact O-CB 3.42Å; R65-Q68 PolarHBondContact O-N 3.06Å; Q68-L71 PolarHBondContact O-N 3.05Å; Q68-A72 VanDerWaalsContact O-CB 3.24Å; Q68-A72 WeakPolarHBondContact O-CB 3.38Å; Q68-A72 PolarHBondContact O-N 3.02Å; Q68-F109 HydrophobicContact CB-CD1 3.74Å; Q68-F109 HydrophobicContact CB-CE1 3.98Å; Q68-F109 HydrophobicContact CG-CD1 3.99Å; Q68-F109 HydrophobicContact CG-CE1 4.41Å; Q68-F109 WeakPolarHBondContact O-CE1 3.48Å; Q68-F117 PolarHBondContact NE2-O 2.86Å; Q68-L122 HydrophobicContact CG-CD1 3.73Å
69	M	98.4	Very high	96.1	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-64.4	-42.3	177.7	-68.5	-172.4	-81.5	0	0	112.8	I38 L40 R65 S66 G67 A72 E73 Y295 M307 P309	I38-M69 WeakPolarHBondContact O-CG 3.1Å; L40-M69 HydrophobicContact CB-CG 3.83Å; L40-M69 HydrophobicContact CG-CG 4.27Å; L40-M69 PolarHBondContact N-SD 2.94Å; L40-M69 WeakPolarHBondContact O-CE 3.36Å; R65-M69 WeakPolarHBondContact O-CG 3.16Å; R65-M69 PolarHBondContact O-N 3.2Å; S66-M69 PolarHBondContact O-N 2.84Å; G67-M69 VanDerWaalsContact C-N 3.32Å; G67-M69 PolarHBondContact O-N 3.22Å; M69-A72 PolarHBondContact O-N 3.01Å; M69-E73 PolarHBondContact O-N 2.66Å; M69-Y295 HydrophobicContact CB-CD1 3.46Å; M69-Y295 VanDerWaalsContact CB-CD1 3.46Å; M69-Y295 HydrophobicContact CB-CE1 3.83Å; M69-Y295 HydrophobicContact CB-CG 3.98Å; M69-Y295 HydrophobicContact CE-CD1 4.49Å; M69-Y295 HydrophobicContact CG-CD1 4.36Å; M69-Y295 HydrophobicContact SD-CD1 4.11Å; M69-M307 HydrophobicContact CE-CB 4.29Å; M69-M307 HydrophobicContact SD-CB 3.87Å; M69-M307 HydrophobicContact SD-SD 4.23Å; M69-P309 HydrophobicContact CE-CB 4.23Å
70	L	98.4	Very high	95.5	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-65	-41.2	175.8	-174.1	152	0	0	0	111.9	S66 G67 T74 L253 L255 V283 I286 Y295	S66-L70 PolarHBondContact O-N 2.64Å; S66-L70 VanDerWaalsContact O-N 3.11Å; G67-L70 PolarHBondContact O-N 2.64Å; L70-T74 PolarHBondContact O-N 3.28Å; L70-T74 VanDerWaalsContact O-N 3.09Å; L70-T74 PolarHBondContact O-OG1 2.82Å; L70-L253 HydrophobicContact CD2-CD1 4.09Å; L70-L253 HydrophobicContact CD2-CD2 4.22Å; L70-L255 HydrophobicContact CD2-CD2 3.62Å; L70-V283 HydrophobicContact CD2-CG2 4Å; L70-V283 HydrophobicContact CG-CG2 4.08Å; L70-I286 HydrophobicContact CB-CD1 4.09Å; L70-I286 HydrophobicContact CB-CG1 4.1Å; L70-I286 HydrophobicContact CD1-CD1 3.82Å; L70-I286 HydrophobicContact CD1-CG1 3.77Å; L70-I286 HydrophobicContact CG-CD1 4.45Å; L70-Y295 HydrophobicContact CB-CD2 4.24Å; L70-Y295 HydrophobicContact CB-CE2 3.79Å; L70-Y295 HydrophobicContact CD1-CE2 4.3Å; L70-Y295 HydrophobicContact CG-CE2 4.2Å
71	L	98.6	Very high	94.3	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-67.4	-38.1	174.1	-177.3	59.9	0	0	0	111.5	G67 Q68 T74 L75 F109 F117 L147 V151 L253	G67-L71 PolarHBondContact O-N 2.9Å; Q68-L71 PolarHBondContact O-N 3.05Å; L71-T74 VanDerWaalsContact O-CB 3.32Å; L71-T74 WeakPolarHBondContact O-CB 3.48Å; L71-T74 PolarHBondContact O-N 3.01Å; L71-T74 VanDerWaalsContact O-N 3.16Å; L71-L75 HydrophobicContact CD1-CG 4.32Å; L71-L75 HydrophobicContact CG-CD1 4.23Å; L71-L75 HydrophobicContact CG-CG 4.39Å; L71-L75 WeakPolarHBondContact O-CG 2.92Å; L71-L75 PolarHBondContact O-N 2.83Å; L71-F109 HydrophobicContact CB-CE1 4.32Å; L71-F109 HydrophobicContact CB-CZ 4.3Å; L71-F109 HydrophobicContact CD2-CE1 4.32Å; L71-F109 HydrophobicContact CD2-CZ 4.43Å; L71-F109 HydrophobicContact CG-CE1 4.39Å; L71-F109 HydrophobicContact CG-CZ 4.14Å; L71-F117 HydrophobicContact CD2-CB 4.37Å; L71-F117 HydrophobicContact CD2-CD1 3.49Å; L71-F117 VanDerWaalsContact CD2-CD1 3.49Å; L71-F117 HydrophobicContact CD2-CD2 4.15Å; L71-F117 HydrophobicContact CD2-CE1 3.75Å; L71-F117 HydrophobicContact CD2-CE2 4.36Å; L71-F117 HydrophobicContact CD2-CG 3.72Å; L71-F117 HydrophobicContact CD2-CZ 4.18Å; L71-L147 HydrophobicContact CB-CD2 4.17Å; L71-L147 HydrophobicContact CD2-CD2 4.04Å; L71-V151 HydrophobicContact CD1-CG2 3.86Å; L71-V151 HydrophobicContact CD2-CG2 4.12Å; L71-L253 HydrophobicContact CD1-CD2 4.05Å
72	A	97.7	Very high	92.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.6	-48.4	176.4	0	0	0	0	0	111.3	I38 Q68 M69 T74 L75 M76 F109	I38-A72 HydrophobicContact CB-CB 3.92Å; I38-A72 HydrophobicContact CD1-CB 3.95Å; I38-A72 HydrophobicContact CG2-CB 3.91Å; Q68-A72 VanDerWaalsContact O-CB 3.24Å; Q68-A72 WeakPolarHBondContact O-CB 3.38Å; Q68-A72 PolarHBondContact O-N 3.02Å; M69-A72 PolarHBondContact O-N 3.01Å; A72-T74 VanDerWaalsContact C-N 3.25Å; A72-T74 PolarHBondContact O-N 3.02Å; A72-L75 PolarHBondContact O-N 3.03Å; A72-L75 VanDerWaalsContact O-N 3.16Å; A72-M76 VanDerWaalsContact O-CG 3.24Å; A72-M76 WeakPolarHBondContact O-CG 3.33Å; A72-M76 PolarHBondContact O-N 3.36Å; A72-F109 HydrophobicContact CB-CD2 4.25Å; A72-F109 HydrophobicContact CB-CE1 4.33Å; A72-F109 HydrophobicContact CB-CE2 3.62Å; A72-F109 HydrophobicContact CB-CZ 3.66Å
73	E	96.2	Very high	90.3	Very high	13 Å²	13	19.4 Å²	19.4	6%	0.061	10%	0.096	C	C	.	.	H	α-helix	trans	-52	-44.5	170.8	173.7	73.4	-172.9	0	0	111.8	R37 M69 M76 R77 V283 Y295	R37-E73 IonicContact CZ-OE1 3.85Å; R37-E73 IonicContact CZ-OE2 3.17Å; R37-E73 IonicContact NH1-OE1 3.84Å; R37-E73 PolarHBondContact NH1-OE1 3.32Å; R37-E73 IonicContact NH1-OE2 3.83Å; R37-E73 PolarHBondContact NH1-OE2 2.87Å; M69-E73 PolarHBondContact O-N 2.66Å; E73-M76 PolarHBondContact O-N 2.79Å; E73-R77 PolarHBondContact O-N 2.81Å; E73-R77 VanDerWaalsContact O-N 3.1Å; E73-R77 IonicContact OE1-CZ 3.16Å; E73-R77 VanDerWaalsContact OE1-CZ 3.25Å; E73-R77 IonicContact OE1-NE 2.79Å; E73-R77 PolarHBondContact OE1-NE 3.43Å; E73-R77 IonicContact OE1-NH2 3.97Å; E73-R77 PolarHBondContact OE1-NH2 3.45Å; E73-V283 HydrophobicContact CG-CB 3.78Å; E73-V283 HydrophobicContact CG-CG1 4.03Å; E73-Y295 VanDerWaalsContact CB-OH 3.31Å; E73-Y295 WeakPolarHBondContact CB-OH 3.46Å; E73-Y295 WeakPolarHBondContact CG-OH 3.49Å
74	T	97.1	Very high	88.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-47.9	178	-52.8	0	0	0	0	111.4	L70 L71 A72 M76 R77 H78 L163 L253 Y348	L70-T74 PolarHBondContact O-N 3.28Å; L70-T74 VanDerWaalsContact O-N 3.09Å; L70-T74 PolarHBondContact O-OG1 2.82Å; L71-T74 VanDerWaalsContact O-CB 3.32Å; L71-T74 WeakPolarHBondContact O-CB 3.48Å; L71-T74 PolarHBondContact O-N 3.01Å; L71-T74 VanDerWaalsContact O-N 3.16Å; A72-T74 VanDerWaalsContact C-N 3.25Å; A72-T74 PolarHBondContact O-N 3.02Å; T74-M76 VanDerWaalsContact C-N 3.32Å; T74-M76 PolarHBondContact O-N 3.11Å; T74-R77 PolarHBondContact O-N 3.34Å; T74-H78 WeakPolarHBondContact O-CB 3.39Å; T74-H78 PolarHBondContact O-N 3.42Å; T74-L163 HydrophobicContact CG2-CD1 4.37Å; T74-L163 HydrophobicContact CG2-CD2 4.44Å; T74-L253 HydrophobicContact CG2-CB 4.02Å; T74-L253 HydrophobicContact CG2-CD1 3.99Å; T74-L253 HydrophobicContact CG2-CD2 4.05Å; T74-L253 HydrophobicContact CG2-CG 4.22Å; T74-L253 WeakPolarHBondContact OG1-CD1 3.06Å; T74-Y348 HydrophobicContact CG2-CD2 3.54Å; T74-Y348 HydrophobicContact CG2-CE2 4.11Å; T74-Y348 HydrophobicContact CG2-CG 4.27Å
75	L	95.8	Very high	86.4	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-34.3	179.8	-66	174.6	0	0	0	112.2	L71 A72 H78 Y79 I105 F109 F117 L159 L163	L71-L75 HydrophobicContact CD1-CG 4.32Å; L71-L75 HydrophobicContact CG-CD1 4.23Å; L71-L75 HydrophobicContact CG-CG 4.39Å; L71-L75 WeakPolarHBondContact O-CG 2.92Å; L71-L75 PolarHBondContact O-N 2.83Å; A72-L75 PolarHBondContact O-N 3.03Å; A72-L75 VanDerWaalsContact O-N 3.16Å; L75-H78 PolarHBondContact O-N 3.49Å; L75-Y79 HydrophobicContact CB-CD2 4.37Å; L75-Y79 HydrophobicContact CD2-CE2 4.06Å; L75-Y79 WeakPolarHBondContact O-CD2 3.29Å; L75-Y79 PolarHBondContact O-N 3.16Å; L75-I105 HydrophobicContact CB-CG2 3.89Å; L75-I105 HydrophobicContact CD1-CG2 4.38Å; L75-F109 HydrophobicContact CD1-CE2 3.91Å; L75-F109 HydrophobicContact CD1-CZ 3.78Å; L75-F117 HydrophobicContact CD1-CD2 3.9Å; L75-F117 HydrophobicContact CD1-CE2 3.44Å; L75-F117 VanDerWaalsContact CD1-CE2 3.44Å; L75-F117 HydrophobicContact CD1-CZ 4.28Å; L75-L159 HydrophobicContact CD2-CD1 3.8Å; L75-L159 HydrophobicContact CD2-CD2 4.02Å; L75-L163 HydrophobicContact CD2-CD2 3.87Å
76	M	92.6	Very high	84.6	Confident	20 Å²	20	34.6 Å²	34.6	10%	0.099	15%	0.153	C	C	.	.	H	α-helix	trans	-60.2	-49.7	171.7	-65.9	-64.6	-75.8	0	0	110.5	I38 A72 E73 T74 H78 Y79 L80 W85 Y102 I105	I38-M76 HydrophobicContact CD1-CG 3.7Å; I38-M76 HydrophobicContact CD1-SD 3.66Å; A72-M76 VanDerWaalsContact O-CG 3.24Å; A72-M76 WeakPolarHBondContact O-CG 3.33Å; A72-M76 PolarHBondContact O-N 3.36Å; E73-M76 PolarHBondContact O-N 2.79Å; T74-M76 VanDerWaalsContact C-N 3.32Å; T74-M76 PolarHBondContact O-N 3.11Å; M76-H78 VanDerWaalsContact C-N 3.29Å; M76-H78 PolarHBondContact O-N 2.9Å; M76-Y79 PolarHBondContact O-N 2.83Å; M76-L80 HydrophobicContact CE-CD1 3.34Å; M76-L80 WeakPolarHBondContact O-CB 3.36Å; M76-L80 PolarHBondContact O-N 3.16Å; M76-L80 HydrophobicContact SD-CD1 3.68Å; M76-W85 HydrophobicContact CE-CD2 3.67Å; M76-W85 HydrophobicContact CE-CE3 3.1Å; M76-W85 HydrophobicContact CE-CG 4.45Å; M76-W85 HydrophobicContact CE-CH2 3.94Å; M76-W85 HydrophobicContact CE-CZ2 4.46Å; M76-W85 HydrophobicContact CE-CZ3 3.24Å; M76-Y102 HydrophobicContact CE-CD2 3.81Å; M76-Y102 HydrophobicContact SD-CD2 4.07Å; M76-I105 HydrophobicContact SD-CB 4.4Å; M76-I105 HydrophobicContact SD-CD1 3.65Å; M76-I105 HydrophobicContact SD-CG2 4.16Å
77	R	92	Very high	82.4	Confident	5 Å²	5	36.7 Å²	36.7	2%	0.019	17%	0.167	C	C	.	.	H	α-helix	trans	-67.2	-27.2	176.2	-64.2	-173	-167	-175.6	10	114.2	E73 T74 K280 C282 Y348 R350	E73-R77 PolarHBondContact O-N 2.81Å; E73-R77 VanDerWaalsContact O-N 3.1Å; E73-R77 IonicContact OE1-CZ 3.16Å; E73-R77 VanDerWaalsContact OE1-CZ 3.25Å; E73-R77 IonicContact OE1-NE 2.79Å; E73-R77 PolarHBondContact OE1-NE 3.43Å; E73-R77 IonicContact OE1-NH2 3.97Å; E73-R77 PolarHBondContact OE1-NH2 3.45Å; T74-R77 PolarHBondContact O-N 3.34Å; R77-K280 PolarHBondContact NH1-O 3.32Å; R77-C282 VanDerWaalsContact CZ-O 3.26Å; R77-C282 PolarHBondContact NH1-O 3.09Å; R77-C282 PolarHBondContact NH2-O 3.47Å; R77-Y348 HydrophobicContact CB-CD1 4.1Å; R77-Y348 HydrophobicContact CB-CE1 4.15Å; R77-R350 PolarHBondContact O-NH2 2.95Å
78	H	93.3	Very high	80.3	Confident	26 Å²	26	42.6 Å²	42.6	12%	0.12	20%	0.198	C	C	.	.	H	α-helix	trans	-73.2	-41.4	178.4	-171.3	62.1	0	0	0	112.5	T74 L75 M76 T162 S251 Y348	T74-H78 WeakPolarHBondContact O-CB 3.39Å; T74-H78 PolarHBondContact O-N 3.42Å; L75-H78 PolarHBondContact O-N 3.49Å; M76-H78 VanDerWaalsContact C-N 3.29Å; M76-H78 PolarHBondContact O-N 2.9Å; H78-T162 PolarHBondContact CE1-O 2.85Å; H78-T162 WeakPolarHBondContact NE2-CB 3.4Å; H78-T162 PolarHBondContact NE2-OG1 2.96Å; H78-S251 PolarHBondContact ND1-OG 2.79Å; H78-Y348 WeakPolarHBondContact CA-OH 3.39Å; H78-Y348 HydrophobicContact CB-CE2 4.21Å; H78-Y348 AromaticContact ND1-CZ 3.89Å; H78-Y348 PolarHBondContact ND1-OH 2.96Å
79	Y	90.3	Very high	77.8	Confident	66 Å²	66	46.6 Å²	46.6	26%	0.259	22%	0.222	S	C	.	.	H	α-helix	trans	-103.2	-28.3	-174	-69.3	-59.8	0	0	0	115.3	L75 M76 I105 L159	L75-Y79 HydrophobicContact CB-CD2 4.37Å; L75-Y79 HydrophobicContact CD2-CE2 4.06Å; L75-Y79 WeakPolarHBondContact O-CD2 3.29Å; L75-Y79 PolarHBondContact O-N 3.16Å; M76-Y79 PolarHBondContact O-N 2.83Å; Y79-I105 HydrophobicContact CD2-CD1 3.97Å; Y79-I105 HydrophobicContact CD2-CG1 3.98Å; Y79-I105 HydrophobicContact CG-CD1 4.49Å; Y79-L159 HydrophobicContact CE2-CD1 4.39Å; Y79-L159 WeakPolarHBondContact OH-CD1 3.37Å
80	L	82.6	Confident	74.9	Confident	17 Å²	17	54.4 Å²	54.4	9%	0.089	26%	0.264	C	S	.	.	S	Bend	trans	-106.2	0.2	-175.3	-64.7	166.6	0	0	0	113.7	M76 W85 E98 L101 I105	M76-L80 HydrophobicContact CE-CD1 3.34Å; M76-L80 WeakPolarHBondContact O-CB 3.36Å; M76-L80 PolarHBondContact O-N 3.16Å; M76-L80 HydrophobicContact SD-CD1 3.68Å; L80-W85 HydrophobicContact CB-CB 4.38Å; L80-W85 HydrophobicContact CD1-CB 4.21Å; L80-W85 HydrophobicContact CD1-CD2 4.15Å; L80-W85 HydrophobicContact CD1-CG 3.9Å; L80-E98 HydrophobicContact CD2-CB 3.79Å; L80-E98 HydrophobicContact CD2-CG 4.05Å; L80-L101 HydrophobicContact CD2-CB 3.74Å; L80-L101 HydrophobicContact CD2-CD1 3.8Å; L80-L101 HydrophobicContact CD2-CG 4.44Å; L80-L101 HydrophobicContact CG-CB 4.47Å; L80-I105 HydrophobicContact CD1-CD1 4.33Å
81	N	68.3	Low	72.4	Confident	101 Å²	101	58.7 Å²	58.7	54%	0.54	29%	0.293	S	S	.	.			trans	56.5	176.1	-173.4	-68.3	-44.8	0	0	0	114
82	E	57.1	Low	70.1	Confident	32 Å²	32	67.4 Å²	67.4	15%	0.15	33%	0.334	C	S	.	.	S	Bend	trans	-87	-15.4	-146.8	-133.8	149.7	-102	0	0	116.4	M1 K280 R350	M1-E82 WeakPolarHBondContact CE-O 3.36Å; E82-K280 WeakPolarHBondContact OE2-CE 3.32Å; E82-R350 IonicContact OE1-CZ 2.58Å; E82-R350 IonicContact OE1-NH1 3.79Å; E82-R350 PolarHBondContact OE1-NH1 3.2Å; E82-R350 IonicContact OE1-NH2 2.75Å; E82-R350 PolarHBondContact OE1-NH2 3.04Å; E82-R350 IonicContact OE2-NH1 2.75Å
83	D	52.3	Low	68	Low	123 Å²	123	71.7 Å²	71.7	66%	0.658	36%	0.364	S	S	*	.	S	Bend	trans	-113.2	-24.4	-157	-71.2	-33.3	0	0	0	117.5
84	R	54.5	Low	66	Low	199 Å²	199	74.1 Å²	74.1	75%	0.751	39%	0.386	S	S	*	.			trans	-136.3	-16.4	-155.2	-94.9	173.7	-93.7	-153.9	-4.9	120	R86	R84-R86 PolarHBondContact O-N 2.89Å
85	W	56.4	Low	64.4	Low	33 Å²	33	76.6 Å²	76.6	13%	0.125	40%	0.398	C	S	.	.			trans	-68.3	123	-176.1	-170.7	73.1	0	0	0	113.3	S36 M76 L80 P87 Y102	S36-W85 WeakPolarHBondContact O-CZ3 3.48Å; M76-W85 HydrophobicContact CE-CD2 3.67Å; M76-W85 HydrophobicContact CE-CE3 3.1Å; M76-W85 HydrophobicContact CE-CG 4.45Å; M76-W85 HydrophobicContact CE-CH2 3.94Å; M76-W85 HydrophobicContact CE-CZ2 4.46Å; M76-W85 HydrophobicContact CE-CZ3 3.24Å; L80-W85 HydrophobicContact CB-CB 4.38Å; L80-W85 HydrophobicContact CD1-CB 4.21Å; L80-W85 HydrophobicContact CD1-CD2 4.15Å; L80-W85 HydrophobicContact CD1-CG 3.9Å; W85-P87 HydrophobicContact CH2-CB 3.4Å; W85-P87 HydrophobicContact CH2-CG 3.56Å; W85-P87 HydrophobicContact CZ2-CB 3.63Å; W85-P87 HydrophobicContact CZ2-CG 4.22Å; W85-P87 HydrophobicContact CZ3-CB 4.11Å; W85-P87 HydrophobicContact CZ3-CG 3.76Å; W85-Y102 AromaticContact CH2-CD1 3.85Å; W85-Y102 HydrophobicContact CH2-CD1 3.85Å; W85-Y102 AromaticContact CH2-CD2 3.11Å; W85-Y102 HydrophobicContact CH2-CD2 3.11Å; W85-Y102 HydrophobicContact CH2-CE1 4.14Å; W85-Y102 AromaticContact CH2-CE2 3.43Å; W85-Y102 HydrophobicContact CH2-CE2 3.43Å; W85-Y102 VanDerWaalsContact CH2-CE2 3.43Å; W85-Y102 AromaticContact CH2-CG 3.34Å; W85-Y102 HydrophobicContact CH2-CG 3.34Å; W85-Y102 AromaticContact CH2-CZ 3.96Å; W85-Y102 VanDerWaalsContact CZ2-CB 3.48Å; W85-Y102 AromaticContact CZ2-CD1 3.56Å; W85-Y102 HydrophobicContact CZ2-CD1 3.56Å; W85-Y102 AromaticContact CZ2-CD2 3.54Å; W85-Y102 HydrophobicContact CZ2-CD2 3.54Å; W85-Y102 HydrophobicContact CZ2-CE1 4.22Å; W85-Y102 HydrophobicContact CZ2-CE2 4.17Å; W85-Y102 AromaticContact CZ2-CG 3.19Å; W85-Y102 HydrophobicContact CZ2-CG 3.19Å; W85-Y102 AromaticContact CZ3-CD2 3.82Å; W85-Y102 HydrophobicContact CZ3-CD2 3.82Å; W85-Y102 HydrophobicContact CZ3-CE2 4.17Å; W85-Y102 HydrophobicContact CZ3-CG 4.33Å
86	R	60.1	Low	63.2	Low	88 Å²	88	82.9 Å²	82.9	33%	0.332	43%	0.427	S	S	.	.			trans	-137.6	123.8	174.8	-62.8	-178.2	-177.1	-142.3	8.1	109.1	V32 R84 L88	V32-R86 HydrophobicContact CG1-CG 4.36Å; V32-R86 VanDerWaalsContact CG1-NH1 3.34Å; R84-R86 PolarHBondContact O-N 2.89Å; R86-L88 PolarHBondContact O-N 3.17Å
87	P	53.2	Low	62.6	Low	44 Å²	44	87.2 Å²	87.2	29%	0.286	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	23.5	-174.6	23.2	-27	0	0	0	115.5	S36 W85	S36-P87 VanDerWaalsContact CB-CD 3.41Å; W85-P87 HydrophobicContact CH2-CB 3.4Å; W85-P87 HydrophobicContact CH2-CG 3.56Å; W85-P87 HydrophobicContact CZ2-CB 3.63Å; W85-P87 HydrophobicContact CZ2-CG 4.22Å; W85-P87 HydrophobicContact CZ3-CB 4.11Å; W85-P87 HydrophobicContact CZ3-CG 3.76Å
88	L	52.7	Low	62.1	Low	123 Å²	123	89.9 Å²	89.9	64%	0.644	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	9.9	-162	-68.9	174.9	0	0	0	115.4	R86	R86-L88 PolarHBondContact O-N 3.17Å
89	T	46.8	Very low	61.6	Low	85 Å²	85	92.4 Å²	92.4	52%	0.521	47%	0.471	S	S	.	.			trans	-103.7	151.8	167.1	48.2	0	0	0	0	110.3	E95	T89-E95 WeakPolarHBondContact CB-OE1 3.36Å; T89-E95 VanDerWaalsContact O-OE2 3.06Å; T89-E95 PolarHBondContact OG1-OE1 3.39Å
90	N	37.3	Very low	61.5	Low	166 Å²	166	94.8 Å²	94.8	89%	0.888	48%	0.483	S	S	*	.			trans	-113.4	105.6	173.8	-76	-21.6	0	0	0	107.4
91	C	45.1	Very low	61.7	Low	90 Å²	90	96.2 Å²	96.2	61%	0.608	49%	0.49	S	S	*	.			trans	-154.6	157.1	175.3	-107.1	0	0	0	0	111.6	E95	C91-E95 WeakPolarHBondContact CA-OE2 3.21Å; C91-E95 HydrophobicContact CB-CG 4.38Å; C91-E95 PolarHBondContact N-OE2 2.58Å
92	E	50.4	Low	62.8	Low	183 Å²	183	91.9 Å²	91.9	86%	0.855	47%	0.467	S	S	*	.	S	Bend	trans	-96.8	135.6	-150.6	-60.8	173.4	160.1	0	0	113.3	A94	E92-A94 PolarHBondContact O-N 3.49Å
93	S	53.2	Low	64.5	Low	89 Å²	89	94.7 Å²	94.7	62%	0.622	48%	0.476	S	S	*	.	S	Bend	trans	73.9	-64.1	-179.3	76.7	0	0	0	0	118.4	E95 Q96	S93-E95 PolarHBondContact O-N 2.88Å; S93-Q96 WeakPolarHBondContact O-CB 3.46Å; S93-Q96 PolarHBondContact O-N 3.32Å; S93-Q96 VanDerWaalsContact O-N 3.1Å
94	A	55.3	Low	66.4	Low	64 Å²	64	92 Å²	92	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-44	-172.3	0	0	0	0	0	112.3	E92 Q96 H97 E98	E92-A94 PolarHBondContact O-N 3.49Å; A94-Q96 PolarHBondContact O-N 2.95Å; A94-H97 PolarHBondContact O-N 2.87Å; A94-H97 VanDerWaalsContact O-N 3.1Å; A94-E98 PolarHBondContact O-N 2.75Å
95	E	62.3	Low	68.3	Low	53 Å²	53	83 Å²	83	25%	0.248	43%	0.433	C	S	.	.	H	α-helix	trans	-59.9	-26.8	176.4	-61.1	-172.3	162.7	0	0	112.5	T89 C91 S93 E98 E99	T89-E95 WeakPolarHBondContact CB-OE1 3.36Å; T89-E95 VanDerWaalsContact O-OE2 3.06Å; T89-E95 PolarHBondContact OG1-OE1 3.39Å; C91-E95 WeakPolarHBondContact CA-OE2 3.21Å; C91-E95 HydrophobicContact CB-CG 4.38Å; C91-E95 PolarHBondContact N-OE2 2.58Å; S93-E95 PolarHBondContact O-N 2.88Å; E95-E98 PolarHBondContact O-N 3.5Å; E95-E99 WeakPolarHBondContact O-CB 3.29Å; E95-E99 PolarHBondContact O-N 3.21Å
96	Q	72.4	Confident	70.2	Confident	134 Å²	134	81.4 Å²	81.4	63%	0.626	43%	0.427	S	S	*	.	H	α-helix	trans	-69.6	-34.5	177.6	-59	-178.8	-6.8	0	0	112.3	S93 A94 K100	S93-Q96 WeakPolarHBondContact O-CB 3.46Å; S93-Q96 PolarHBondContact O-N 3.32Å; S93-Q96 VanDerWaalsContact O-N 3.1Å; A94-Q96 PolarHBondContact O-N 2.95Å; Q96-K100 VanDerWaalsContact O-CB 3.28Å; Q96-K100 WeakPolarHBondContact O-CB 3.06Å; Q96-K100 PolarHBondContact O-N 2.96Å
97	H	79.2	Confident	71.9	Confident	110 Å²	110	77.8 Å²	77.8	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-70.8	-46	175.3	-175.1	77.3	0	0	0	110.6	A94 K100 L101	A94-H97 PolarHBondContact O-N 2.87Å; A94-H97 VanDerWaalsContact O-N 3.1Å; H97-K100 WeakPolarHBondContact O-CB 3.48Å; H97-K100 PolarHBondContact O-N 3.21Å; H97-L101 WeakPolarHBondContact NE2-CD1 3.3Å; H97-L101 PolarHBondContact O-N 2.81Å
98	E	80.5	Confident	74	Confident	62 Å²	62	77.2 Å²	77.2	29%	0.29	41%	0.41	S	S	.	.	H	α-helix	trans	-64	-41.1	177.4	-62.3	-174.6	174	0	0	112	L80 A94 E95 K100 L101 Y102	L80-E98 HydrophobicContact CD2-CB 3.79Å; L80-E98 HydrophobicContact CD2-CG 4.05Å; A94-E98 PolarHBondContact O-N 2.75Å; E95-E98 PolarHBondContact O-N 3.5Å; E98-K100 PolarHBondContact O-N 2.95Å; E98-L101 PolarHBondContact O-N 3.07Å; E98-Y102 WeakPolarHBondContact O-CB 3.48Å; E98-Y102 PolarHBondContact O-N 2.66Å
99	E	83.9	Confident	76.1	Confident	79 Å²	79	71.3 Å²	71.3	37%	0.369	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-40.9	174.2	-163	-163.4	-178.1	0	0	111.4	E95 Y102 R103	E95-E99 WeakPolarHBondContact O-CB 3.29Å; E95-E99 PolarHBondContact O-N 3.21Å; E99-Y102 HydrophobicContact CG-CD1 4.45Å; E99-Y102 PolarHBondContact O-N 2.91Å; E99-R103 VanDerWaalsContact CD-NE 3.33Å; E99-R103 HydrophobicContact CG-CG 4.44Å; E99-R103 WeakPolarHBondContact O-CB 3.42Å; E99-R103 VanDerWaalsContact O-CG 3.25Å; E99-R103 WeakPolarHBondContact O-CG 3.45Å; E99-R103 PolarHBondContact O-N 3.39Å; E99-R103 IonicContact OE1-CZ 3.53Å; E99-R103 IonicContact OE1-NE 3.82Å; E99-R103 PolarHBondContact OE1-NE 3.31Å; E99-R103 IonicContact OE1-NH2 2.66Å; E99-R103 PolarHBondContact OE1-NH2 3.49Å; E99-R103 IonicContact OE2-CZ 2.77Å; E99-R103 IonicContact OE2-NE 3.37Å; E99-R103 IonicContact OE2-NH2 3.11Å; E99-R103 PolarHBondContact OE2-NH2 3.23Å; E99-R103 VanDerWaalsContact OE2-NH2 3.11Å
100	K	87.4	Confident	78.6	Confident	115 Å²	115	67.3 Å²	67.3	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-44.8	175.2	-176.2	178.8	178.6	-179.1	0	111.4	Q96 H97 E98 R103 S104	Q96-K100 VanDerWaalsContact O-CB 3.28Å; Q96-K100 WeakPolarHBondContact O-CB 3.06Å; Q96-K100 PolarHBondContact O-N 2.96Å; H97-K100 WeakPolarHBondContact O-CB 3.48Å; H97-K100 PolarHBondContact O-N 3.21Å; E98-K100 PolarHBondContact O-N 2.95Å; K100-R103 PolarHBondContact O-N 3.43Å; K100-S104 PolarHBondContact O-N 3.11Å; K100-S104 PolarHBondContact O-OG 3.23Å; K100-S104 VanDerWaalsContact O-OG 3.06Å
101	L	88.4	Confident	81.5	Confident	47 Å²	47	59.6 Å²	59.6	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-48.8	174.7	-76.7	176.8	0	0	0	111.7	L80 H97 E98 R103 S104 I105	L80-L101 HydrophobicContact CD2-CB 3.74Å; L80-L101 HydrophobicContact CD2-CD1 3.8Å; L80-L101 HydrophobicContact CD2-CG 4.44Å; L80-L101 HydrophobicContact CG-CB 4.47Å; H97-L101 WeakPolarHBondContact NE2-CD1 3.3Å; H97-L101 PolarHBondContact O-N 2.81Å; E98-L101 PolarHBondContact O-N 3.07Å; L101-R103 PolarHBondContact O-N 2.92Å; L101-S104 CarbonylContact O-C 3.59Å; L101-S104 WeakPolarHBondContact O-CA 3.39Å; L101-S104 WeakPolarHBondContact O-CB 3.19Å; L101-S104 PolarHBondContact O-N 3.08Å; L101-S104 VanDerWaalsContact O-N 3.12Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 3.25Å
102	Y	90.9	Very high	83.9	Confident	11 Å²	11	56.2 Å²	56.2	4%	0.043	29%	0.29	C	S	.	.	H	α-helix	trans	-54.8	-48	174.1	155.5	-102.1	0	0	0	112.1	I38 M76 W85 E98 E99 S104 I105 V106 F323 H327	I38-Y102 HydrophobicContact CD1-CD2 4.41Å; I38-Y102 HydrophobicContact CD1-CE2 4.28Å; I38-Y102 HydrophobicContact CG1-CE2 4.09Å; M76-Y102 HydrophobicContact CE-CD2 3.81Å; M76-Y102 HydrophobicContact SD-CD2 4.07Å; W85-Y102 AromaticContact CH2-CD1 3.85Å; W85-Y102 HydrophobicContact CH2-CD1 3.85Å; W85-Y102 AromaticContact CH2-CD2 3.11Å; W85-Y102 HydrophobicContact CH2-CD2 3.11Å; W85-Y102 HydrophobicContact CH2-CE1 4.14Å; W85-Y102 AromaticContact CH2-CE2 3.43Å; W85-Y102 HydrophobicContact CH2-CE2 3.43Å; W85-Y102 VanDerWaalsContact CH2-CE2 3.43Å; W85-Y102 AromaticContact CH2-CG 3.34Å; W85-Y102 HydrophobicContact CH2-CG 3.34Å; W85-Y102 AromaticContact CH2-CZ 3.96Å; W85-Y102 VanDerWaalsContact CZ2-CB 3.48Å; W85-Y102 AromaticContact CZ2-CD1 3.56Å; W85-Y102 HydrophobicContact CZ2-CD1 3.56Å; W85-Y102 AromaticContact CZ2-CD2 3.54Å; W85-Y102 HydrophobicContact CZ2-CD2 3.54Å; W85-Y102 HydrophobicContact CZ2-CE1 4.22Å; W85-Y102 HydrophobicContact CZ2-CE2 4.17Å; W85-Y102 AromaticContact CZ2-CG 3.19Å; W85-Y102 HydrophobicContact CZ2-CG 3.19Å; W85-Y102 AromaticContact CZ3-CD2 3.82Å; W85-Y102 HydrophobicContact CZ3-CD2 3.82Å; W85-Y102 HydrophobicContact CZ3-CE2 4.17Å; W85-Y102 HydrophobicContact CZ3-CG 4.33Å; E98-Y102 WeakPolarHBondContact O-CB 3.48Å; E98-Y102 PolarHBondContact O-N 2.66Å; E99-Y102 HydrophobicContact CG-CD1 4.45Å; E99-Y102 PolarHBondContact O-N 2.91Å; Y102-S104 VanDerWaalsContact C-N 3.3Å; Y102-S104 PolarHBondContact O-N 3.33Å; Y102-I105 PolarHBondContact O-N 2.82Å; Y102-V106 HydrophobicContact CD2-CG2 3.86Å; Y102-V106 HydrophobicContact CE2-CG2 3.3Å; Y102-V106 PolarHBondContact O-N 2.85Å; Y102-F323 HydrophobicContact CE1-CD2 4.48Å; Y102-H327 AromaticContact CE2-NE2 3.76Å; Y102-H327 AromaticContact CZ-NE2 3.46Å; Y102-H327 PolarHBondContact OH-NE2 2.67Å
103	R	92.4	Very high	86	Confident	91 Å²	91	52.8 Å²	52.8	34%	0.343	27%	0.272	S	S	.	.	H	α-helix	trans	-61.3	-40	177.4	-73.4	173.4	-176.2	-165.5	8.2	110.8	E99 K100 L101 A107 T321 F323	E99-R103 VanDerWaalsContact CD-NE 3.33Å; E99-R103 HydrophobicContact CG-CG 4.44Å; E99-R103 WeakPolarHBondContact O-CB 3.42Å; E99-R103 VanDerWaalsContact O-CG 3.25Å; E99-R103 WeakPolarHBondContact O-CG 3.45Å; E99-R103 PolarHBondContact O-N 3.39Å; E99-R103 IonicContact OE1-CZ 3.53Å; E99-R103 IonicContact OE1-NE 3.82Å; E99-R103 PolarHBondContact OE1-NE 3.31Å; E99-R103 IonicContact OE1-NH2 2.66Å; E99-R103 PolarHBondContact OE1-NH2 3.49Å; E99-R103 IonicContact OE2-CZ 2.77Å; E99-R103 IonicContact OE2-NE 3.37Å; E99-R103 IonicContact OE2-NH2 3.11Å; E99-R103 PolarHBondContact OE2-NH2 3.23Å; E99-R103 VanDerWaalsContact OE2-NH2 3.11Å; K100-R103 PolarHBondContact O-N 3.43Å; L101-R103 PolarHBondContact O-N 2.92Å; R103-A107 VanDerWaalsContact O-CB 3.25Å; R103-A107 WeakPolarHBondContact O-CB 3.45Å; R103-A107 PolarHBondContact O-N 2.91Å; R103-T321 PolarHBondContact NE-O 2.81Å; R103-T321 PolarHBondContact NH1-O 2.72Å; R103-T321 VanDerWaalsContact NH1-O 3.16Å; R103-F323 HydrophobicContact CB-CE2 4.08Å; R103-F323 HydrophobicContact CG-CD2 4.4Å; R103-F323 HydrophobicContact CG-CE2 4.27Å; R103-F323 WeakPolarHBondContact O-CE2 3.27Å
104	S	92.6	Very high	88	Confident	67 Å²	67	53.3 Å²	53.3	47%	0.469	27%	0.265	S	S	.	.	H	α-helix	trans	-63.6	-41.4	173.8	-63.8	0	0	0	0	112.7	K100 L101 Y102 A107	K100-S104 PolarHBondContact O-N 3.11Å; K100-S104 PolarHBondContact O-OG 3.23Å; K100-S104 VanDerWaalsContact O-OG 3.06Å; L101-S104 CarbonylContact O-C 3.59Å; L101-S104 WeakPolarHBondContact O-CA 3.39Å; L101-S104 WeakPolarHBondContact O-CB 3.19Å; L101-S104 PolarHBondContact O-N 3.08Å; L101-S104 VanDerWaalsContact O-N 3.12Å; Y102-S104 VanDerWaalsContact C-N 3.3Å; Y102-S104 PolarHBondContact O-N 3.33Å; S104-A107 PolarHBondContact O-N 3.44Å
105	I	94.1	Very high	90	Very high	9 Å²	9	50.3 Å²	50.3	5%	0.046	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-50.9	176	-66.7	161.6	0	0	0	110.4	I38 L75 M76 Y79 L80 L101 Y102 A107 E108 F109	I38-I105 HydrophobicContact CD1-CG2 4.17Å; L75-I105 HydrophobicContact CB-CG2 3.89Å; L75-I105 HydrophobicContact CD1-CG2 4.38Å; M76-I105 HydrophobicContact SD-CB 4.4Å; M76-I105 HydrophobicContact SD-CD1 3.65Å; M76-I105 HydrophobicContact SD-CG2 4.16Å; Y79-I105 HydrophobicContact CD2-CD1 3.97Å; Y79-I105 HydrophobicContact CD2-CG1 3.98Å; Y79-I105 HydrophobicContact CG-CD1 4.49Å; L80-I105 HydrophobicContact CD1-CD1 4.33Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 3.25Å; Y102-I105 PolarHBondContact O-N 2.82Å; I105-A107 VanDerWaalsContact C-N 3.31Å; I105-A107 PolarHBondContact O-N 3.02Å; I105-E108 PolarHBondContact O-N 3.48Å; I105-E108 VanDerWaalsContact O-N 3.16Å; I105-F109 HydrophobicContact CG2-CE2 4.08Å; I105-F109 VanDerWaalsContact O-CD2 3.25Å; I105-F109 WeakPolarHBondContact O-CD2 3.44Å
106	V	95.4	Very high	91.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-34.9	-179.1	175.4	0	0	0	0	112.4	I38 Y102 E108 F109 L316 F323 C326	I38-V106 HydrophobicContact CD1-CG2 3.6Å; I38-V106 HydrophobicContact CG1-CG2 3.92Å; I38-V106 HydrophobicContact CG2-CG2 4.38Å; Y102-V106 HydrophobicContact CD2-CG2 3.86Å; Y102-V106 HydrophobicContact CE2-CG2 3.3Å; Y102-V106 PolarHBondContact O-N 2.85Å; V106-E108 PolarHBondContact O-N 3.12Å; V106-F109 PolarHBondContact O-N 2.84Å; V106-L316 HydrophobicContact CG1-CD2 4.02Å; V106-F323 HydrophobicContact CB-CD2 3.74Å; V106-F323 HydrophobicContact CB-CE2 3.9Å; V106-F323 HydrophobicContact CB-CG 4.23Å; V106-F323 HydrophobicContact CB-CZ 4.47Å; V106-F323 HydrophobicContact CG1-CB 3.9Å; V106-F323 HydrophobicContact CG1-CD1 3.82Å; V106-F323 HydrophobicContact CG1-CD2 3.53Å; V106-F323 HydrophobicContact CG1-CE1 4.11Å; V106-F323 HydrophobicContact CG1-CE2 3.9Å; V106-F323 HydrophobicContact CG1-CG 3.48Å; V106-F323 VanDerWaalsContact CG1-CG 3.48Å; V106-F323 HydrophobicContact CG1-CZ 4.16Å; V106-C326 HydrophobicContact CG1-CB 4.41Å
107	A	96.2	Very high	92.9	Very high	12 Å²	12	41.9 Å²	41.9	10%	0.099	20%	0.202	C	C	.	.	H	α-helix	trans	-58.4	-30.4	175.9	0	0	0	0	0	112.9	R103 S104 I105 F109 A110 K318 F323	R103-A107 VanDerWaalsContact O-CB 3.25Å; R103-A107 WeakPolarHBondContact O-CB 3.45Å; R103-A107 PolarHBondContact O-N 2.91Å; S104-A107 PolarHBondContact O-N 3.44Å; I105-A107 VanDerWaalsContact C-N 3.31Å; I105-A107 PolarHBondContact O-N 3.02Å; A107-F109 VanDerWaalsContact C-N 3.26Å; A107-F109 PolarHBondContact O-N 3.22Å; A107-A110 WeakPolarHBondContact O-CB 3.35Å; A107-A110 PolarHBondContact O-N 3.04Å; A107-K318 HydrophobicContact CB-CG 4.06Å; A107-K318 WeakPolarHBondContact CB-O 3.43Å; A107-K318 WeakPolarHBondContact O-CG 3.44Å; A107-F323 HydrophobicContact CB-CZ 4.3Å
108	E	97.3	Very high	93.8	Very high	31 Å²	31	36.6 Å²	36.6	15%	0.145	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-5.1	178.3	-61.4	-59.8	156.7	0	0	114.3	I105 V106 A115 A116 F117 I156 K318	I105-E108 PolarHBondContact O-N 3.48Å; I105-E108 VanDerWaalsContact O-N 3.16Å; V106-E108 PolarHBondContact O-N 3.12Å; E108-A115 CarbonylContact O-C 3.45Å; E108-A115 WeakPolarHBondContact OE2-CA 3.43Å; E108-A116 HydrophobicContact CB-CB 4.45Å; E108-A116 PolarHBondContact O-N 3.39Å; E108-A116 PolarHBondContact OE2-N 2.94Å; E108-F117 HydrophobicContact CB-CD2 4Å; E108-F117 HydrophobicContact CB-CE2 4.35Å; E108-F117 CarbonylContact O-C 3.57Å; E108-F117 WeakPolarHBondContact O-CA 3.46Å; E108-F117 WeakPolarHBondContact O-CB 3.39Å; E108-F117 PolarHBondContact O-N 2.95Å; E108-I156 HydrophobicContact CB-CD1 3.9Å; E108-I156 HydrophobicContact CG-CD1 3.6Å; E108-I156 HydrophobicContact CG-CG1 3.84Å; E108-K318 WeakPolarHBondContact OE1-CE 3.19Å; E108-K318 IonicContact OE1-NZ 3.76Å; E108-K318 PolarHBondContact OE1-NZ 3Å; E108-K318 IonicContact OE2-NZ 2.93Å; E108-K318 PolarHBondContact OE2-NZ 3.06Å
109	F	98.2	Very high	94.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	5.7	167.8	-62.7	-81	0	0	0	113.4	L40 Q68 L71 A72 L75 I105 V106 A107 F117	L40-F109 HydrophobicContact CD1-CB 3.77Å; L40-F109 HydrophobicContact CD1-CD1 3.8Å; L40-F109 HydrophobicContact CD1-CG 3.78Å; L40-F109 HydrophobicContact CD2-CB 4.35Å; Q68-F109 HydrophobicContact CB-CD1 3.74Å; Q68-F109 HydrophobicContact CB-CE1 3.98Å; Q68-F109 HydrophobicContact CG-CD1 3.99Å; Q68-F109 HydrophobicContact CG-CE1 4.41Å; Q68-F109 WeakPolarHBondContact O-CE1 3.48Å; L71-F109 HydrophobicContact CB-CE1 4.32Å; L71-F109 HydrophobicContact CB-CZ 4.3Å; L71-F109 HydrophobicContact CD2-CE1 4.32Å; L71-F109 HydrophobicContact CD2-CZ 4.43Å; L71-F109 HydrophobicContact CG-CE1 4.39Å; L71-F109 HydrophobicContact CG-CZ 4.14Å; A72-F109 HydrophobicContact CB-CD2 4.25Å; A72-F109 HydrophobicContact CB-CE1 4.33Å; A72-F109 HydrophobicContact CB-CE2 3.62Å; A72-F109 HydrophobicContact CB-CZ 3.66Å; L75-F109 HydrophobicContact CD1-CE2 3.91Å; L75-F109 HydrophobicContact CD1-CZ 3.78Å; I105-F109 HydrophobicContact CG2-CE2 4.08Å; I105-F109 VanDerWaalsContact O-CD2 3.25Å; I105-F109 WeakPolarHBondContact O-CD2 3.44Å; V106-F109 PolarHBondContact O-N 2.84Å; A107-F109 VanDerWaalsContact C-N 3.26Å; A107-F109 PolarHBondContact O-N 3.22Å; F109-F117 HydrophobicContact CD1-CB 3.51Å; F109-F117 HydrophobicContact CD1-CD2 4.48Å; F109-F117 HydrophobicContact CD1-CG 4.41Å; F109-F117 HydrophobicContact CE1-CB 3.44Å; F109-F117 VanDerWaalsContact CE1-CB 3.44Å; F109-F117 AromaticContact CE1-CD2 3.95Å; F109-F117 HydrophobicContact CE1-CD2 3.95Å; F109-F117 AromaticContact CE1-CG 3.94Å; F109-F117 HydrophobicContact CE1-CG 3.94Å; F109-F117 HydrophobicContact CE2-CD2 4.22Å; F109-F117 HydrophobicContact CG-CB 4.32Å; F109-F117 HydrophobicContact CZ-CB 4.19Å; F109-F117 AromaticContact CZ-CD2 3.8Å; F109-F117 HydrophobicContact CZ-CD2 3.8Å; F109-F117 HydrophobicContact CZ-CG 4.24Å
110	A	97.7	Very high	95.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-57.4	152.7	178.3	0	0	0	0	0	112.8	A107 C112 A115 S118 L316 K318	A107-A110 WeakPolarHBondContact O-CB 3.35Å; A107-A110 PolarHBondContact O-N 3.04Å; A110-C112 PolarHBondContact O-N 3.39Å; A110-A115 HydrophobicContact CB-CB 3.97Å; A110-A115 WeakPolarHBondContact O-CB 3.33Å; A110-S118 WeakPolarHBondContact O-CA 3.11Å; A110-S118 WeakPolarHBondContact O-CB 3.36Å; A110-L316 HydrophobicContact CB-CG 4.42Å; A110-K318 HydrophobicContact CB-CB 3.78Å; A110-K318 HydrophobicContact CB-CG 4.46Å
111	D	98	Very high	95.8	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	13%	0.132	C	C	.	.	S	Bend	trans	-85.2	52	-176	-56.5	-64.7	0	0	0	111.6	R43 F46 R65 H120 A315 L316	R43-D111 WeakPolarHBondContact CB-OD2 3.43Å; R43-D111 WeakPolarHBondContact CD-OD2 3.31Å; R43-D111 WeakPolarHBondContact CG-OD2 3.12Å; F46-D111 HydrophobicContact CB-CB 3.6Å; F46-D111 WeakPolarHBondContact CB-O 3.4Å; F46-D111 HydrophobicContact CD1-CB 3.75Å; F46-D111 HydrophobicContact CG-CB 4.01Å; R65-D111 IonicContact CZ-OD1 3.33Å; R65-D111 VanDerWaalsContact CZ-OD1 3.25Å; R65-D111 IonicContact NH1-OD1 2.95Å; R65-D111 PolarHBondContact NH1-OD1 3.07Å; R65-D111 IonicContact NH2-OD1 3.22Å; R65-D111 PolarHBondContact NH2-OD1 3.09Å; D111-H120 PolarHBondContact O-CE1 3.5Å; D111-A315 HydrophobicContact CB-CB 4.19Å; D111-A315 WeakPolarHBondContact OD2-CA 3.47Å; D111-L316 PolarHBondContact N-O 2.73Å; D111-L316 WeakPolarHBondContact OD2-CB 3.48Å; D111-L316 PolarHBondContact OD2-N 2.9Å
112	C	96.2	Very high	96.3	Very high	19 Å²	19	24.4 Å²	24.4	13%	0.128	12%	0.121	C	C	.	.	S	Bend	trans	-141.6	161.3	178.2	72.9	0	0	0	0	111.2	A110 E114 A115 S118	A110-C112 PolarHBondContact O-N 3.39Å; C112-E114 VanDerWaalsContact CB-OE2 3.27Å; C112-E114 WeakPolarHBondContact CB-OE2 3.16Å; C112-E114 PolarHBondContact O-N 3.26Å; C112-E114 PolarHBondContact SG-OE2 3.34Å; C112-A115 PolarHBondContact O-N 3.01Å; C112-S118 WeakPolarHBondContact O-CB 3.36Å; C112-S118 PolarHBondContact O-OG 3.34Å; C112-S118 VanDerWaalsContact O-OG 3.13Å
113	K	95.4	Very high	96.6	Very high	111 Å²	111	24.1 Å²	24.1	48%	0.483	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-21	-170.7	-60.7	173.5	-169.7	115.9	0	113.2	E47 A115 H120	E47-K113 IonicContact OE2-NZ 3.8Å; E47-K113 PolarHBondContact OE2-NZ 3.47Å; K113-A115 VanDerWaalsContact C-N 3.35Å; K113-H120 HydrophobicContact CG-CB 4.19Å
114	E	94.6	Very high	96.8	Very high	100 Å²	100	24.3 Å²	24.3	47%	0.467	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.3	-176.8	-55.5	68.1	-147.2	0	0	112.9	C112 K318	C112-E114 VanDerWaalsContact CB-OE2 3.27Å; C112-E114 WeakPolarHBondContact CB-OE2 3.16Å; C112-E114 PolarHBondContact O-N 3.26Å; C112-E114 PolarHBondContact SG-OE2 3.34Å; E114-K318 HydrophobicContact CB-CD 4.37Å; E114-K318 PolarHBondContact O-NZ 3.35Å
115	A	97.1	Very high	97.1	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.008	10%	0.103	C	C	.	.	S	Bend	trans	-89.4	124.6	179.3	0	0	0	0	0	110.9	E108 A110 C112 K113 F117 S118 K318	E108-A115 CarbonylContact O-C 3.45Å; E108-A115 WeakPolarHBondContact OE2-CA 3.43Å; A110-A115 HydrophobicContact CB-CB 3.97Å; A110-A115 WeakPolarHBondContact O-CB 3.33Å; C112-A115 PolarHBondContact O-N 3.01Å; K113-A115 VanDerWaalsContact C-N 3.35Å; A115-F117 PolarHBondContact O-N 2.8Å; A115-F117 VanDerWaalsContact O-N 3.16Å; A115-S118 WeakPolarHBondContact O-CB 3.44Å; A115-S118 PolarHBondContact O-N 3.15Å; A115-S118 VanDerWaalsContact O-N 3.11Å; A115-S118 PolarHBondContact O-OG 3.44Å; A115-K318 HydrophobicContact CB-CD 4.19Å
116	A	97.6	Very high	97.2	Very high	8 Å²	8	20.8 Å²	20.8	7%	0.066	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-30.4	-167.7	0	0	0	0	0	114.2	E108 K121 N155 I156	E108-A116 HydrophobicContact CB-CB 4.45Å; E108-A116 PolarHBondContact O-N 3.39Å; E108-A116 PolarHBondContact OE2-N 2.94Å; A116-K121 WeakPolarHBondContact O-CG 3.25Å; A116-N155 WeakPolarHBondContact CB-OD1 3.17Å; A116-I156 HydrophobicContact CB-CD1 3.83Å; A116-I156 HydrophobicContact CB-CG1 3.89Å
117	F	98.4	Very high	97.3	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	17.6	-178.2	-50	-54	0	0	0	112.5	Q68 L71 L75 E108 F109 A115 A150 V151 I156 L159	Q68-F117 PolarHBondContact NE2-O 2.86Å; L71-F117 HydrophobicContact CD2-CB 4.37Å; L71-F117 HydrophobicContact CD2-CD1 3.49Å; L71-F117 VanDerWaalsContact CD2-CD1 3.49Å; L71-F117 HydrophobicContact CD2-CD2 4.15Å; L71-F117 HydrophobicContact CD2-CE1 3.75Å; L71-F117 HydrophobicContact CD2-CE2 4.36Å; L71-F117 HydrophobicContact CD2-CG 3.72Å; L71-F117 HydrophobicContact CD2-CZ 4.18Å; L75-F117 HydrophobicContact CD1-CD2 3.9Å; L75-F117 HydrophobicContact CD1-CE2 3.44Å; L75-F117 VanDerWaalsContact CD1-CE2 3.44Å; L75-F117 HydrophobicContact CD1-CZ 4.28Å; E108-F117 HydrophobicContact CB-CD2 4Å; E108-F117 HydrophobicContact CB-CE2 4.35Å; E108-F117 CarbonylContact O-C 3.57Å; E108-F117 WeakPolarHBondContact O-CA 3.46Å; E108-F117 WeakPolarHBondContact O-CB 3.39Å; E108-F117 PolarHBondContact O-N 2.95Å; F109-F117 HydrophobicContact CD1-CB 3.51Å; F109-F117 HydrophobicContact CD1-CD2 4.48Å; F109-F117 HydrophobicContact CD1-CG 4.41Å; F109-F117 HydrophobicContact CE1-CB 3.44Å; F109-F117 VanDerWaalsContact CE1-CB 3.44Å; F109-F117 AromaticContact CE1-CD2 3.95Å; F109-F117 HydrophobicContact CE1-CD2 3.95Å; F109-F117 AromaticContact CE1-CG 3.94Å; F109-F117 HydrophobicContact CE1-CG 3.94Å; F109-F117 HydrophobicContact CE2-CD2 4.22Å; F109-F117 HydrophobicContact CG-CB 4.32Å; F109-F117 HydrophobicContact CZ-CB 4.19Å; F109-F117 AromaticContact CZ-CD2 3.8Å; F109-F117 HydrophobicContact CZ-CD2 3.8Å; F109-F117 HydrophobicContact CZ-CG 4.24Å; A115-F117 PolarHBondContact O-N 2.8Å; A115-F117 VanDerWaalsContact O-N 3.16Å; F117-A150 HydrophobicContact CD1-CB 3.9Å; F117-A150 HydrophobicContact CE1-CB 4.17Å; F117-A150 WeakPolarHBondContact CE1-O 3.49Å; F117-V151 HydrophobicContact CE1-CG2 4.04Å; F117-V151 HydrophobicContact CZ-CG2 4.37Å; F117-I156 HydrophobicContact CD2-CD1 4.23Å; F117-I156 HydrophobicContact CE2-CD1 3.29Å; F117-I156 HydrophobicContact CZ-CD1 3.67Å; F117-L159 HydrophobicContact CE2-CD2 4.14Å; F117-L159 HydrophobicContact CZ-CD2 3.56Å
118	S	98.2	Very high	97.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	14%	0.142	C	C	.	.			trans	-55.5	156.9	177.5	60.3	0	0	0	0	113.3	A110 C112 A115 H120 K121 L122	A110-S118 WeakPolarHBondContact O-CA 3.11Å; A110-S118 WeakPolarHBondContact O-CB 3.36Å; C112-S118 WeakPolarHBondContact O-CB 3.36Å; C112-S118 PolarHBondContact O-OG 3.34Å; C112-S118 VanDerWaalsContact O-OG 3.13Å; A115-S118 WeakPolarHBondContact O-CB 3.44Å; A115-S118 PolarHBondContact O-N 3.15Å; A115-S118 VanDerWaalsContact O-N 3.11Å; A115-S118 PolarHBondContact O-OG 3.44Å; S118-H120 PolarHBondContact O-N 2.95Å; S118-K121 PolarHBondContact O-N 3.48Å; S118-K121 WeakPolarHBondContact OG-CB 3.29Å; S118-K121 PolarHBondContact OG-N 3.14Å; S118-L122 WeakPolarHBondContact O-CG 3.38Å; S118-L122 PolarHBondContact O-N 2.89Å
119	I	98.1	Very high	97.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-30.7	170.3	-168.7	63.7	0	0	0	111.3	F46 D57 W60 L64 V123	F46-I119 HydrophobicContact CD1-CG2 4.46Å; F46-I119 HydrophobicContact CE1-CG2 4.05Å; F46-I119 HydrophobicContact CZ-CG2 4.1Å; D57-I119 HydrophobicContact CB-CD1 4.28Å; D57-I119 HydrophobicContact CB-CG1 3.98Å; W60-I119 HydrophobicContact CH2-CD1 4.36Å; W60-I119 HydrophobicContact CH2-CG1 4.14Å; W60-I119 HydrophobicContact CZ3-CD1 4.34Å; L64-I119 HydrophobicContact CB-CD1 3.91Å; L64-I119 HydrophobicContact CD1-CD1 3.67Å; L64-I119 HydrophobicContact CG-CD1 4.45Å; I119-V123 WeakPolarHBondContact O-CB 3.41Å; I119-V123 VanDerWaalsContact O-CG2 3.27Å; I119-V123 WeakPolarHBondContact O-CG2 3.47Å; I119-V123 PolarHBondContact O-N 3.24Å
120	H	98	Very high	97.1	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.056	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-49.9	174.5	-60	72.6	0	0	0	112	F46 E47 D111 K113 S118 V123 E124	F46-H120 AromaticContact CD2-CE1 3.76Å; F46-H120 AromaticContact CD2-NE2 3.92Å; E47-H120 PolarHBondContact O-NE2 2.83Å; D111-H120 PolarHBondContact O-CE1 3.5Å; K113-H120 HydrophobicContact CG-CB 4.19Å; S118-H120 PolarHBondContact O-N 2.95Å; H120-V123 PolarHBondContact O-N 3.5Å; H120-E124 PolarHBondContact O-N 3.32Å
121	K	97.8	Very high	97	Very high	33 Å²	33	44.8 Å²	44.8	14%	0.143	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-43.9	177.2	-177.2	62.1	179.9	177.4	0	111	A116 S118 V123 E124 L125 E153	A116-K121 WeakPolarHBondContact O-CG 3.25Å; S118-K121 PolarHBondContact O-N 3.48Å; S118-K121 WeakPolarHBondContact OG-CB 3.29Å; S118-K121 PolarHBondContact OG-N 3.14Å; K121-V123 VanDerWaalsContact C-N 3.26Å; K121-V123 PolarHBondContact O-N 3.03Å; K121-E124 IonicContact NZ-OE1 3.52Å; K121-E124 PolarHBondContact NZ-OE1 2.89Å; K121-E124 WeakPolarHBondContact O-CB 3.45Å; K121-E124 PolarHBondContact O-N 3.41Å; K121-E124 VanDerWaalsContact O-N 3.16Å; K121-L125 HydrophobicContact CD-CD2 4.48Å; K121-L125 HydrophobicContact CD-CG 4.21Å; K121-L125 HydrophobicContact CG-CD1 4.2Å; K121-L125 HydrophobicContact CG-CG 4.29Å; K121-L125 WeakPolarHBondContact O-CB 3.36Å; K121-L125 VanDerWaalsContact O-CG 3.25Å; K121-L125 WeakPolarHBondContact O-CG 3.36Å; K121-L125 PolarHBondContact O-N 2.84Å; K121-E153 IonicContact NZ-OE2 2.76Å; K121-E153 PolarHBondContact NZ-OE2 3.4Å
122	L	98.1	Very high	96.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-34.4	176.7	-65.4	178.6	0	0	0	112.7	L64 Q68 S118 S126 L146 L147 A150	L64-L122 HydrophobicContact CB-CD1 4.12Å; L64-L122 HydrophobicContact CD1-CB 4.45Å; Q68-L122 HydrophobicContact CG-CD1 3.73Å; S118-L122 WeakPolarHBondContact O-CG 3.38Å; S118-L122 PolarHBondContact O-N 2.89Å; L122-S126 WeakPolarHBondContact O-CB 3.43Å; L122-S126 PolarHBondContact O-N 2.85Å; L122-L146 HydrophobicContact CD2-CB 4Å; L122-L147 HydrophobicContact CD2-CD2 4.4Å; L122-A150 HydrophobicContact CD2-CB 4.33Å
123	V	97.7	Very high	96.7	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-75.8	-36.2	174.7	171.8	0	0	0	0	112.7	I49 W60 L64 I119 H120 K121 S126 R127 P134	I49-V123 HydrophobicContact CG2-CB 4.42Å; I49-V123 HydrophobicContact CG2-CG1 3.79Å; W60-V123 HydrophobicContact CH2-CG2 3.72Å; W60-V123 HydrophobicContact CZ3-CG2 3.7Å; L64-V123 HydrophobicContact CD1-CG2 4.47Å; I119-V123 WeakPolarHBondContact O-CB 3.41Å; I119-V123 VanDerWaalsContact O-CG2 3.27Å; I119-V123 WeakPolarHBondContact O-CG2 3.47Å; I119-V123 PolarHBondContact O-N 3.24Å; H120-V123 PolarHBondContact O-N 3.5Å; K121-V123 VanDerWaalsContact C-N 3.26Å; K121-V123 PolarHBondContact O-N 3.03Å; V123-S126 WeakPolarHBondContact O-CB 3.2Å; V123-S126 PolarHBondContact O-N 3.49Å; V123-R127 WeakPolarHBondContact O-CG 3.49Å; V123-R127 PolarHBondContact O-N 2.93Å; V123-P134 HydrophobicContact CG1-CB 3.75Å; V123-P134 HydrophobicContact CG1-CG 3.72Å
124	E	97.2	Very high	96.6	Very high	96 Å²	96	50.2 Å²	50.2	45%	0.449	23%	0.229	S	C	.	.	H	α-helix	trans	-60	-51	171.6	179.5	-154.4	109.6	0	0	111.2	H120 K121 S126 R127 R128	H120-E124 PolarHBondContact O-N 3.32Å; K121-E124 IonicContact NZ-OE1 3.52Å; K121-E124 PolarHBondContact NZ-OE1 2.89Å; K121-E124 WeakPolarHBondContact O-CB 3.45Å; K121-E124 PolarHBondContact O-N 3.41Å; K121-E124 VanDerWaalsContact O-N 3.16Å; E124-S126 VanDerWaalsContact C-N 3.29Å; E124-S126 PolarHBondContact O-N 2.94Å; E124-R127 PolarHBondContact O-N 2.78Å; E124-R128 PolarHBondContact O-N 3.09Å
125	L	97.8	Very high	96.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.5	-43.7	173.9	-67.4	179.6	0	0	0	111.2	K121 R127 R128 L129 L146 A149 A150 E153	K121-L125 HydrophobicContact CD-CD2 4.48Å; K121-L125 HydrophobicContact CD-CG 4.21Å; K121-L125 HydrophobicContact CG-CD1 4.2Å; K121-L125 HydrophobicContact CG-CG 4.29Å; K121-L125 WeakPolarHBondContact O-CB 3.36Å; K121-L125 VanDerWaalsContact O-CG 3.25Å; K121-L125 WeakPolarHBondContact O-CG 3.36Å; K121-L125 PolarHBondContact O-N 2.84Å; L125-R127 PolarHBondContact O-N 3.47Å; L125-R128 PolarHBondContact O-N 3.19Å; L125-L129 WeakPolarHBondContact O-CB 3.18Å; L125-L129 WeakPolarHBondContact O-CG 3.35Å; L125-L129 PolarHBondContact O-N 3.37Å; L125-L146 HydrophobicContact CB-CD2 3.58Å; L125-L146 WeakPolarHBondContact CD1-O 3.38Å; L125-A149 HydrophobicContact CD1-CB 4.18Å; L125-A149 HydrophobicContact CD2-CB 4.09Å; L125-A150 HydrophobicContact CD1-CB 3.61Å; L125-E153 WeakPolarHBondContact CD2-OE2 3.44Å
126	S	97.2	Very high	96.3	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-41.9	178	177.3	0	0	0	0	113.4	L122 V123 E124 F130 K132 H138	L122-S126 WeakPolarHBondContact O-CB 3.43Å; L122-S126 PolarHBondContact O-N 2.85Å; V123-S126 WeakPolarHBondContact O-CB 3.2Å; V123-S126 PolarHBondContact O-N 3.49Å; E124-S126 VanDerWaalsContact C-N 3.29Å; E124-S126 PolarHBondContact O-N 2.94Å; S126-F130 WeakPolarHBondContact O-CB 3.25Å; S126-F130 PolarHBondContact O-N 2.88Å; S126-K132 PolarHBondContact O-N 3.04Å; S126-K132 VanDerWaalsContact OG-CB 3.27Å; S126-K132 WeakPolarHBondContact OG-CB 3.42Å; S126-H138 PolarHBondContact OG-CE1 2.88Å; S126-H138 PolarHBondContact OG-NE2 3.21Å
127	R	96.7	Very high	96.1	Very high	119 Å²	119	54.1 Å²	54.1	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-45.6	173.5	-71.1	177.1	69.5	167.1	-1.7	111.7	A50 V123 E124 L125 D131 K132 P134	A50-R127 PolarHBondContact O-NH1 2.84Å; V123-R127 WeakPolarHBondContact O-CG 3.49Å; V123-R127 PolarHBondContact O-N 2.93Å; E124-R127 PolarHBondContact O-N 2.78Å; L125-R127 PolarHBondContact O-N 3.47Å; R127-D131 VanDerWaalsContact O-CA 3.27Å; R127-D131 WeakPolarHBondContact O-CA 3.38Å; R127-D131 PolarHBondContact O-N 2.92Å; R127-D131 VanDerWaalsContact O-N 3.12Å; R127-K132 WeakPolarHBondContact CG-O 3.36Å; R127-P134 HydrophobicContact CG-CG 4.5Å
128	R	96.4	Very high	95.9	Very high	135 Å²	135	54.2 Å²	54.2	51%	0.509	25%	0.252	S	S	.	.	H	α-helix	trans	-73.5	-37	-175.8	179.9	166.2	47.7	94.6	6.6	113.6	E124 L125 E153	E124-R128 PolarHBondContact O-N 3.09Å; L125-R128 PolarHBondContact O-N 3.19Å; R128-E153 IonicContact CZ-OE1 2.93Å; R128-E153 IonicContact CZ-OE2 2.94Å; R128-E153 IonicContact NH1-OE1 2.64Å; R128-E153 PolarHBondContact NH1-OE1 3.4Å; R128-E153 IonicContact NH2-OE1 3.89Å; R128-E153 PolarHBondContact NH2-OE1 2.87Å; R128-E153 IonicContact NH2-OE2 3.79Å; R128-E153 PolarHBondContact NH2-OE2 3.35Å
129	L	96.5	Very high	95.7	Very high	75 Å²	75	55.7 Å²	55.7	39%	0.393	27%	0.267	S	S	.	.	H	α-helix	trans	-91.1	-24.7	-174.9	-61.3	176.3	0	0	0	113.7	L125 L146 A149	L125-L129 WeakPolarHBondContact O-CB 3.18Å; L125-L129 WeakPolarHBondContact O-CG 3.35Å; L125-L129 PolarHBondContact O-N 3.37Å; L129-L146 HydrophobicContact CD1-CD2 4.37Å; L129-A149 HydrophobicContact CD1-CB 3.72Å
130	F	95.7	Very high	95.5	Very high	72 Å²	72	56 Å²	56	32%	0.316	27%	0.269	S	S	.	.	H	α-helix	trans	-132.9	4.9	-172.4	-52.5	-59.9	0	0	0	115	S126 K132 L145 L146	S126-F130 WeakPolarHBondContact O-CB 3.25Å; S126-F130 PolarHBondContact O-N 2.88Å; F130-K132 HydrophobicContact CB-CB 4.29Å; F130-K132 HydrophobicContact CB-CD 4.21Å; F130-K132 HydrophobicContact CB-CG 3.98Å; F130-K132 PolarHBondContact O-N 3.49Å; F130-L145 HydrophobicContact CE1-CD1 4.05Å; F130-L145 HydrophobicContact CZ-CB 3.84Å; F130-L145 HydrophobicContact CZ-CD1 3.85Å; F130-L146 HydrophobicContact CD2-CD2 4.23Å; F130-L146 HydrophobicContact CE2-CD2 3.74Å; F130-L146 HydrophobicContact CE2-CG 4.02Å
131	D	94.7	Very high	95.4	Very high	145 Å²	145	57.9 Å²	57.9	78%	0.775	29%	0.287	S	S	*	.			trans	49.4	25	-169.9	-161.8	30.5	0	0	0	113.8	R127 K133	R127-D131 VanDerWaalsContact O-CA 3.27Å; R127-D131 WeakPolarHBondContact O-CA 3.38Å; R127-D131 PolarHBondContact O-N 2.92Å; R127-D131 VanDerWaalsContact O-N 3.12Å; D131-K133 PolarHBondContact O-N 3.12Å
132	K	93	Very high	95.2	Very high	62 Å²	62	57.4 Å²	57.4	27%	0.27	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-80.8	122.7	-177.1	-87.7	-173.6	174.6	-169.2	0	110.5	S126 R127 F130 R137	S126-K132 PolarHBondContact O-N 3.04Å; S126-K132 VanDerWaalsContact OG-CB 3.27Å; S126-K132 WeakPolarHBondContact OG-CB 3.42Å; R127-K132 WeakPolarHBondContact CG-O 3.36Å; F130-K132 HydrophobicContact CB-CB 4.29Å; F130-K132 HydrophobicContact CB-CD 4.21Å; F130-K132 HydrophobicContact CB-CG 3.98Å; F130-K132 PolarHBondContact O-N 3.49Å; K132-R137 PolarHBondContact NZ-O 3.11Å
133	K	93.8	Very high	95.2	Very high	164 Å²	164	57.3 Å²	57.3	71%	0.713	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-62.7	145.9	176	-62.3	179.1	-176.5	176.7	0	110.7	D131 G135 S136	D131-K133 PolarHBondContact O-N 3.12Å; K133-G135 PolarHBondContact O-N 2.96Å; K133-S136 PolarHBondContact N-OG 2.96Å; K133-S136 WeakPolarHBondContact O-CB 3.46Å; K133-S136 PolarHBondContact O-N 2.85Å; K133-S136 PolarHBondContact O-OG 3.08Å
134	P	93.5	Very high	95.2	Very high	22 Å²	22	57.1 Å²	57.1	14%	0.143	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	140	168.7	-27.5	36.3	0	0	0	111.8	I49 T52 M54 V123 R127 S136	I49-P134 HydrophobicContact CG2-CB 3.9Å; I49-P134 HydrophobicContact CG2-CG 4.09Å; T52-P134 HydrophobicContact CG2-CB 3.76Å; T52-P134 HydrophobicContact CG2-CG 3.91Å; M54-P134 HydrophobicContact SD-CB 4.34Å; V123-P134 HydrophobicContact CG1-CB 3.75Å; V123-P134 HydrophobicContact CG1-CG 3.72Å; R127-P134 HydrophobicContact CG-CG 4.5Å; P134-S136 VanDerWaalsContact C-N 3.32Å
135	G	93.5	Very high	95.2	Very high	25 Å²	25	54.6 Å²	54.6	26%	0.258	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	-10.1	-170.9	0	0	0	0	0	115.3	W60 K133	W60-G135 VanDerWaalsContact CB-O 3.3Å; W60-G135 WeakPolarHBondContact CB-O 3.34Å; K133-G135 PolarHBondContact O-N 2.96Å
136	S	93.3	Very high	95.2	Very high	40 Å²	40	54.6 Å²	54.6	28%	0.28	28%	0.275	S	S	.	.			trans	-66.2	139.8	174.4	-61.8	0	0	0	0	111.5	K133 P134 H138	K133-S136 PolarHBondContact N-OG 2.96Å; K133-S136 WeakPolarHBondContact O-CB 3.46Å; K133-S136 PolarHBondContact O-N 2.85Å; K133-S136 PolarHBondContact O-OG 3.08Å; P134-S136 VanDerWaalsContact C-N 3.32Å; S136-H138 PolarHBondContact O-CD2 3.45Å
137	R	93.4	Very high	95.3	Very high	127 Å²	127	54.5 Å²	54.5	48%	0.479	28%	0.275	S	S	.	.			trans	-76	148.7	175.5	-59.8	-173.6	-172.6	158	10.3	111.5	W60 K132 A290 S291	W60-R137 HydrophobicContact CB-CG 4.33Å; K132-R137 PolarHBondContact NZ-O 3.11Å; R137-A290 HydrophobicContact CB-CB 4.01Å; R137-A290 WeakPolarHBondContact CD-O 3.42Å; R137-A290 PolarHBondContact NH1-O 2.85Å; R137-S291 PolarHBondContact NH1-OG 2.92Å
138	H	93.8	Very high	95.4	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.019	26%	0.261	C	S	.	.			trans	-114.7	147.7	175.8	-77.2	-94.1	0	0	0	111.4	T63 L64 S126 S136 S142	T63-H138 VanDerWaalsContact CB-O 3.23Å; T63-H138 WeakPolarHBondContact CB-O 3.34Å; T63-H138 WeakPolarHBondContact CG2-O 3.46Å; T63-H138 PolarHBondContact OG1-O 3.22Å; L64-H138 HydrophobicContact CD2-CB 3.99Å; L64-H138 HydrophobicContact CG-CB 4.45Å; S126-H138 PolarHBondContact OG-CE1 2.88Å; S126-H138 PolarHBondContact OG-NE2 3.21Å; S136-H138 PolarHBondContact O-CD2 3.45Å; H138-S142 PolarHBondContact ND1-OG 2.85Å
139	G	93.4	Very high	95.5	Very high	30 Å²	30	44.5 Å²	44.5	31%	0.309	24%	0.24	S	C	.	.			trans	-101.3	161.6	166.4	0	0	0	0	0	110.8	A141 S142 T143	G139-A141 PolarHBondContact O-N 3.31Å; G139-S142 PolarHBondContact N-OG 2.79Å; G139-S142 PolarHBondContact O-N 3.07Å; G139-S142 PolarHBondContact O-OG 2.73Å; G139-T143 PolarHBondContact O-N 2.92Å; G139-T143 PolarHBondContact O-OG1 3.04Å
140	P	94.7	Very high	95.6	Very high	7 Å²	7	40.9 Å²	40.9	5%	0.045	22%	0.221	C	C	.	.	H	α-helix	trans	-50.8	-47.1	-173.6	-28.3	35.2	0	0	0	114.2	T63 S142 T143 S144 I286 T344	T63-P140 HydrophobicContact CG2-CG 4.4Å; P140-S142 PolarHBondContact O-N 3.21Å; P140-T143 WeakPolarHBondContact O-CB 3.34Å; P140-T143 PolarHBondContact O-N 2.86Å; P140-T143 VanDerWaalsContact O-N 3.09Å; P140-S144 PolarHBondContact O-N 3.24Å; P140-S144 PolarHBondContact O-OG 3.44Å; P140-I286 HydrophobicContact CB-CB 4.5Å; P140-I286 HydrophobicContact CB-CG2 4.13Å; P140-I286 HydrophobicContact CG-CG2 4.23Å; P140-T344 WeakPolarHBondContact CB-OG1 3.34Å; P140-T344 PolarHBondContact O-OG1 3.18Å
141	A	94.3	Very high	95.7	Very high	52 Å²	52	37.5 Å²	37.5	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-58.5	-44.3	176.5	0	0	0	0	0	113.4	G139 T143 S144 L145 S257	G139-A141 PolarHBondContact O-N 3.31Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.04Å; A141-S144 WeakPolarHBondContact O-CB 3.49Å; A141-S144 PolarHBondContact O-N 3.41Å; A141-L145 PolarHBondContact O-N 3.45Å; A141-S257 WeakPolarHBondContact CA-OG 3.37Å
142	S	95	Very high	95.8	Very high	22 Å²	22	36 Å²	36	15%	0.154	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-33.4	176.1	68.2	0	0	0	0	112.3	H138 G139 P140 L146	H138-S142 PolarHBondContact ND1-OG 2.85Å; G139-S142 PolarHBondContact N-OG 2.79Å; G139-S142 PolarHBondContact O-N 3.07Å; G139-S142 PolarHBondContact O-OG 2.73Å; P140-S142 PolarHBondContact O-N 3.21Å; S142-L146 WeakPolarHBondContact O-CG 3.43Å; S142-L146 PolarHBondContact O-N 3.31Å
143	T	96.8	Very high	95.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.6	-39.8	173.2	-59.9	0	0	0	0	111	T63 L64 G139 P140 A141 L145 L146 L147	T63-T143 PolarHBondContact O-OG1 3Å; L64-T143 HydrophobicContact CD2-CG2 4.41Å; G139-T143 PolarHBondContact O-N 2.92Å; G139-T143 PolarHBondContact O-OG1 3.04Å; P140-T143 WeakPolarHBondContact O-CB 3.34Å; P140-T143 PolarHBondContact O-N 2.86Å; P140-T143 VanDerWaalsContact O-N 3.09Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 3.04Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.34Å; T143-L146 WeakPolarHBondContact O-CA 3.2Å; T143-L146 WeakPolarHBondContact O-CB 3.4Å; T143-L146 PolarHBondContact O-N 3.5Å; T143-L147 HydrophobicContact CG2-CD1 4.4Å; T143-L147 HydrophobicContact CG2-CG 4.28Å; T143-L147 WeakPolarHBondContact O-CG 3.14Å; T143-L147 PolarHBondContact O-N 3.43Å
144	S	97.7	Very high	96	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.5	-44.4	178.9	-53.9	0	0	0	0	112.4	P140 A141 L146 L147 Q148 S257 T344	P140-S144 PolarHBondContact O-N 3.24Å; P140-S144 PolarHBondContact O-OG 3.44Å; A141-S144 WeakPolarHBondContact O-CB 3.49Å; A141-S144 PolarHBondContact O-N 3.41Å; S144-L146 VanDerWaalsContact C-N 3.34Å; S144-L146 PolarHBondContact O-N 3.12Å; S144-L147 PolarHBondContact O-N 3.29Å; S144-Q148 PolarHBondContact O-N 2.98Å; S144-S257 PolarHBondContact OG-OG 3.4Å; S144-T344 WeakPolarHBondContact OG-CG2 3.27Å; S144-T344 PolarHBondContact OG-OG1 2.98Å
145	L	97.8	Very high	96	Very high	43 Å²	43	33.7 Å²	33.7	23%	0.225	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-33.4	175.3	-67.1	170.4	0	0	0	112.7	F130 A141 T143 A149 V167	F130-L145 HydrophobicContact CE1-CD1 4.05Å; F130-L145 HydrophobicContact CZ-CB 3.84Å; F130-L145 HydrophobicContact CZ-CD1 3.85Å; A141-L145 PolarHBondContact O-N 3.45Å; T143-L145 VanDerWaalsContact C-N 3.31Å; T143-L145 PolarHBondContact O-N 3.34Å; L145-A149 PolarHBondContact O-N 3.01Å; L145-A149 VanDerWaalsContact O-N 3.12Å; L145-V167 HydrophobicContact CD2-CB 4.18Å; L145-V167 HydrophobicContact CD2-CG1 3.97Å; L145-V167 HydrophobicContact CD2-CG2 4.27Å; L145-V167 HydrophobicContact CG-CG1 4.32Å
146	L	98.2	Very high	96	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.2	-39.7	171.9	-63	174.3	0	0	0	111.9	L64 L122 L125 L129 F130 S142 T143 S144 A150	L64-L146 HydrophobicContact CD2-CD1 3.53Å; L122-L146 HydrophobicContact CD2-CB 4Å; L125-L146 HydrophobicContact CB-CD2 3.58Å; L125-L146 WeakPolarHBondContact CD1-O 3.38Å; L129-L146 HydrophobicContact CD1-CD2 4.37Å; F130-L146 HydrophobicContact CD2-CD2 4.23Å; F130-L146 HydrophobicContact CE2-CD2 3.74Å; F130-L146 HydrophobicContact CE2-CG 4.02Å; S142-L146 WeakPolarHBondContact O-CG 3.43Å; S142-L146 PolarHBondContact O-N 3.31Å; T143-L146 WeakPolarHBondContact O-CA 3.2Å; T143-L146 WeakPolarHBondContact O-CB 3.4Å; T143-L146 PolarHBondContact O-N 3.5Å; S144-L146 VanDerWaalsContact C-N 3.34Å; S144-L146 PolarHBondContact O-N 3.12Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.21Å
147	L	98.6	Very high	95.7	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-40.7	176.8	-62.4	178.8	0	0	0	111.1	L71 L122 T143 S144 A150 V151 L255	L71-L147 HydrophobicContact CB-CD2 4.17Å; L71-L147 HydrophobicContact CD2-CD2 4.04Å; L122-L147 HydrophobicContact CD2-CD2 4.4Å; T143-L147 HydrophobicContact CG2-CD1 4.4Å; T143-L147 HydrophobicContact CG2-CG 4.28Å; T143-L147 WeakPolarHBondContact O-CG 3.14Å; T143-L147 PolarHBondContact O-N 3.43Å; S144-L147 PolarHBondContact O-N 3.29Å; L147-A150 PolarHBondContact O-N 3.14Å; L147-V151 WeakPolarHBondContact O-CG2 3.44Å; L147-V151 PolarHBondContact O-N 3.02Å; L147-L255 HydrophobicContact CB-CD1 4.35Å; L147-L255 HydrophobicContact CD1-CD1 4.22Å
148	Q	98.5	Very high	95.4	Very high	36 Å²	36	34.3 Å²	34.3	17%	0.168	21%	0.205	C	C	.	.	H	α-helix	trans	-56.5	-57	173.1	176.9	173.8	58.7	0	0	111.4	S144 A150 V151 E152 V165 V167	S144-Q148 PolarHBondContact O-N 2.98Å; Q148-A150 VanDerWaalsContact C-N 3.27Å; Q148-A150 PolarHBondContact O-N 2.79Å; Q148-V151 PolarHBondContact O-N 2.86Å; Q148-E152 VanDerWaalsContact CG-OE1 3.25Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.48Å; Q148-E152 WeakPolarHBondContact O-CG 3.23Å; Q148-E152 PolarHBondContact O-N 2.9Å; Q148-V165 HydrophobicContact CB-CB 3.98Å; Q148-V165 HydrophobicContact CB-CG1 3.93Å; Q148-V165 HydrophobicContact CG-CB 4.23Å; Q148-V165 PolarHBondContact NE2-O 2.81Å; Q148-V167 HydrophobicContact CB-CG2 3.87Å; Q148-V167 HydrophobicContact CG-CG2 4.45Å
149	A	98.3	Very high	95.5	Very high	7 Å²	7	34.1 Å²	34.1	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-32.1	178.6	0	0	0	0	0	113.2	L125 L129 L145 E153	L125-A149 HydrophobicContact CD1-CB 4.18Å; L125-A149 HydrophobicContact CD2-CB 4.09Å; L129-A149 HydrophobicContact CD1-CB 3.72Å; L145-A149 PolarHBondContact O-N 3.01Å; L145-A149 VanDerWaalsContact O-N 3.12Å; A149-E153 VanDerWaalsContact O-CB 3.27Å; A149-E153 WeakPolarHBondContact O-CB 3.31Å; A149-E153 WeakPolarHBondContact O-CG 3.43Å; A149-E153 PolarHBondContact O-N 3.01Å
150	A	98.4	Very high	95.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.3	-35.2	177.5	0	0	0	0	0	113	F117 L122 L125 L146 L147 Q148 S154	F117-A150 HydrophobicContact CD1-CB 3.9Å; F117-A150 HydrophobicContact CE1-CB 4.17Å; F117-A150 WeakPolarHBondContact CE1-O 3.49Å; L122-A150 HydrophobicContact CD2-CB 4.33Å; L125-A150 HydrophobicContact CD1-CB 3.61Å; L146-A150 WeakPolarHBondContact O-CB 3.43Å; L146-A150 PolarHBondContact O-N 3.21Å; L147-A150 PolarHBondContact O-N 3.14Å; Q148-A150 VanDerWaalsContact C-N 3.27Å; Q148-A150 PolarHBondContact O-N 2.79Å; A150-S154 WeakPolarHBondContact O-CA 3.42Å; A150-S154 WeakPolarHBondContact O-CB 3.27Å; A150-S154 PolarHBondContact O-N 2.65Å
151	V	98.3	Very high	95.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-74.2	-43.6	174.6	173	0	0	0	0	110.7	L71 F117 L147 Q148 E153 S154 L159 L163 V165	L71-V151 HydrophobicContact CD1-CG2 3.86Å; L71-V151 HydrophobicContact CD2-CG2 4.12Å; F117-V151 HydrophobicContact CE1-CG2 4.04Å; F117-V151 HydrophobicContact CZ-CG2 4.37Å; L147-V151 WeakPolarHBondContact O-CG2 3.44Å; L147-V151 PolarHBondContact O-N 3.02Å; Q148-V151 PolarHBondContact O-N 2.86Å; V151-E153 PolarHBondContact O-N 3.32Å; V151-S154 VanDerWaalsContact O-CB 3.26Å; V151-S154 WeakPolarHBondContact O-CB 3.3Å; V151-S154 PolarHBondContact O-N 3.26Å; V151-L159 HydrophobicContact CG1-CG 4.49Å; V151-L163 HydrophobicContact CG1-CB 4.35Å; V151-L163 HydrophobicContact CG1-CD2 4.16Å; V151-L163 HydrophobicContact CG1-CG 4.23Å; V151-L163 HydrophobicContact CG2-CD2 4.44Å; V151-V165 HydrophobicContact CB-CG2 3.78Å; V151-V165 HydrophobicContact CG1-CG2 4.06Å; V151-V165 HydrophobicContact CG2-CG2 3.76Å
152	E	96.3	Very high	95.4	Very high	114 Å²	114	38.9 Å²	38.9	53%	0.533	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-38.6	177.7	-71.8	172.4	-175.3	0	0	112.8	Q148	Q148-E152 VanDerWaalsContact CG-OE1 3.25Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.48Å; Q148-E152 WeakPolarHBondContact O-CG 3.23Å; Q148-E152 PolarHBondContact O-N 2.9Å
153	E	96.3	Very high	95.5	Very high	79 Å²	79	38 Å²	38	37%	0.369	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	13.7	177.8	-61.1	177	-169.4	0	0	113.6	K121 L125 R128 A149 V151 N155	K121-E153 IonicContact NZ-OE2 2.76Å; K121-E153 PolarHBondContact NZ-OE2 3.4Å; L125-E153 WeakPolarHBondContact CD2-OE2 3.44Å; R128-E153 IonicContact CZ-OE1 2.93Å; R128-E153 IonicContact CZ-OE2 2.94Å; R128-E153 IonicContact NH1-OE1 2.64Å; R128-E153 PolarHBondContact NH1-OE1 3.4Å; R128-E153 IonicContact NH2-OE1 3.89Å; R128-E153 PolarHBondContact NH2-OE1 2.87Å; R128-E153 IonicContact NH2-OE2 3.79Å; R128-E153 PolarHBondContact NH2-OE2 3.35Å; A149-E153 VanDerWaalsContact O-CB 3.27Å; A149-E153 WeakPolarHBondContact O-CB 3.31Å; A149-E153 WeakPolarHBondContact O-CG 3.43Å; A149-E153 PolarHBondContact O-N 3.01Å; V151-E153 PolarHBondContact O-N 3.32Å; E153-N155 PolarHBondContact O-N 3Å
154	S	96.3	Very high	95.5	Very high	13 Å²	13	38.4 Å²	38.4	9%	0.091	22%	0.215	C	C	.	.			trans	-65.9	133.7	-175.5	-167	0	0	0	0	111.7	A150 V151 I156 P160	A150-S154 WeakPolarHBondContact O-CA 3.42Å; A150-S154 WeakPolarHBondContact O-CB 3.27Å; A150-S154 PolarHBondContact O-N 2.65Å; V151-S154 VanDerWaalsContact O-CB 3.26Å; V151-S154 WeakPolarHBondContact O-CB 3.3Å; V151-S154 PolarHBondContact O-N 3.26Å; S154-I156 WeakPolarHBondContact OG-CB 3.43Å; S154-I156 WeakPolarHBondContact OG-CD1 3.42Å; S154-I156 WeakPolarHBondContact OG-CG1 3.5Å; S154-I156 PolarHBondContact OG-N 3.47Å; S154-P160 WeakPolarHBondContact O-CG 3.16Å
155	N	92.7	Very high	95.5	Very high	107 Å²	107	38.4 Å²	38.4	57%	0.572	22%	0.216	S	C	*	.			trans	-84.3	2.5	170.7	65.4	-11.7	0	0	0	112.9	A116 E153	A116-N155 WeakPolarHBondContact CB-OD1 3.17Å; E153-N155 PolarHBondContact O-N 3Å
156	I	93.3	Very high	95.5	Very high	25 Å²	25	36.6 Å²	36.6	13%	0.128	21%	0.206	C	C	.	.	S	Bend	trans	-68.5	125.3	174.3	-62.1	169.1	0	0	0	108.3	E108 A116 F117 S154 S158 L159	E108-I156 HydrophobicContact CB-CD1 3.9Å; E108-I156 HydrophobicContact CG-CD1 3.6Å; E108-I156 HydrophobicContact CG-CG1 3.84Å; A116-I156 HydrophobicContact CB-CD1 3.83Å; A116-I156 HydrophobicContact CB-CG1 3.89Å; F117-I156 HydrophobicContact CD2-CD1 4.23Å; F117-I156 HydrophobicContact CE2-CD1 3.29Å; F117-I156 HydrophobicContact CZ-CD1 3.67Å; S154-I156 WeakPolarHBondContact OG-CB 3.43Å; S154-I156 WeakPolarHBondContact OG-CD1 3.42Å; S154-I156 WeakPolarHBondContact OG-CG1 3.5Å; S154-I156 PolarHBondContact OG-N 3.47Å; I156-S158 PolarHBondContact O-N 2.78Å; I156-L159 HydrophobicContact CB-CB 3.98Å; I156-L159 HydrophobicContact CB-CD2 4.21Å; I156-L159 HydrophobicContact CD1-CD2 3.79Å; I156-L159 HydrophobicContact CG2-CB 3.91Å; I156-L159 HydrophobicContact CG2-CD2 4.41Å; I156-L159 PolarHBondContact O-N 2.97Å
157	P	87.5	Confident	95.5	Very high	110 Å²	110	37.2 Å²	37.2	71%	0.714	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	139	177.5	-27.9	35.7	0	0	0	112.4	L159	P157-L159 PolarHBondContact O-N 2.9Å
158	S	87.5	Confident	95.3	Very high	69 Å²	69	37.4 Å²	37.4	48%	0.483	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	-15.2	-175.5	74.8	0	0	0	0	118.4	I156 N161 T162	I156-S158 PolarHBondContact O-N 2.78Å; S158-N161 CarbonylContact O-C 3.51Å; S158-N161 VanDerWaalsContact O-CA 3.3Å; S158-N161 WeakPolarHBondContact O-CA 3.49Å; S158-N161 WeakPolarHBondContact O-CB 3.4Å; S158-N161 PolarHBondContact O-N 3.09Å; S158-T162 PolarHBondContact O-N 3.26Å; S158-T162 PolarHBondContact O-OG1 3.2Å
159	L	94.6	Very high	94.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.6	-45.9	-172	-177.9	66.3	0	0	0	114.5	L75 Y79 F117 V151 I156 P157 N161 T162 L163	L75-L159 HydrophobicContact CD2-CD1 3.8Å; L75-L159 HydrophobicContact CD2-CD2 4.02Å; Y79-L159 HydrophobicContact CE2-CD1 4.39Å; Y79-L159 WeakPolarHBondContact OH-CD1 3.37Å; F117-L159 HydrophobicContact CE2-CD2 4.14Å; F117-L159 HydrophobicContact CZ-CD2 3.56Å; V151-L159 HydrophobicContact CG1-CG 4.49Å; I156-L159 HydrophobicContact CB-CB 3.98Å; I156-L159 HydrophobicContact CB-CD2 4.21Å; I156-L159 HydrophobicContact CD1-CD2 3.79Å; I156-L159 HydrophobicContact CG2-CB 3.91Å; I156-L159 HydrophobicContact CG2-CD2 4.41Å; I156-L159 PolarHBondContact O-N 2.97Å; P157-L159 PolarHBondContact O-N 2.9Å; L159-N161 PolarHBondContact O-N 2.98Å; L159-T162 PolarHBondContact O-N 2.88Å; L159-L163 HydrophobicContact CD1-CB 3.52Å; L159-L163 HydrophobicContact CD1-CD2 3.88Å; L159-L163 HydrophobicContact CD1-CG 4.35Å; L159-L163 HydrophobicContact CG-CB 4.37Å; L159-L163 PolarHBondContact O-N 3.43Å
160	P	94.1	Very high	94	Very high	33 Å²	33	46.9 Å²	46.9	21%	0.214	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-16.3	174.9	-21.1	32.9	0	0	0	113.8	S154 K250	S154-P160 WeakPolarHBondContact O-CG 3.16Å; P160-K250 WeakPolarHBondContact O-CE 3.27Å; P160-K250 PolarHBondContact O-NZ 3.02Å
161	N	92.5	Very high	93.3	Very high	115 Å²	115	47.5 Å²	47.5	62%	0.615	26%	0.258	S	S	*	.	H	α-helix	trans	-98.5	-11.9	178	-62.9	-25.7	0	0	0	113.5	S158 L159 K250	S158-N161 CarbonylContact O-C 3.51Å; S158-N161 VanDerWaalsContact O-CA 3.3Å; S158-N161 WeakPolarHBondContact O-CA 3.49Å; S158-N161 WeakPolarHBondContact O-CB 3.4Å; S158-N161 PolarHBondContact O-N 3.09Å; L159-N161 PolarHBondContact O-N 2.98Å; N161-K250 WeakPolarHBondContact O-CG 3.25Å
162	T	94.4	Very high	93	Very high	41 Å²	41	48.3 Å²	48.3	25%	0.252	26%	0.263	S	S	.	.	H	α-helix	trans	-117.9	-21.2	-179.9	62.4	0	0	0	0	113.9	H78 S158 L159 K250 S251	H78-T162 PolarHBondContact CE1-O 2.85Å; H78-T162 WeakPolarHBondContact NE2-CB 3.4Å; H78-T162 PolarHBondContact NE2-OG1 2.96Å; S158-T162 PolarHBondContact O-N 3.26Å; S158-T162 PolarHBondContact O-OG1 3.2Å; L159-T162 PolarHBondContact O-N 2.88Å; T162-K250 CarbonylContact O-C 3.52Å; T162-K250 VanDerWaalsContact O-CA 3.32Å; T162-K250 WeakPolarHBondContact O-CA 2.95Å; T162-S251 PolarHBondContact O-N 2.76Å
163	L	96.7	Very high	92.8	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.4	176.9	-175.1	67.4	0	0	0	110.7	T74 L75 V151 L159 S251 L253 Y348	T74-L163 HydrophobicContact CG2-CD1 4.37Å; T74-L163 HydrophobicContact CG2-CD2 4.44Å; L75-L163 HydrophobicContact CD2-CD2 3.87Å; V151-L163 HydrophobicContact CG1-CB 4.35Å; V151-L163 HydrophobicContact CG1-CD2 4.16Å; V151-L163 HydrophobicContact CG1-CG 4.23Å; V151-L163 HydrophobicContact CG2-CD2 4.44Å; L159-L163 HydrophobicContact CD1-CB 3.52Å; L159-L163 HydrophobicContact CD1-CD2 3.88Å; L159-L163 HydrophobicContact CD1-CG 4.35Å; L159-L163 HydrophobicContact CG-CB 4.37Å; L159-L163 PolarHBondContact O-N 3.43Å; L163-S251 CarbonylContact C-O 3.56Å; L163-S251 WeakPolarHBondContact CA-O 3.47Å; L163-L253 HydrophobicContact CD1-CB 4.47Å; L163-Y348 HydrophobicContact CD1-CD2 4.39Å; L163-Y348 HydrophobicContact CD1-CE2 3.91Å
164	A	97.8	Very high	92.6	Very high	9 Å²	9	39.5 Å²	39.5	7%	0.074	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	156.2	167	0	0	0	0	0	110.3	L181 K250 S251 V252 L253	A164-L181 HydrophobicContact CB-CB 4.02Å; A164-L181 HydrophobicContact CB-CD2 4.29Å; A164-K250 HydrophobicContact CB-CB 4.38Å; A164-K250 HydrophobicContact CB-CD 4.2Å; A164-S251 PolarHBondContact N-O 3.04Å; A164-V252 HydrophobicContact CB-CG2 4.48Å; A164-V252 WeakPolarHBondContact O-CA 3.32Å; A164-L253 PolarHBondContact O-N 2.74Å
165	V	98.4	Very high	92.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.3	173.3	-175	0	0	0	0	108.9	Q148 V151 V167 L253 L255	Q148-V165 HydrophobicContact CB-CB 3.98Å; Q148-V165 HydrophobicContact CB-CG1 3.93Å; Q148-V165 HydrophobicContact CG-CB 4.23Å; Q148-V165 PolarHBondContact NE2-O 2.81Å; V151-V165 HydrophobicContact CB-CG2 3.78Å; V151-V165 HydrophobicContact CG1-CG2 4.06Å; V151-V165 HydrophobicContact CG2-CG2 3.76Å; V165-V167 HydrophobicContact CG1-CG2 4.28Å; V165-L253 CarbonylContact C-O 3.58Å; V165-L253 WeakPolarHBondContact CA-O 3.29Å; V165-L253 HydrophobicContact CG1-CD2 4.36Å; V165-L253 HydrophobicContact CG1-CG 4.39Å; V165-L253 HydrophobicContact CG2-CB 4.34Å; V165-L253 HydrophobicContact CG2-CD2 4.31Å; V165-L255 HydrophobicContact CG1-CD1 3.64Å; V165-L255 HydrophobicContact CG1-CG 4.04Å
166	Y	98	Very high	92.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	100.7	176.3	-179.2	-150.2	0	0	0	110.4	V168 L173 L174 E177 L178 L181 L253 V254 L255	Y166-V168 HydrophobicContact CD1-CG2 3.9Å; Y166-V168 HydrophobicContact CE1-CG2 3.63Å; Y166-V168 HydrophobicContact CE2-CG2 4.42Å; Y166-V168 HydrophobicContact CG-CG2 4.41Å; Y166-V168 PolarHBondContact O-N 3.5Å; Y166-L173 HydrophobicContact CE1-CD2 4.44Å; Y166-L173 HydrophobicContact CE1-CG 4.12Å; Y166-L174 PolarHBondContact OH-N 3.38Å; Y166-E177 HydrophobicContact CE1-CB 4.39Å; Y166-E177 HydrophobicContact CE2-CB 3.88Å; Y166-E177 WeakPolarHBondContact CE2-OE2 3.35Å; Y166-E177 VanDerWaalsContact CZ-OE2 3.29Å; Y166-E177 PolarHBondContact OH-OE2 2.92Å; Y166-L178 HydrophobicContact CD1-CB 4.05Å; Y166-L178 HydrophobicContact CD1-CD1 4.46Å; Y166-L178 HydrophobicContact CD1-CG 4.19Å; Y166-L178 HydrophobicContact CE1-CB 4.2Å; Y166-L181 HydrophobicContact CD2-CD1 4.06Å; Y166-L181 HydrophobicContact CG-CD1 4.01Å; Y166-L253 PolarHBondContact N-O 2.69Å; Y166-V254 HydrophobicContact CD1-CG1 3.99Å; Y166-V254 HydrophobicContact CD1-CG2 4.37Å; Y166-V254 CarbonylContact O-C 3.41Å; Y166-V254 WeakPolarHBondContact O-CA 3.34Å; Y166-L255 PolarHBondContact O-N 3.17Å
167	V	97.5	Very high	92.5	Very high	13 Å²	13	38.2 Å²	38.2	8%	0.079	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	104.7	173	-174.9	0	0	0	0	109.5	L145 Q148 V165 L255	L145-V167 HydrophobicContact CD2-CB 4.18Å; L145-V167 HydrophobicContact CD2-CG1 3.97Å; L145-V167 HydrophobicContact CD2-CG2 4.27Å; L145-V167 HydrophobicContact CG-CG1 4.32Å; Q148-V167 HydrophobicContact CB-CG2 3.87Å; Q148-V167 HydrophobicContact CG-CG2 4.45Å; V165-V167 HydrophobicContact CG1-CG2 4.28Å; V167-L255 HydrophobicContact CG2-CB 4.48Å; V167-L255 HydrophobicContact CG2-CD1 4.42Å
168	V	95	Very high	92.8	Very high	5 Å²	5	33 Å²	33	3%	0.03	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.8	-179.7	170.9	0	0	0	0	110.3	Y166 V172 L173 V254 L255 V256	Y166-V168 HydrophobicContact CD1-CG2 3.9Å; Y166-V168 HydrophobicContact CE1-CG2 3.63Å; Y166-V168 HydrophobicContact CE2-CG2 4.42Å; Y166-V168 HydrophobicContact CG-CG2 4.41Å; Y166-V168 PolarHBondContact O-N 3.5Å; V168-V172 VanDerWaalsContact CG1-C 3.5Å; V168-V172 WeakPolarHBondContact CG1-O 3.3Å; V168-L173 HydrophobicContact CG1-CB 4.3Å; V168-L173 HydrophobicContact CG2-CB 4.16Å; V168-L173 HydrophobicContact CG2-CG 4.08Å; V168-V254 HydrophobicContact CG2-CG1 3.62Å; V168-L255 PolarHBondContact N-O 2.92Å; V168-V256 HydrophobicContact CB-CG1 4.42Å; V168-V256 HydrophobicContact CB-CG2 4.25Å; V168-V256 HydrophobicContact CG1-CG1 4.21Å; V168-V256 HydrophobicContact CG2-CG2 4.09Å
169	R	84.4	Confident	93.1	Very high	129 Å²	129	30.3 Å²	30.3	49%	0.487	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-109.2	143.6	-176.5	-60.9	179.6	-174.5	-104.6	-2.9	110.7	G171 V172	R169-G171 PolarHBondContact O-N 2.95Å; R169-G171 VanDerWaalsContact O-N 3.1Å; R169-V172 PolarHBondContact O-N 3.28Å
170	D	83.7	Confident	93.1	Very high	114 Å²	114	31 Å²	31	61%	0.61	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	18.9	179	-37.1	-46.1	0	0	0	115.2	V172 K387	D170-V172 PolarHBondContact O-N 3.44Å; D170-K387 IonicContact OD2-NZ 2.68Å; D170-K387 PolarHBondContact OD2-NZ 3.06Å
171	G	85	Confident	93.1	Very high	12 Å²	12	30.9 Å²	30.9	12%	0.124	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	20.7	-173.4	0	0	0	0	0	114.2	R169 F378 T379	R169-G171 PolarHBondContact O-N 2.95Å; R169-G171 VanDerWaalsContact O-N 3.1Å; G171-F378 CarbonylContact O-C 3.57Å; G171-F378 WeakPolarHBondContact O-CA 3.29Å; G171-F378 VanDerWaalsContact O-CB 3.28Å; G171-F378 WeakPolarHBondContact O-CB 3.5Å; G171-T379 PolarHBondContact O-N 2.88Å
172	V	90.5	Very high	93.2	Very high	19 Å²	19	25.4 Å²	25.4	12%	0.115	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	103.7	179.5	-176.8	0	0	0	0	109.9	V168 R169 D170 L174 T379 L381 K387	V168-V172 VanDerWaalsContact CG1-C 3.5Å; V168-V172 WeakPolarHBondContact CG1-O 3.3Å; R169-V172 PolarHBondContact O-N 3.28Å; D170-V172 PolarHBondContact O-N 3.44Å; V172-L174 HydrophobicContact CG1-CD2 3.82Å; V172-T379 CarbonylContact C-O 3.49Å; V172-T379 WeakPolarHBondContact CA-O 3.44Å; V172-L381 HydrophobicContact CG1-CD1 3.63Å; V172-L381 HydrophobicContact CG1-CG 4.01Å; V172-K387 HydrophobicContact CB-CD 4.28Å; V172-K387 HydrophobicContact CG1-CD 4Å; V172-K387 HydrophobicContact CG1-CG 4.3Å
173	L	92.4	Very high	93.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121	175	-170.9	164.3	0	0	0	108.7	Y166 V168 L178 V254 F358 F378 T379 I380 L381	Y166-L173 HydrophobicContact CE1-CD2 4.44Å; Y166-L173 HydrophobicContact CE1-CG 4.12Å; V168-L173 HydrophobicContact CG1-CB 4.3Å; V168-L173 HydrophobicContact CG2-CB 4.16Å; V168-L173 HydrophobicContact CG2-CG 4.08Å; L173-L178 HydrophobicContact CD2-CD1 4.14Å; L173-V254 HydrophobicContact CD1-CG1 3.95Å; L173-F358 HydrophobicContact CD1-CE1 3.88Å; L173-F358 HydrophobicContact CD1-CZ 3.93Å; L173-F378 HydrophobicContact CB-CD2 4.31Å; L173-F378 HydrophobicContact CD1-CE2 4.08Å; L173-T379 PolarHBondContact N-O 2.86Å; L173-I380 HydrophobicContact CB-CG1 4.46Å; L173-I380 HydrophobicContact CD2-CG2 4.49Å; L173-I380 WeakPolarHBondContact O-CA 3.48Å; L173-L381 PolarHBondContact O-N 3.4Å
174	L	93.3	Very high	92.8	Very high	7 Å²	7	25.7 Å²	25.7	4%	0.037	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.3	175.9	-57.2	-176.2	0	0	0	109.9	Y166 V172 E177 L178 L381 A384 K387	Y166-L174 PolarHBondContact OH-N 3.38Å; V172-L174 HydrophobicContact CG1-CD2 3.82Å; L174-E177 HydrophobicContact CB-CB 4.11Å; L174-E177 HydrophobicContact CB-CG 3.91Å; L174-E177 HydrophobicContact CD1-CG 4.07Å; L174-E177 PolarHBondContact O-N 3.34Å; L174-L178 PolarHBondContact O-N 2.73Å; L174-L381 WeakPolarHBondContact CA-O 3.42Å; L174-L381 HydrophobicContact CD2-CB 3.95Å; L174-A384 HydrophobicContact CD1-CB 3.9Å; L174-K387 HydrophobicContact CD2-CB 4.31Å; L174-K387 HydrophobicContact CD2-CD 4.49Å
175	I	93.4	Very high	92.2	Very high	31 Å²	31	28.3 Å²	28.3	16%	0.159	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-46.8	-179.5	-62.2	170.9	0	0	0	109.6	E177 L178 E179 L359 I380 L381 S382	I175-E177 VanDerWaalsContact C-N 3.27Å; I175-E177 PolarHBondContact O-N 2.81Å; I175-L178 WeakPolarHBondContact O-CB 3.36Å; I175-L178 PolarHBondContact O-N 3.5Å; I175-E179 HydrophobicContact CG2-CG 4.11Å; I175-E179 PolarHBondContact O-N 2.75Å; I175-L359 HydrophobicContact CD1-CD1 3.92Å; I175-L359 HydrophobicContact CD1-CD2 4.11Å; I175-L359 HydrophobicContact CG1-CD1 4.07Å; I175-L359 HydrophobicContact CG1-CD2 3.89Å; I175-L359 HydrophobicContact CG2-CD1 4.18Å; I175-I380 HydrophobicContact CD1-CG2 3.94Å; I175-I380 HydrophobicContact CG1-CG2 3.95Å; I175-L381 PolarHBondContact N-O 3.41Å; I175-S382 PolarHBondContact N-O 3.12Å; I175-S382 VanDerWaalsContact N-O 3.14Å
176	D	92.5	Very high	90.6	Very high	41 Å²	41	32.8 Å²	32.8	22%	0.219	17%	0.169	C	C	.	.	H	α-helix	trans	-56	-39.4	179.2	-61	-8.5	0	0	0	112.5	V180 F242 S382 S383	D176-V180 VanDerWaalsContact O-CB 3.3Å; D176-V180 WeakPolarHBondContact O-CB 3.27Å; D176-V180 WeakPolarHBondContact O-CG2 3.26Å; D176-V180 PolarHBondContact O-N 3.15Å; D176-F242 HydrophobicContact CB-CE2 4.09Å; D176-F242 HydrophobicContact CB-CZ 4.04Å; D176-S382 PolarHBondContact N-O 2.91Å; D176-S383 WeakPolarHBondContact OD2-CA 3.2Å; D176-S383 WeakPolarHBondContact OD2-CB 3.4Å
177	E	93.3	Very high	88.5	Confident	46 Å²	46	38.5 Å²	38.5	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-69.7	-34.1	179.1	-70.2	-163	120.6	0	0	112.2	Y166 L174 I175 L181 R187	Y166-E177 HydrophobicContact CE1-CB 4.39Å; Y166-E177 HydrophobicContact CE2-CB 3.88Å; Y166-E177 WeakPolarHBondContact CE2-OE2 3.35Å; Y166-E177 VanDerWaalsContact CZ-OE2 3.29Å; Y166-E177 PolarHBondContact OH-OE2 2.92Å; L174-E177 HydrophobicContact CB-CB 4.11Å; L174-E177 HydrophobicContact CB-CG 3.91Å; L174-E177 HydrophobicContact CD1-CG 4.07Å; L174-E177 PolarHBondContact O-N 3.34Å; I175-E177 VanDerWaalsContact C-N 3.27Å; I175-E177 PolarHBondContact O-N 2.81Å; E177-L181 VanDerWaalsContact O-CG 3.29Å; E177-L181 WeakPolarHBondContact O-CG 3.34Å; E177-L181 PolarHBondContact O-N 3.35Å; E177-R187 VanDerWaalsContact CD-NH2 3.26Å; E177-R187 IonicContact OE1-CZ 2.71Å; E177-R187 IonicContact OE1-NH1 3.99Å; E177-R187 PolarHBondContact OE1-NH1 2.75Å; E177-R187 IonicContact OE1-NH2 3.19Å; E177-R187 PolarHBondContact OE1-NH2 2.78Å; E177-R187 IonicContact OE2-NH2 2.69Å
178	L	94.4	Very high	86	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-72	-44.8	176.4	-162.3	170.3	0	0	0	109.9	Y166 L173 L174 I175 L181 G182 W248 V252 V254 L355 F358	Y166-L178 HydrophobicContact CD1-CB 4.05Å; Y166-L178 HydrophobicContact CD1-CD1 4.46Å; Y166-L178 HydrophobicContact CD1-CG 4.19Å; Y166-L178 HydrophobicContact CE1-CB 4.2Å; L173-L178 HydrophobicContact CD2-CD1 4.14Å; L174-L178 PolarHBondContact O-N 2.73Å; I175-L178 WeakPolarHBondContact O-CB 3.36Å; I175-L178 PolarHBondContact O-N 3.5Å; L178-L181 PolarHBondContact O-N 2.77Å; L178-G182 PolarHBondContact O-N 3.32Å; L178-W248 HydrophobicContact CD2-CH2 3.67Å; L178-W248 HydrophobicContact CD2-CZ2 4.31Å; L178-V252 HydrophobicContact CD2-CB 4.21Å; L178-V252 HydrophobicContact CD2-CG1 4.31Å; L178-V252 HydrophobicContact CD2-CG2 4.15Å; L178-V252 HydrophobicContact CG-CG1 4.23Å; L178-V254 HydrophobicContact CD1-CG2 3.67Å; L178-V254 HydrophobicContact CG-CG2 4.16Å; L178-L355 HydrophobicContact CD1-CD1 3.79Å; L178-L355 HydrophobicContact CD2-CD1 3.69Å; L178-L355 HydrophobicContact CD2-CD2 4.26Å; L178-L355 HydrophobicContact CG-CD1 4.34Å; L178-F358 HydrophobicContact CD1-CE1 4.33Å
179	E	94.3	Very high	83.3	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.065	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-47	175.9	-72.8	-170.2	144.4	0	0	112.2	I175 L181 G182 Y183 F242 W248 R352 L355	I175-E179 HydrophobicContact CG2-CG 4.11Å; I175-E179 PolarHBondContact O-N 2.75Å; E179-L181 PolarHBondContact O-N 2.85Å; E179-G182 PolarHBondContact O-N 3.13Å; E179-Y183 HydrophobicContact CB-CD2 4.09Å; E179-Y183 HydrophobicContact CB-CE2 3.91Å; E179-Y183 HydrophobicContact CG-CE2 4.39Å; E179-Y183 WeakPolarHBondContact O-CD2 3.4Å; E179-Y183 PolarHBondContact O-N 2.79Å; E179-F242 HydrophobicContact CB-CE1 3.87Å; E179-F242 HydrophobicContact CB-CZ 4.13Å; E179-W248 HydrophobicContact CG-CZ3 4.41Å; E179-R352 IonicContact OE1-CZ 3.67Å; E179-R352 IonicContact OE1-NE 2.67Å; E179-R352 PolarHBondContact OE1-NE 3.27Å; E179-R352 IonicContact OE1-NH1 2.76Å; E179-R352 IonicContact OE1-NH2 2.83Å; E179-R352 PolarHBondContact OE1-NH2 3.36Å; E179-L355 HydrophobicContact CG-CD2 3.55Å
180	V	93.3	Very high	80.8	Confident	13 Å²	13	49.6 Å²	49.6	8%	0.079	25%	0.251	C	S	.	.	H	α-helix	trans	-53.3	-40.7	173.9	160.2	0	0	0	0	111.9	D176 G184 M185 F242	D176-V180 VanDerWaalsContact O-CB 3.3Å; D176-V180 WeakPolarHBondContact O-CB 3.27Å; D176-V180 WeakPolarHBondContact O-CG2 3.26Å; D176-V180 PolarHBondContact O-N 3.15Å; V180-G184 PolarHBondContact O-N 2.85Å; V180-M185 HydrophobicContact CG1-CB 4.14Å; V180-M185 WeakPolarHBondContact CG1-O 3.46Å; V180-M185 PolarHBondContact O-N 3.08Å; V180-F242 HydrophobicContact CG2-CE1 4.28Å; V180-F242 HydrophobicContact CG2-CZ 4.21Å
181	L	95.1	Very high	78.3	Confident	31 Å²	31	49.3 Å²	49.3	16%	0.162	26%	0.258	C	S	.	.	H	α-helix	trans	-71	-40.7	175.8	-70	170.7	0	0	0	112.3	A164 Y166 E177 L178 E179 G184 V252	A164-L181 HydrophobicContact CB-CB 4.02Å; A164-L181 HydrophobicContact CB-CD2 4.29Å; Y166-L181 HydrophobicContact CD2-CD1 4.06Å; Y166-L181 HydrophobicContact CG-CD1 4.01Å; E177-L181 VanDerWaalsContact O-CG 3.29Å; E177-L181 WeakPolarHBondContact O-CG 3.34Å; E177-L181 PolarHBondContact O-N 3.35Å; L178-L181 PolarHBondContact O-N 2.77Å; E179-L181 PolarHBondContact O-N 2.85Å; L181-G184 WeakPolarHBondContact O-CA 3.15Å; L181-G184 PolarHBondContact O-N 3Å; L181-V252 HydrophobicContact CB-CG2 4.26Å
182	G	94.3	Very high	75.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-40.8	177.9	0	0	0	0	0	113.9	L178 E179 G184 V249 K250	L178-G182 PolarHBondContact O-N 3.32Å; E179-G182 PolarHBondContact O-N 3.13Å; G182-G184 PolarHBondContact O-N 2.94Å; G182-V249 WeakPolarHBondContact O-CG2 3.42Å; G182-V249 PolarHBondContact O-N 3Å; G182-K250 WeakPolarHBondContact CA-O 3.4Å; G182-K250 PolarHBondContact O-N 2.83Å
183	Y	93.5	Very high	72.7	Confident	29 Å²	29	62.1 Å²	62.1	11%	0.114	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	1.6	170.7	-62.9	-59.3	0	0	0	113.2	E179 M185 F242 L246 W248 V249 R352	E179-Y183 HydrophobicContact CB-CD2 4.09Å; E179-Y183 HydrophobicContact CB-CE2 3.91Å; E179-Y183 HydrophobicContact CG-CE2 4.39Å; E179-Y183 WeakPolarHBondContact O-CD2 3.4Å; E179-Y183 PolarHBondContact O-N 2.79Å; Y183-M185 PolarHBondContact O-N 2.96Å; Y183-F242 HydrophobicContact CD2-CD1 4.4Å; Y183-F242 HydrophobicContact CD2-CE1 4.33Å; Y183-F242 HydrophobicContact CE2-CD1 4.19Å; Y183-F242 HydrophobicContact CE2-CE1 4.38Å; Y183-L246 HydrophobicContact CD1-CB 3.86Å; Y183-L246 HydrophobicContact CE1-CB 4.14Å; Y183-L246 WeakPolarHBondContact CE1-O 3.49Å; Y183-L246 HydrophobicContact CG-CB 4.43Å; Y183-W248 HydrophobicContact CE1-CB 4.5Å; Y183-W248 HydrophobicContact CE1-CE3 4.34Å; Y183-V249 WeakPolarHBondContact O-CG2 3.32Å; Y183-R352 WeakPolarHBondContact OH-CD 3.42Å; Y183-R352 PolarHBondContact OH-NE 3.16Å
184	G	88.8	Confident	69.6	Low	21 Å²	21	64.8 Å²	64.8	22%	0.216	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	66	16.7	176.3	0	0	0	0	0	114.5	V180 L181 G182 N186	V180-G184 PolarHBondContact O-N 2.85Å; L181-G184 WeakPolarHBondContact O-CA 3.15Å; L181-G184 PolarHBondContact O-N 3Å; G182-G184 PolarHBondContact O-N 2.94Å; G184-N186 PolarHBondContact O-N 2.74Å
185	M	84.3	Confident	66.7	Low	64 Å²	64	73.5 Å²	73.5	32%	0.315	39%	0.394	S	S	.	.			trans	-73.9	121.8	-175.5	-63.9	175.1	75	0	0	110.3	V180 Y183 R187 L246	V180-M185 HydrophobicContact CG1-CB 4.14Å; V180-M185 WeakPolarHBondContact CG1-O 3.46Å; V180-M185 PolarHBondContact O-N 3.08Å; Y183-M185 PolarHBondContact O-N 2.96Å; M185-R187 PolarHBondContact O-N 2.68Å; M185-L246 HydrophobicContact SD-CD1 4.12Å
186	N	65.1	Low	63.7	Low	95 Å²	95	79.2 Å²	79.2	51%	0.508	42%	0.424	S	S	.	.			trans	-71	125.7	174.9	-73.5	-56.8	0	0	0	110.4	G184 K188 Q189	G184-N186 PolarHBondContact O-N 2.74Å; N186-K188 PolarHBondContact O-N 3.45Å; N186-Q189 HydrophobicContact CB-CB 4.33Å; N186-Q189 HydrophobicContact CB-CG 4.16Å; N186-Q189 PolarHBondContact ND2-OE1 2.75Å; N186-Q189 PolarHBondContact O-N 2.97Å
187	R	53.8	Low	60.7	Low	125 Å²	125	85.2 Å²	85.2	47%	0.472	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-10.6	172.7	-66.6	-172.5	-176.5	-143.5	-3.3	115	E177 M185	E177-R187 VanDerWaalsContact CD-NH2 3.26Å; E177-R187 IonicContact OE1-CZ 2.71Å; E177-R187 IonicContact OE1-NH1 3.99Å; E177-R187 PolarHBondContact OE1-NH1 2.75Å; E177-R187 IonicContact OE1-NH2 3.19Å; E177-R187 PolarHBondContact OE1-NH2 2.78Å; E177-R187 IonicContact OE2-NH2 2.69Å; M185-R187 PolarHBondContact O-N 2.68Å
188	K	46.2	Very low	57.8	Low	190 Å²	190	92.5 Å²	92.5	83%	0.826	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-10.6	179.1	-65.1	-175.3	177.5	-179.4	0	114.8	N186	N186-K188 PolarHBondContact O-N 3.45Å
189	Q	38.3	Very low	54.7	Low	130 Å²	130	102 Å²	102	61%	0.607	53%	0.526	S	S	*	.	S	Bend	trans	-95	-8	-173.5	-81.6	177.6	-42.4	0	0	114.6	N186 S191	N186-Q189 HydrophobicContact CB-CB 4.33Å; N186-Q189 HydrophobicContact CB-CG 4.16Å; N186-Q189 PolarHBondContact ND2-OE1 2.75Å; N186-Q189 PolarHBondContact O-N 2.97Å; Q189-S191 PolarHBondContact O-N 2.98Å; Q189-S191 VanDerWaalsContact O-N 3.07Å
190	S	32.3	Very low	51.8	Low	60 Å²	60	106.4 Å²	106.4	42%	0.42	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73	8.7	-179.4	42.1	0	0	0	0	115.6	H240	S190-H240 WeakPolarHBondContact CB-NE2 3.25Å
191	S	31	Very low	48.7	Very low	108 Å²	108	114.6 Å²	114.6	76%	0.755	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	0.8	-179.8	57.7	0	0	0	0	115.6	Q189	Q189-S191 PolarHBondContact O-N 2.98Å; Q189-S191 VanDerWaalsContact O-N 3.07Å
192	S	28.6	Very low	45.5	Very low	95 Å²	95	120.8 Å²	120.8	66%	0.664	63%	0.629	S	S	*	*			trans	-147.7	82.1	173.2	56.1	0	0	0	0	113.8	G194	S192-G194 PolarHBondContact O-N 3.23Å
193	M	29	Very low	42.6	Very low	204 Å²	204	125 Å²	125	100%	1.005	66%	0.659	S	S	*	*			trans	-75.5	97.4	155.8	-87.6	-118.2	-68.1	0	0	109.1
194	G	27.6	Very low	39.5	Very low	57 Å²	57	128.9 Å²	128.9	59%	0.588	69%	0.69	S	S	*	*			trans	179.3	116.1	173.5	0	0	0	0	0	112.9	S192	S192-G194 PolarHBondContact O-N 3.23Å
195	Q	31.3	Very low	36.8	Very low	189 Å²	189	132.6 Å²	132.6	88%	0.883	71%	0.708	S	S	*	*			trans	70.7	141.1	172.2	-50.2	179	11.8	0	0	115
196	L	30.3	Very low	34.7	Very low	152 Å²	152	138.9 Å²	138.9	80%	0.796	74%	0.737	S	S	*	*			cis	-155.6	164.2	-11.9	-126.2	157	0	0	0	108.9
197	H	30.4	Very low	33.5	Very low	166 Å²	166	141.2 Å²	141.2	77%	0.769	75%	0.745	S	S	*	*			trans	-76.3	149.5	-177.6	-69.6	45.8	0	0	0	113.2
198	Q	31.3	Very low	32.4	Very low	199 Å²	199	141.7 Å²	141.7	93%	0.93	76%	0.756	S	S	*	*				-154.1	145.3	129.9	-115.2	173.8	35.5	0	0	112.8
199	K	29.2	Very low	31.7	Very low	200 Å²	200	138.1 Å²	138.1	87%	0.87	75%	0.745	S	S	*	*			trans	-97.4	142.1	-177.6	-68.7	172.6	175.6	171.8	0	110.7
200	A	34.4	Very low	31.5	Very low	107 Å²	107	140.2 Å²	140.2	88%	0.884	76%	0.759	S	S	*	*			trans	-135	149.8	151.4	0	0	0	0	0	108.8
201	K	29.1	Very low	31.4	Very low	184 Å²	184	140.5 Å²	140.5	80%	0.8	77%	0.771	S	S	*	*			trans	-127.1	139.6	-161.3	-140.6	-165.9	-175.5	-171.7	0	110.5
202	M	27.7	Very low	31.4	Very low	161 Å²	161	146.3 Å²	146.3	79%	0.793	78%	0.776	S	S	*	*			trans	67.6	153.5	159.6	-70.9	177.7	71.9	0	0	117.2
203	S	31.8	Very low	31.7	Very low	89 Å²	89	149.2 Å²	149.2	62%	0.622	78%	0.78	S	S	*	*			cis	-151.4	164.2	-5.6	33.9	0	0	0	0	112.6
204	S	29.4	Very low	31.8	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	78%	0.777	S	S	*	*	S	Bend	trans	-19.8	139.9	164.8	-125.4	0	0	0	0	118.1
205	V	32.1	Very low	31.8	Very low	99 Å²	99	159.9 Å²	159.9	60%	0.6	79%	0.791	S	S	*	*			trans	80.1	35.3	155	-165.8	0	0	0	0	116.9	Q207	V205-Q207 HydrophobicContact CG1-CG 3.7Å; V205-Q207 WeakPolarHBondContact O-CB 3.45Å; V205-Q207 WeakPolarHBondContact O-CG 3.44Å
206	E	39.6	Very low	31.7	Very low	196 Å²	196	156.4 Å²	156.4	92%	0.916	79%	0.786	S	S	*	*			trans	-102.5	43.5	159.9	-65.8	-172.2	140.6	0	0	111.5
207	Q	40.5	Very low	31.8	Very low	144 Å²	144	155.6 Å²	155.6	67%	0.673	79%	0.788	S	S	*	*				62.1	95.7	101.8	-88.5	-172.6	13.5	0	0	115.9	V205	V205-Q207 HydrophobicContact CG1-CG 3.7Å; V205-Q207 WeakPolarHBondContact O-CB 3.45Å; V205-Q207 WeakPolarHBondContact O-CG 3.44Å
208	L	31.1	Very low	31.7	Very low	136 Å²	136	155.2 Å²	155.2	71%	0.712	79%	0.791	S	S	*	*	S	Bend	trans	54.2	78.1	130.8	-70.9	161	0	0	0	118.3
209	I	31.6	Very low	31.9	Very low	115 Å²	115	151.7 Å²	151.7	59%	0.59	79%	0.786	S	S	*	*			trans	76.7	138	146.5	-47.7	156.4	0	0	0	114.3
210	I	33.5	Very low	31.9	Very low	174 Å²	174	146.8 Å²	146.8	89%	0.892	78%	0.782	S	S	*	*			trans	82.7	130	-175	-47.6	156.2	0	0	0	112.3
211	G	29.5	Very low	31.9	Very low	66 Å²	66	150.3 Å²	150.3	68%	0.68	78%	0.784	S	S	*	*			cis	164.5	-175	-6.1	0	0	0	0	0	113.5
212	R	31.7	Very low	32.1	Very low	229 Å²	229	144.9 Å²	144.9	86%	0.864	78%	0.781	S	S	*	*			trans	74.5	98.1	172.8	-86.1	-179.8	160.6	143.8	-3.5	120
213	Q	34.1	Very low	32.1	Very low	157 Å²	157	149.4 Å²	149.4	73%	0.734	79%	0.789	S	S	*	*				48.8	127.9	115.7	-66.8	178.6	-23.7	0	0	120.8
214	R	30.9	Very low	32.1	Very low	251 Å²	251	151.1 Å²	151.1	95%	0.947	80%	0.801	S	S	*	*				-165	163.8	108.7	-99.9	157.5	-170.1	-155	2.5	112.3
215	R	27.6	Very low	32.1	Very low	233 Å²	233	155.2 Å²	155.2	88%	0.879	81%	0.805	S	S	*	*			trans	-120	152.7	-172.1	-73.7	179.2	-91.3	-171.4	-8.4	111.3
216	C	29.6	Very low	32.1	Very low	117 Å²	117	155.4 Å²	155.4	79%	0.791	81%	0.811	S	S	*	*			trans	-167.1	111.9	147.4	-93.6	0	0	0	0	109.2
217	T	32.7	Very low	31.6	Very low	135 Å²	135	155 Å²	155	83%	0.828	81%	0.809	S	S	*	*				91	112.2	93.4	53.9	0	0	0	0	115.8
218	D	28.1	Very low	31.1	Very low	157 Å²	157	155.1 Å²	155.1	84%	0.84	81%	0.811	S	S	*	*			trans	-79.2	170.5	169.2	-62.9	-56	0	0	0	112.8
219	P	35.5	Very low	30.9	Very low	126 Å²	126	155.4 Å²	155.4	82%	0.818	81%	0.813	S	S	*	*				-150.3	137.1	89.2	36.4	-16.8	0	0	0	119
220	A	30	Very low	30.9	Very low	96 Å²	96	155.8 Å²	155.8	79%	0.793	82%	0.816	S	S	*	*			trans	31.2	111.5	136.9	0	0	0	0	0	123.9
221	I	34.6	Very low	30.7	Very low	181 Å²	181	157.9 Å²	157.9	93%	0.928	81%	0.813	S	S	*	*			trans	-144.8	142.5	140.9	-54	-178.2	0	0	0	106.5
222	G	32.1	Very low	30.7	Very low	70 Å²	70	160.4 Å²	160.4	72%	0.722	81%	0.81	S	S	*	*			cis	-163.9	-131.9	1.5	0	0	0	0	0	112
223	R	27.4	Very low	30.8	Very low	256 Å²	256	156.2 Å²	156.2	97%	0.966	81%	0.805	S	S	*	*			trans	-139.5	137.8	171.8	-77.3	177.3	171.4	165	-2.9	112.4
224	S	32.1	Very low	30.7	Very low	126 Å²	126	156.1 Å²	156.1	88%	0.881	81%	0.809	S	S	*	*			trans	-164.6	158.9	131.4	-161.9	0	0	0	0	111.8
225	K	29	Very low	30.8	Very low	196 Å²	196	149.2 Å²	149.2	85%	0.852	79%	0.791	S	S	*	*			trans	-98.1	135.5	179.4	-63.8	172.1	175.3	177.7	0	110.8
226	S	32.4	Very low	31.1	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	78%	0.781	S	S	*	*			trans	-166.9	135.9	151.8	53.3	0	0	0	0	110.8	M228	S226-M228 PolarHBondContact O-N 2.86Å; S226-M228 VanDerWaalsContact O-N 3.09Å
227	E	28.9	Very low	31.2	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	77%	0.767	S	S	*	*			trans	-63.7	107.4	172.4	-66.1	166.1	122.8	0	0	109.7	N229	E227-N229 VanDerWaalsContact C-N 3.32Å; E227-N229 PolarHBondContact O-N 3.17Å
228	M	30.2	Very low	31.5	Very low	146 Å²	146	137 Å²	137	72%	0.719	75%	0.746	S	S	*	*			trans	-79.3	85.6	177.7	-123.9	-175.7	-65.9	0	0	110.3	S226 L230	S226-M228 PolarHBondContact O-N 2.86Å; S226-M228 VanDerWaalsContact O-N 3.09Å; M228-L230 HydrophobicContact CG-CD2 4.39Å; M228-L230 PolarHBondContact O-N 3.02Å; M228-L230 HydrophobicContact SD-CD2 3.72Å; M228-L230 HydrophobicContact SD-CG 4.46Å
229	N	27.4	Very low	31.9	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	74%	0.744	S	S	*	*			trans	-54.5	95.9	137.9	-74.4	-53.4	0	0	0	106.6	E227 R231	E227-N229 VanDerWaalsContact C-N 3.32Å; E227-N229 PolarHBondContact O-N 3.17Å; N229-R231 VanDerWaalsContact C-N 3.32Å; N229-R231 PolarHBondContact O-N 2.82Å
230	L	32.1	Very low	32.2	Very low	123 Å²	123	132.3 Å²	132.3	64%	0.644	72%	0.721	S	S	*	*			trans	-62.8	97.2	172.5	-80.5	166.6	0	0	0	107.5	M228	M228-L230 HydrophobicContact CG-CD2 4.39Å; M228-L230 PolarHBondContact O-N 3.02Å; M228-L230 HydrophobicContact SD-CD2 3.72Å; M228-L230 HydrophobicContact SD-CG 4.46Å
231	R	28.2	Very low	32.8	Very low	219 Å²	219	134.4 Å²	134.4	83%	0.826	72%	0.723	S	S	*	*			trans	-63.8	140.6	-178.7	-75.1	-176.1	169.9	-179.2	-4	110	N229 D233	N229-R231 VanDerWaalsContact C-N 3.32Å; N229-R231 PolarHBondContact O-N 2.82Å; R231-D233 PolarHBondContact O-N 3.06Å
232	L	31.3	Very low	33.5	Very low	118 Å²	118	128.6 Å²	128.6	62%	0.618	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	34.5	-166.5	-168.8	67	0	0	0	113.1
233	D	31.9	Very low	34.3	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	-19.4	-167.2	-72.6	-65.9	0	0	0	117.1	R231 L235	R231-D233 PolarHBondContact O-N 3.06Å; D233-L235 PolarHBondContact O-N 2.85Å
234	D	32.7	Very low	35.6	Very low	155 Å²	155	126.3 Å²	126.3	83%	0.829	68%	0.676	S	S	*	*			trans	-93.3	56.2	-174.8	-68.4	-44.2	0	0	0	114.2
235	L	32.2	Very low	36.6	Very low	106 Å²	106	124.8 Å²	124.8	56%	0.555	67%	0.665	S	S	*	*			trans	-135.9	117.3	169.6	-152.8	76.1	0	0	0	112.5	D233	D233-L235 PolarHBondContact O-N 2.85Å
236	P	33.9	Very low	38.4	Very low	104 Å²	104	119 Å²	119	68%	0.675	64%	0.643	S	S	*	*			trans	-63	140.5	174.4	27.3	-33.4	0	0	0	109.8	L238	P236-L238 PolarHBondContact O-N 3.06Å
237	G	31.6	Very low	40.8	Very low	49 Å²	49	118.3 Å²	118.3	51%	0.505	64%	0.638	S	S	.	*			trans	-65.9	116.3	179.1	0	0	0	0	0	111.1	S239	G237-S239 VanDerWaalsContact C-N 3.35Å; G237-S239 PolarHBondContact O-N 2.89Å
238	L	40.4	Very low	43.7	Very low	74 Å²	74	111.3 Å²	111.3	39%	0.387	60%	0.604	S	S	.	*			trans	-74.7	88.7	166.8	-88.1	82.6	0	0	0	109	P236 H240	P236-L238 PolarHBondContact O-N 3.06Å; L238-H240 PolarHBondContact O-N 2.88Å; L238-H240 VanDerWaalsContact O-N 3.07Å
239	S	35.8	Very low	46.6	Very low	113 Å²	113	108 Å²	108	79%	0.79	59%	0.592	S	S	*	*			trans	-79.5	69	161.2	60.4	0	0	0	0	109	G237	G237-S239 VanDerWaalsContact C-N 3.35Å; G237-S239 PolarHBondContact O-N 2.89Å
240	H	42.8	Very low	49.8	Very low	72 Å²	72	103.1 Å²	103.1	33%	0.333	56%	0.564	S	S	.	*			trans	-84.1	117	174.4	-90.6	-99.8	0	0	0	109.9	S190 L238 F242	S190-H240 WeakPolarHBondContact CB-NE2 3.25Å; L238-H240 PolarHBondContact O-N 2.88Å; L238-H240 VanDerWaalsContact O-N 3.07Å; H240-F242 PolarHBondContact O-N 3.16Å
241	V	42.9	Very low	52.9	Low	140 Å²	140	97.8 Å²	97.8	85%	0.848	54%	0.537	S	S	*	.			trans	-67.7	109.8	157.1	-179.7	0	0	0	0	105.8	D243	V241-D243 PolarHBondContact O-N 2.92Å
242	F	48.7	Very low	56.2	Low	60 Å²	60	87.3 Å²	87.3	26%	0.263	50%	0.497	S	S	.	.			trans	-67.2	129.2	176	-79.8	-86	0	0	0	110	D176 E179 V180 Y183 H240	D176-F242 HydrophobicContact CB-CE2 4.09Å; D176-F242 HydrophobicContact CB-CZ 4.04Å; E179-F242 HydrophobicContact CB-CE1 3.87Å; E179-F242 HydrophobicContact CB-CZ 4.13Å; V180-F242 HydrophobicContact CG2-CE1 4.28Å; V180-F242 HydrophobicContact CG2-CZ 4.21Å; Y183-F242 HydrophobicContact CD2-CD1 4.4Å; Y183-F242 HydrophobicContact CD2-CE1 4.33Å; Y183-F242 HydrophobicContact CE2-CD1 4.19Å; Y183-F242 HydrophobicContact CE2-CE1 4.38Å; H240-F242 PolarHBondContact O-N 3.16Å
243	D	49.2	Very low	59.4	Low	88 Å²	88	81.7 Å²	81.7	47%	0.471	47%	0.468	S	S	.	.			trans	-89.7	107.2	171.4	-178	-6.4	0	0	0	108.4	V241 S245 L246	V241-D243 PolarHBondContact O-N 2.92Å; D243-S245 PolarHBondContact O-N 3.02Å; D243-S245 VanDerWaalsContact O-N 3.08Å; D243-S245 WeakPolarHBondContact OD1-CB 3.22Å; D243-S245 PolarHBondContact OD1-N 2.87Å; D243-S245 PolarHBondContact OD1-OG 3.33Å; D243-S245 PolarHBondContact OD2-OG 3.01Å; D243-S245 VanDerWaalsContact OD2-OG 3.07Å; D243-L246 HydrophobicContact CB-CD1 4.29Å; D243-L246 HydrophobicContact CB-CG 4.22Å; D243-L246 WeakPolarHBondContact O-CB 3.4Å; D243-L246 PolarHBondContact O-N 3.28Å; D243-L246 VanDerWaalsContact O-N 3.11Å
244	E	54.1	Low	62.6	Low	189 Å²	189	75 Å²	75	88%	0.883	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-12.1	178.3	-65.9	-171.5	158	0	0	113.2	L246	E244-L246 VanDerWaalsContact C-N 3.31Å
245	S	53.4	Low	65.7	Low	94 Å²	94	67.6 Å²	67.6	66%	0.657	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.3	174.8	79.2	0	0	0	0	114.1	D243 S247	D243-S245 PolarHBondContact O-N 3.02Å; D243-S245 VanDerWaalsContact O-N 3.08Å; D243-S245 WeakPolarHBondContact OD1-CB 3.22Å; D243-S245 PolarHBondContact OD1-N 2.87Å; D243-S245 PolarHBondContact OD1-OG 3.33Å; D243-S245 PolarHBondContact OD2-OG 3.01Å; D243-S245 VanDerWaalsContact OD2-OG 3.07Å; S245-S247 PolarHBondContact O-N 2.84Å
246	L	67.3	Low	68.7	Low	75 Å²	75	62.5 Å²	62.5	39%	0.393	37%	0.366	S	S	.	.	S	Bend	trans	-67.1	129.5	175.2	-69.7	173.1	0	0	0	110.9	Y183 M185 D243 E244	Y183-L246 HydrophobicContact CD1-CB 3.86Å; Y183-L246 HydrophobicContact CE1-CB 4.14Å; Y183-L246 WeakPolarHBondContact CE1-O 3.49Å; Y183-L246 HydrophobicContact CG-CB 4.43Å; M185-L246 HydrophobicContact SD-CD1 4.12Å; D243-L246 HydrophobicContact CB-CD1 4.29Å; D243-L246 HydrophobicContact CB-CG 4.22Å; D243-L246 WeakPolarHBondContact O-CB 3.4Å; D243-L246 PolarHBondContact O-N 3.28Å; D243-L246 VanDerWaalsContact O-N 3.11Å; E244-L246 VanDerWaalsContact C-N 3.31Å
247	S	81.1	Confident	71.6	Confident	88 Å²	88	58.8 Å²	58.8	62%	0.615	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-78.4	138	174.6	55.7	0	0	0	0	111.2	S245 V249	S245-S247 PolarHBondContact O-N 2.84Å; S247-V249 PolarHBondContact O-N 3.22Å
248	W	90.2	Very high	74.5	Confident	41 Å²	41	57.3 Å²	57.3	16%	0.155	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-69.7	123.8	172	-172.1	-73.1	0	0	0	109.7	L178 E179 Y183 K250 V252 V349 R350 R352 L355	L178-W248 HydrophobicContact CD2-CH2 3.67Å; L178-W248 HydrophobicContact CD2-CZ2 4.31Å; E179-W248 HydrophobicContact CG-CZ3 4.41Å; Y183-W248 HydrophobicContact CE1-CB 4.5Å; Y183-W248 HydrophobicContact CE1-CE3 4.34Å; W248-K250 PolarHBondContact NE1-O 3.42Å; W248-V252 HydrophobicContact CZ2-CG2 3.95Å; W248-V349 HydrophobicContact CZ2-CG1 4.31Å; W248-R350 PolarHBondContact NE1-O 3.03Å; W248-R350 VanDerWaalsContact NE1-O 3.14Å; W248-R352 HydrophobicContact CB-CB 4.23Å; W248-R352 HydrophobicContact CD2-CB 4.16Å; W248-R352 HydrophobicContact CE3-CB 3.7Å; W248-R352 HydrophobicContact CE3-CG 4.32Å; W248-R352 HydrophobicContact CG-CB 4.43Å; W248-R352 HydrophobicContact CZ3-CB 4.37Å; W248-L355 HydrophobicContact CH2-CB 4.26Å; W248-L355 HydrophobicContact CH2-CD2 3.87Å; W248-L355 HydrophobicContact CZ3-CD2 3.78Å
249	V	91.6	Very high	77	Confident	77 Å²	77	58.5 Å²	58.5	47%	0.467	33%	0.326	S	S	.	.			trans	-116.6	-24.3	-170.7	-73	0	0	0	0	114.4	G182 Y183 S247	G182-V249 WeakPolarHBondContact O-CG2 3.42Å; G182-V249 PolarHBondContact O-N 3Å; Y183-V249 WeakPolarHBondContact O-CG2 3.32Å; S247-V249 PolarHBondContact O-N 3.22Å
250	K	95	Very high	79.6	Confident	38 Å²	38	53.3 Å²	53.3	17%	0.165	29%	0.29	C	S	.	.			trans	-123	126.1	-178.7	-65.1	-172.8	-170.2	-164	0	111.7	P160 N161 T162 A164 G182 W248	P160-K250 WeakPolarHBondContact O-CE 3.27Å; P160-K250 PolarHBondContact O-NZ 3.02Å; N161-K250 WeakPolarHBondContact O-CG 3.25Å; T162-K250 CarbonylContact O-C 3.52Å; T162-K250 VanDerWaalsContact O-CA 3.32Å; T162-K250 WeakPolarHBondContact O-CA 2.95Å; A164-K250 HydrophobicContact CB-CB 4.38Å; A164-K250 HydrophobicContact CB-CD 4.2Å; G182-K250 WeakPolarHBondContact CA-O 3.4Å; G182-K250 PolarHBondContact O-N 2.83Å; W248-K250 PolarHBondContact NE1-O 3.42Å
251	S	96.3	Very high	81.8	Confident	11 Å²	11	51.2 Å²	51.2	8%	0.077	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	150.4	161.2	-51.9	0	0	0	0	110	H78 T162 L163 A164 Y348 V349 R350	H78-S251 PolarHBondContact ND1-OG 2.79Å; T162-S251 PolarHBondContact O-N 2.76Å; L163-S251 CarbonylContact C-O 3.56Å; L163-S251 WeakPolarHBondContact CA-O 3.47Å; A164-S251 PolarHBondContact N-O 3.04Å; S251-Y348 VanDerWaalsContact CB-OH 3.25Å; S251-Y348 WeakPolarHBondContact CB-OH 3.47Å; S251-Y348 PolarHBondContact OG-OH 2.81Å; S251-V349 CarbonylContact C-O 3.57Å; S251-V349 WeakPolarHBondContact CA-O 3.4Å; S251-R350 PolarHBondContact OG-O 2.82Å
252	V	97.9	Very high	83.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.4	-176.1	-173.5	0	0	0	0	110.5	A164 L178 L181 W248 V254 V349	A164-V252 HydrophobicContact CB-CG2 4.48Å; A164-V252 WeakPolarHBondContact O-CA 3.32Å; L178-V252 HydrophobicContact CD2-CB 4.21Å; L178-V252 HydrophobicContact CD2-CG1 4.31Å; L178-V252 HydrophobicContact CD2-CG2 4.15Å; L178-V252 HydrophobicContact CG-CG1 4.23Å; L181-V252 HydrophobicContact CB-CG2 4.26Å; W248-V252 HydrophobicContact CZ2-CG2 3.95Å; V252-V254 HydrophobicContact CG1-CG2 4.05Å; V252-V349 PolarHBondContact N-O 3.33Å; V252-V349 PolarHBondContact O-N 2.75Å
253	L	98.5	Very high	85.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	104.2	164.7	174.3	58.1	0	0	0	109	L70 L71 T74 L163 A164 V165 Y166 L255 V283 F347	L70-L253 HydrophobicContact CD2-CD1 4.09Å; L70-L253 HydrophobicContact CD2-CD2 4.22Å; L71-L253 HydrophobicContact CD1-CD2 4.05Å; T74-L253 HydrophobicContact CG2-CB 4.02Å; T74-L253 HydrophobicContact CG2-CD1 3.99Å; T74-L253 HydrophobicContact CG2-CD2 4.05Å; T74-L253 HydrophobicContact CG2-CG 4.22Å; T74-L253 WeakPolarHBondContact OG1-CD1 3.06Å; L163-L253 HydrophobicContact CD1-CB 4.47Å; A164-L253 PolarHBondContact O-N 2.74Å; V165-L253 CarbonylContact C-O 3.58Å; V165-L253 WeakPolarHBondContact CA-O 3.29Å; V165-L253 HydrophobicContact CG1-CD2 4.36Å; V165-L253 HydrophobicContact CG1-CG 4.39Å; V165-L253 HydrophobicContact CG2-CB 4.34Å; V165-L253 HydrophobicContact CG2-CD2 4.31Å; Y166-L253 PolarHBondContact N-O 2.69Å; L253-L255 HydrophobicContact CD1-CD2 3.85Å; L253-L255 HydrophobicContact CD2-CD1 4.47Å; L253-L255 HydrophobicContact CD2-CD2 4.11Å; L253-L255 HydrophobicContact CD2-CG 4.4Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.07Å; L253-V283 HydrophobicContact CD1-CG2 3.76Å; L253-F347 CarbonylContact C-O 3.58Å; L253-F347 WeakPolarHBondContact CA-O 3.49Å
254	V	98.3	Very high	87.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	124.8	175	-170.8	0	0	0	0	109.4	Y166 V168 L173 L178 V252 V256 G346 F347	Y166-V254 HydrophobicContact CD1-CG1 3.99Å; Y166-V254 HydrophobicContact CD1-CG2 4.37Å; Y166-V254 CarbonylContact O-C 3.41Å; Y166-V254 WeakPolarHBondContact O-CA 3.34Å; V168-V254 HydrophobicContact CG2-CG1 3.62Å; L173-V254 HydrophobicContact CD1-CG1 3.95Å; L178-V254 HydrophobicContact CD1-CG2 3.67Å; L178-V254 HydrophobicContact CG-CG2 4.16Å; V252-V254 HydrophobicContact CG1-CG2 4.05Å; V254-V256 HydrophobicContact CG1-CG2 4Å; V254-G346 CarbonylContact O-C 3.55Å; V254-G346 WeakPolarHBondContact O-CA 3.32Å; V254-F347 HydrophobicContact CB-CB 4.29Å; V254-F347 PolarHBondContact N-O 2.68Å; V254-F347 PolarHBondContact O-N 3.28Å
255	L	98.5	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	102.1	179.3	-62.8	-176.3	0	0	0	110	L70 L147 V165 Y166 V167 V168 L253 T344	L70-L255 HydrophobicContact CD2-CD2 3.62Å; L147-L255 HydrophobicContact CB-CD1 4.35Å; L147-L255 HydrophobicContact CD1-CD1 4.22Å; V165-L255 HydrophobicContact CG1-CD1 3.64Å; V165-L255 HydrophobicContact CG1-CG 4.04Å; Y166-L255 PolarHBondContact O-N 3.17Å; V167-L255 HydrophobicContact CG2-CB 4.48Å; V167-L255 HydrophobicContact CG2-CD1 4.42Å; V168-L255 PolarHBondContact N-O 2.92Å; L253-L255 HydrophobicContact CD1-CD2 3.85Å; L253-L255 HydrophobicContact CD2-CD1 4.47Å; L253-L255 HydrophobicContact CD2-CD2 4.11Å; L253-L255 HydrophobicContact CD2-CG 4.4Å; L253-L255 HydrophobicContact CG-CD2 3.84Å; L253-L255 HydrophobicContact CG-CG 4.07Å; L255-T344 HydrophobicContact CB-CG2 3.86Å; L255-T344 HydrophobicContact CD2-CG2 4.26Å
256	V	96.1	Very high	91.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	105.2	-178.6	-167.1	0	0	0	0	109.8	V168 V254 L258 T344 I345 F347 F378	V168-V256 HydrophobicContact CB-CG1 4.42Å; V168-V256 HydrophobicContact CB-CG2 4.25Å; V168-V256 HydrophobicContact CG1-CG1 4.21Å; V168-V256 HydrophobicContact CG2-CG2 4.09Å; V254-V256 HydrophobicContact CG1-CG2 4Å; V256-L258 HydrophobicContact CG1-CD1 4.26Å; V256-L258 HydrophobicContact CG1-CD2 3.77Å; V256-L258 HydrophobicContact CG1-CG 3.97Å; V256-T344 CarbonylContact O-C 3.5Å; V256-T344 VanDerWaalsContact O-CA 3.31Å; V256-T344 WeakPolarHBondContact O-CA 3.33Å; V256-I345 PolarHBondContact N-O 3.11Å; V256-I345 PolarHBondContact O-N 2.9Å; V256-F347 HydrophobicContact CG2-CD2 4.09Å; V256-F347 HydrophobicContact CG2-CE2 3.89Å; V256-F378 HydrophobicContact CG1-CB 3.83Å; V256-F378 HydrophobicContact CG1-CD1 4.1Å; V256-F378 HydrophobicContact CG1-CG 3.98Å
257	S	94.6	Very high	92.3	Very high	25 Å²	25	48.2 Å²	48.2	18%	0.175	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.1	179.8	-61.5	0	0	0	0	111.3	A141 S144 C343 T344	A141-S257 WeakPolarHBondContact CA-OG 3.37Å; S144-S257 PolarHBondContact OG-OG 3.4Å; S257-C343 CarbonylContact C-O 3.59Å; S257-C343 WeakPolarHBondContact CA-O 3.38Å; S257-T344 PolarHBondContact OG-OG1 3.45Å
258	L	92.6	Very high	92.6	Very high	19 Å²	19	46.7 Å²	46.7	10%	0.099	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	158.3	-166.6	-60.5	178.5	0	0	0	112.4	V256 L260 C343 I345 L377 F378	V256-L258 HydrophobicContact CG1-CD1 4.26Å; V256-L258 HydrophobicContact CG1-CD2 3.77Å; V256-L258 HydrophobicContact CG1-CG 3.97Å; L258-L260 HydrophobicContact CB-CD2 3.92Å; L258-L260 HydrophobicContact CB-CG 4.1Å; L258-L260 HydrophobicContact CD1-CD2 4.06Å; L258-C343 PolarHBondContact N-O 2.88Å; L258-C343 PolarHBondContact O-N 2.95Å; L258-C343 VanDerWaalsContact O-N 3.09Å; L258-I345 HydrophobicContact CD1-CD1 3.66Å; L258-I345 HydrophobicContact CD1-CG1 4.25Å; L258-L377 HydrophobicContact CD1-CB 4.2Å; L258-L377 WeakPolarHBondContact CD1-O 3.44Å; L258-L377 WeakPolarHBondContact CD2-O 3.36Å; L258-F378 HydrophobicContact CD2-CB 4.32Å
259	H	91.7	Very high	92.6	Very high	99 Å²	99	46.2 Å²	46.2	46%	0.458	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	86.9	173.6	-166.8	78.1	0	0	0	109.7	G261 G262 P341 N342	H259-G261 PolarHBondContact CD2-O 3.42Å; H259-G261 PolarHBondContact NE2-O 3.12Å; H259-G261 PolarHBondContact O-N 3.23Å; H259-G262 PolarHBondContact NE2-O 3.38Å; H259-P341 CarbonylContact C-O 3.59Å; H259-P341 VanDerWaalsContact CA-O 3.31Å; H259-P341 WeakPolarHBondContact CA-O 3.41Å; H259-N342 PolarHBondContact CE1-OD1 2.83Å; H259-N342 PolarHBondContact ND1-OD1 3.23Å
260	L	90.6	Very high	92.6	Very high	4 Å²	4	44 Å²	44	2%	0.021	24%	0.235	C	C	.	.			trans	-83.6	45.1	-167.6	-59.1	-177.5	0	0	0	113.4	L258 F265 N266 Y269 L273 P341 L377	L258-L260 HydrophobicContact CB-CD2 3.92Å; L258-L260 HydrophobicContact CB-CG 4.1Å; L258-L260 HydrophobicContact CD1-CD2 4.06Å; L260-F265 HydrophobicContact CB-CD2 3.87Å; L260-F265 HydrophobicContact CB-CE2 3.84Å; L260-F265 HydrophobicContact CD1-CE2 4.01Å; L260-N266 PolarHBondContact O-N 3.36Å; L260-Y269 HydrophobicContact CB-CD2 3.73Å; L260-Y269 HydrophobicContact CB-CE2 4.17Å; L260-Y269 HydrophobicContact CB-CG 4.3Å; L260-Y269 HydrophobicContact CD2-CD1 4.28Å; L260-Y269 HydrophobicContact CD2-CD2 4.15Å; L260-Y269 HydrophobicContact CD2-CE1 4.42Å; L260-Y269 HydrophobicContact CD2-CE2 4.3Å; L260-Y269 HydrophobicContact CD2-CG 4.14Å; L260-Y269 HydrophobicContact CG-CD2 4.47Å; L260-L273 HydrophobicContact CD1-CD1 3.95Å; L260-L273 HydrophobicContact CD1-CD2 3.9Å; L260-L273 HydrophobicContact CD1-CG 4.15Å; L260-P341 PolarHBondContact N-O 3.4Å; L260-L377 HydrophobicContact CD1-CD2 3.98Å; L260-L377 HydrophobicContact CD2-CD2 3.54Å; L260-L377 HydrophobicContact CG-CD2 4.43Å
261	G	89.5	Confident	92.2	Very high	27 Å²	27	45.2 Å²	45.2	28%	0.278	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	159.7	-149.9	-177.2	0	0	0	0	0	113	H259 R264	H259-G261 PolarHBondContact CD2-O 3.42Å; H259-G261 PolarHBondContact NE2-O 3.12Å; H259-G261 PolarHBondContact O-N 3.23Å; G261-R264 WeakPolarHBondContact CA-O 3.43Å
262	G	87.3	Confident	91.8	Very high	47 Å²	47	45.1 Å²	45.1	49%	0.485	24%	0.242	S	C	.	.	S	Bend	trans	-121.2	-110	171.5	0	0	0	0	0	110	H259 R264 P341	H259-G262 PolarHBondContact NE2-O 3.38Å; G262-R264 PolarHBondContact N-O 3.11Å; G262-R264 VanDerWaalsContact N-O 3.13Å; G262-R264 PolarHBondContact O-N 3.45Å; G262-P341 WeakPolarHBondContact O-CG 3.49Å
263	E	86.5	Confident	91.5	Very high	166 Å²	166	45.1 Å²	45.1	78%	0.776	24%	0.242	S	C	*	.	S	Bend	trans	-69.7	-21.9	169.4	-60.3	-173.6	167.8	0	0	113.5	R289	E263-R289 PolarHBondContact O-NH2 3.21Å
264	R	89.2	Confident	91.2	Very high	202 Å²	202	46.5 Å²	46.5	76%	0.762	25%	0.248	S	C	*	.	S	Bend	trans	-131.3	149.9	-177.6	-57.7	-177.3	-172.9	-172.9	2.3	109	G261 G262	G261-R264 WeakPolarHBondContact CA-O 3.43Å; G262-R264 PolarHBondContact N-O 3.11Å; G262-R264 VanDerWaalsContact N-O 3.13Å; G262-R264 PolarHBondContact O-N 3.45Å
265	F	90.9	Very high	90.8	Very high	16 Å²	16	48.9 Å²	48.9	7%	0.07	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-61.2	134.6	171.9	174	-95.3	0	0	0	110.9	L260 I270 L273 F336 M339	L260-F265 HydrophobicContact CB-CD2 3.87Å; L260-F265 HydrophobicContact CB-CE2 3.84Å; L260-F265 HydrophobicContact CD1-CE2 4.01Å; F265-I270 HydrophobicContact CE1-CD1 4.49Å; F265-I270 HydrophobicContact CE1-CG1 3.68Å; F265-I270 HydrophobicContact CZ-CG1 4.24Å; F265-L273 HydrophobicContact CE2-CD1 3.62Å; F265-L273 HydrophobicContact CZ-CD1 3.74Å; F265-F336 WeakPolarHBondContact CD1-O 3.42Å; F265-F336 HydrophobicContact CE1-CB 4.43Å; F265-M339 VanDerWaalsContact CB-O 3.29Å; F265-M339 WeakPolarHBondContact CB-O 3.22Å; F265-M339 HydrophobicContact CD2-CB 4.45Å; F265-M339 HydrophobicContact CE2-SD 4.43Å; F265-M339 HydrophobicContact CG-CB 4.38Å
266	N	90.7	Very high	90.5	Very high	70 Å²	70	48.9 Å²	48.9	37%	0.374	26%	0.258	S	S	.	.			trans	-88.3	123.8	178.8	-177.7	-5.4	0	0	0	110.1	L260 V268 Y269	L260-N266 PolarHBondContact O-N 3.36Å; N266-V268 HydrophobicContact CB-CG1 4.36Å; N266-V268 WeakPolarHBondContact ND2-CG1 3.44Å; N266-V268 PolarHBondContact O-N 3.38Å; N266-V268 VanDerWaalsContact O-N 3.11Å; N266-V268 PolarHBondContact OD1-N 3.4Å; N266-Y269 HydrophobicContact CB-CD2 3.92Å; N266-Y269 HydrophobicContact CB-CE2 3.97Å; N266-Y269 PolarHBondContact O-N 3.09Å
267	S	90.8	Very high	90.4	Very high	82 Å²	82	49 Å²	49	57%	0.573	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-63.1	-17.1	-176.2	50.1	0	0	0	0	114.7	Y269 I270	S267-Y269 PolarHBondContact O-N 3.31Å; S267-Y269 VanDerWaalsContact O-N 3.16Å; S267-I270 WeakPolarHBondContact O-CB 3.31Å; S267-I270 VanDerWaalsContact O-CG1 3.26Å; S267-I270 WeakPolarHBondContact O-CG1 3.46Å; S267-I270 PolarHBondContact O-N 2.98Å; S267-I270 VanDerWaalsContact O-N 3.09Å
268	V	88.3	Confident	90.3	Very high	56 Å²	56	49.9 Å²	49.9	34%	0.339	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-57.4	-27.3	174.1	77.7	0	0	0	0	112.7	N266 H272 Y375	N266-V268 HydrophobicContact CB-CG1 4.36Å; N266-V268 WeakPolarHBondContact ND2-CG1 3.44Å; N266-V268 PolarHBondContact O-N 3.38Å; N266-V268 VanDerWaalsContact O-N 3.11Å; N266-V268 PolarHBondContact OD1-N 3.4Å; V268-H272 PolarHBondContact O-ND1 3.4Å; V268-Y375 HydrophobicContact CG2-CD2 4.23Å
269	Y	89.6	Confident	90.2	Very high	32 Å²	32	49 Å²	49	13%	0.125	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-86.6	-0.7	-179.3	-58.9	-60.6	0	0	0	114.1	L260 N266 S267 L273 Y375 L377	L260-Y269 HydrophobicContact CB-CD2 3.73Å; L260-Y269 HydrophobicContact CB-CE2 4.17Å; L260-Y269 HydrophobicContact CB-CG 4.3Å; L260-Y269 HydrophobicContact CD2-CD1 4.28Å; L260-Y269 HydrophobicContact CD2-CD2 4.15Å; L260-Y269 HydrophobicContact CD2-CE1 4.42Å; L260-Y269 HydrophobicContact CD2-CE2 4.3Å; L260-Y269 HydrophobicContact CD2-CG 4.14Å; L260-Y269 HydrophobicContact CG-CD2 4.47Å; N266-Y269 HydrophobicContact CB-CD2 3.92Å; N266-Y269 HydrophobicContact CB-CE2 3.97Å; N266-Y269 PolarHBondContact O-N 3.09Å; S267-Y269 PolarHBondContact O-N 3.31Å; S267-Y269 VanDerWaalsContact O-N 3.16Å; Y269-L273 WeakPolarHBondContact O-CB 2.99Å; Y269-L273 WeakPolarHBondContact O-CG 3.35Å; Y269-L273 PolarHBondContact O-N 3.37Å; Y269-Y375 WeakPolarHBondContact CE1-O 3.27Å; Y269-L377 HydrophobicContact CD1-CD2 3.57Å; Y269-L377 HydrophobicContact CD1-CG 4.47Å; Y269-L377 HydrophobicContact CE1-CD2 4.33Å; Y269-L377 HydrophobicContact CG-CD2 4.03Å
270	I	90.7	Very high	90.2	Very high	31 Å²	31	47.7 Å²	47.7	16%	0.159	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-55.2	-175.9	-69.6	175.5	0	0	0	111.3	F265 S267 H272 L273 K274 F336	F265-I270 HydrophobicContact CE1-CD1 4.49Å; F265-I270 HydrophobicContact CE1-CG1 3.68Å; F265-I270 HydrophobicContact CZ-CG1 4.24Å; S267-I270 WeakPolarHBondContact O-CB 3.31Å; S267-I270 VanDerWaalsContact O-CG1 3.26Å; S267-I270 WeakPolarHBondContact O-CG1 3.46Å; S267-I270 PolarHBondContact O-N 2.98Å; S267-I270 VanDerWaalsContact O-N 3.09Å; I270-H272 VanDerWaalsContact C-N 3.34Å; I270-H272 PolarHBondContact O-N 2.95Å; I270-L273 PolarHBondContact O-N 2.86Å; I270-L273 VanDerWaalsContact O-N 3.17Å; I270-K274 HydrophobicContact CG2-CD 4.33Å; I270-K274 WeakPolarHBondContact O-CG 3.39Å; I270-K274 PolarHBondContact O-N 2.89Å; I270-F336 HydrophobicContact CD1-CB 4.1Å; I270-F336 HydrophobicContact CG1-CB 3.88Å; I270-F336 HydrophobicContact CG1-CG 4.35Å; I270-F336 HydrophobicContact CG2-CB 4.39Å; I270-F336 HydrophobicContact CG2-CD1 4.5Å; I270-F336 HydrophobicContact CG2-CD2 4.09Å; I270-F336 HydrophobicContact CG2-CG 4.11Å
271	D	88.1	Confident	90.4	Very high	63 Å²	63	47.8 Å²	47.8	34%	0.337	25%	0.253	S	S	.	.	H	α-helix	trans	-75.4	-28.7	-172.9	-57	-46.8	0	0	0	111.9	K274 K275 Y368	D271-K274 PolarHBondContact O-N 3Å; D271-K274 WeakPolarHBondContact OD1-CD 3.18Å; D271-K274 IonicContact OD1-NZ 2.81Å; D271-K274 PolarHBondContact OD1-NZ 2.98Å; D271-K275 PolarHBondContact O-N 2.97Å; D271-Y368 HydrophobicContact CB-CE1 4.16Å
272	H	88	Confident	90.8	Very high	9 Å²	9	46.7 Å²	46.7	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-48	165.8	-62.1	85.6	0	0	0	111.4	V268 I270 K275 V276 V365 Y368 L377	V268-H272 PolarHBondContact O-ND1 3.4Å; I270-H272 VanDerWaalsContact C-N 3.34Å; I270-H272 PolarHBondContact O-N 2.95Å; H272-K275 PolarHBondContact O-N 3.45Å; H272-V276 WeakPolarHBondContact O-CG2 3.38Å; H272-V276 PolarHBondContact O-N 3.28Å; H272-V365 PolarHBondContact CD2-O 3.1Å; H272-Y368 PolarHBondContact NE2-O 3.48Å; H272-Y368 VanDerWaalsContact NE2-O 3.14Å; H272-L377 HydrophobicContact CB-CD1 3.66Å; H272-L377 HydrophobicContact CB-CD2 4.18Å; H272-L377 HydrophobicContact CB-CG 3.75Å
273	L	91.1	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-35.2	177	-76.1	-172.9	0	0	0	112.9	L260 F265 Y269 I270 V276 L277 I285 F336 M339 I345 L377	L260-L273 HydrophobicContact CD1-CD1 3.95Å; L260-L273 HydrophobicContact CD1-CD2 3.9Å; L260-L273 HydrophobicContact CD1-CG 4.15Å; F265-L273 HydrophobicContact CE2-CD1 3.62Å; F265-L273 HydrophobicContact CZ-CD1 3.74Å; Y269-L273 WeakPolarHBondContact O-CB 2.99Å; Y269-L273 WeakPolarHBondContact O-CG 3.35Å; Y269-L273 PolarHBondContact O-N 3.37Å; I270-L273 PolarHBondContact O-N 2.86Å; I270-L273 VanDerWaalsContact O-N 3.17Å; L273-V276 PolarHBondContact O-N 3.24Å; L273-L277 VanDerWaalsContact O-CB 3.25Å; L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 WeakPolarHBondContact O-CG 3.34Å; L273-L277 PolarHBondContact O-N 2.68Å; L273-I285 HydrophobicContact CD2-CD1 3.85Å; L273-F336 HydrophobicContact CB-CD1 4.47Å; L273-F336 HydrophobicContact CB-CE1 3.88Å; L273-F336 HydrophobicContact CD1-CD1 4.35Å; L273-F336 HydrophobicContact CD1-CE1 4.4Å; L273-M339 HydrophobicContact CD1-CE 4.18Å; L273-M339 HydrophobicContact CD1-SD 3.77Å; L273-I345 HydrophobicContact CD2-CD1 3.89Å; L273-L377 HydrophobicContact CD2-CD1 4.15Å; L273-L377 HydrophobicContact CD2-CD2 4.29Å
274	K	91.8	Very high	91.7	Very high	29 Å²	29	36.8 Å²	36.8	13%	0.126	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-47.9	171.7	-71.4	175.6	-171.9	156.1	0	110.6	I270 D271 L277 S278 W299 F336	I270-K274 HydrophobicContact CG2-CD 4.33Å; I270-K274 WeakPolarHBondContact O-CG 3.39Å; I270-K274 PolarHBondContact O-N 2.89Å; D271-K274 PolarHBondContact O-N 3Å; D271-K274 WeakPolarHBondContact OD1-CD 3.18Å; D271-K274 IonicContact OD1-NZ 2.81Å; D271-K274 PolarHBondContact OD1-NZ 2.98Å; K274-L277 CarbonylContact O-C 3.58Å; K274-L277 PolarHBondContact O-N 2.92Å; K274-S278 PolarHBondContact O-N 2.67Å; K274-S278 PolarHBondContact O-OG 2.7Å; K274-S278 VanDerWaalsContact O-OG 3.12Å; K274-W299 HydrophobicContact CB-CD2 4.06Å; K274-W299 HydrophobicContact CB-CG 4.38Å; K274-W299 HydrophobicContact CB-CZ2 4.16Å; K274-W299 HydrophobicContact CD-CD2 4.27Å; K274-W299 HydrophobicContact CD-CE3 3.94Å; K274-W299 HydrophobicContact CD-CH2 4.16Å; K274-W299 HydrophobicContact CD-CZ2 4.45Å; K274-W299 HydrophobicContact CD-CZ3 3.89Å; K274-W299 HydrophobicContact CG-CD2 3.76Å; K274-W299 HydrophobicContact CG-CE3 3.9Å; K274-W299 HydrophobicContact CG-CG 4.13Å; K274-W299 HydrophobicContact CG-CZ2 4.45Å; K274-W299 HydrophobicContact CG-CZ3 4.32Å; K274-W299 PolarHBondContact O-NE1 2.88Å; K274-W299 VanDerWaalsContact O-NE1 3.11Å; K274-F336 HydrophobicContact CG-CE1 4.49Å; K274-F336 HydrophobicContact CG-CE2 3.94Å; K274-F336 HydrophobicContact CG-CZ 3.66Å
275	K	90.7	Very high	92.1	Very high	49 Å²	49	27.1 Å²	27.1	21%	0.213	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-50.4	175.1	-83.8	-154.8	170.6	-168.6	0	112.1	D271 H272 L277 S278 M279 E364 V365 Y368	D271-K275 PolarHBondContact O-N 2.97Å; H272-K275 PolarHBondContact O-N 3.45Å; K275-L277 VanDerWaalsContact C-N 3.33Å; K275-L277 PolarHBondContact O-N 3.05Å; K275-S278 WeakPolarHBondContact O-CA 3.31Å; K275-S278 WeakPolarHBondContact O-CB 3.17Å; K275-S278 PolarHBondContact O-N 3.37Å; K275-M279 WeakPolarHBondContact O-CG 3.47Å; K275-M279 PolarHBondContact O-N 2.96Å; K275-M279 VanDerWaalsContact O-N 3.13Å; K275-E364 IonicContact NZ-OE1 3.56Å; K275-E364 PolarHBondContact NZ-OE1 3.1Å; K275-V365 HydrophobicContact CB-CB 4.37Å; K275-V365 HydrophobicContact CB-CG1 3.74Å; K275-V365 HydrophobicContact CB-CG2 3.82Å; K275-V365 HydrophobicContact CD-CG2 4.1Å; K275-Y368 HydrophobicContact CD-CD1 3.65Å; K275-Y368 HydrophobicContact CD-CD2 4.23Å; K275-Y368 HydrophobicContact CD-CE1 4.18Å; K275-Y368 HydrophobicContact CD-CG 3.65Å; K275-Y368 HydrophobicContact CG-CD1 4.17Å; K275-Y368 HydrophobicContact CG-CE1 4.41Å; K275-Y368 VanDerWaalsContact NZ-CG 3.33Å
276	V	92.2	Very high	92.4	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-54.1	-48.2	175.2	166.6	0	0	0	0	111.9	H272 L273 S278 M279 C282 I345 F347 V365 L377	H272-V276 WeakPolarHBondContact O-CG2 3.38Å; H272-V276 PolarHBondContact O-N 3.28Å; L273-V276 PolarHBondContact O-N 3.24Å; V276-S278 PolarHBondContact O-N 2.77Å; V276-M279 HydrophobicContact CG2-SD 4.33Å; V276-M279 WeakPolarHBondContact O-CB 3.48Å; V276-M279 PolarHBondContact O-N 3.19Å; V276-M279 VanDerWaalsContact O-N 3.09Å; V276-C282 WeakPolarHBondContact O-CB 3.47Å; V276-I345 HydrophobicContact CG1-CD1 4.2Å; V276-I345 HydrophobicContact CG1-CG2 3.5Å; V276-F347 HydrophobicContact CG1-CE1 3.91Å; V276-F347 HydrophobicContact CG1-CZ 3.89Å; V276-F347 HydrophobicContact CG2-CZ 4.46Å; V276-V365 HydrophobicContact CG2-CG1 3.76Å; V276-L377 HydrophobicContact CG2-CD1 3.5Å; V276-L377 VanDerWaalsContact CG2-CD1 3.5Å
277	L	93.4	Very high	92.4	Very high	2 Å²	2	23 Å²	23	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-3.2	177.7	-75.1	170.1	0	0	0	113.9	G2 L273 K274 K275 I285 L304	G2-L277 CarbonylContact C-O 3.54Å; G2-L277 WeakPolarHBondContact CA-O 3.27Å; L273-L277 VanDerWaalsContact O-CB 3.25Å; L273-L277 WeakPolarHBondContact O-CB 3.41Å; L273-L277 WeakPolarHBondContact O-CG 3.34Å; L273-L277 PolarHBondContact O-N 2.68Å; K274-L277 CarbonylContact O-C 3.58Å; K274-L277 PolarHBondContact O-N 2.92Å; K275-L277 VanDerWaalsContact C-N 3.33Å; K275-L277 PolarHBondContact O-N 3.05Å; L277-I285 HydrophobicContact CD1-CD1 4.15Å; L277-I285 HydrophobicContact CD2-CD1 3.83Å; L277-I285 HydrophobicContact CD2-CG1 3.9Å; L277-I285 HydrophobicContact CG-CD1 3.84Å; L277-I285 HydrophobicContact CG-CG1 4.46Å; L277-L304 HydrophobicContact CD1-CD2 3.41Å; L277-L304 VanDerWaalsContact CD1-CD2 3.41Å
278	S	92.2	Very high	91.7	Very high	43 Å²	43	19.5 Å²	19.5	30%	0.301	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-19.1	168.6	-66.8	0	0	0	0	113	G2 K274 K275 V276 W299	G2-S278 CarbonylContact O-C 3.57Å; G2-S278 WeakPolarHBondContact O-CA 3.2Å; K274-S278 PolarHBondContact O-N 2.67Å; K274-S278 PolarHBondContact O-OG 2.7Å; K274-S278 VanDerWaalsContact O-OG 3.12Å; K275-S278 WeakPolarHBondContact O-CA 3.31Å; K275-S278 WeakPolarHBondContact O-CB 3.17Å; K275-S278 PolarHBondContact O-N 3.37Å; V276-S278 PolarHBondContact O-N 2.77Å; S278-W299 PolarHBondContact OG-NE1 2.8Å; S278-W299 VanDerWaalsContact OG-NE1 3.08Å
279	M	92.1	Very high	90.9	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	11%	0.112	C	C	.	.	S	Bend	trans	-57.4	147.1	-174	-66.5	176.1	69.2	0	0	113.3	K275 V276 F281 C282 F347 F358 E361 A362 V365	K275-M279 WeakPolarHBondContact O-CG 3.47Å; K275-M279 PolarHBondContact O-N 2.96Å; K275-M279 VanDerWaalsContact O-N 3.13Å; V276-M279 HydrophobicContact CG2-SD 4.33Å; V276-M279 WeakPolarHBondContact O-CB 3.48Å; V276-M279 PolarHBondContact O-N 3.19Å; V276-M279 VanDerWaalsContact O-N 3.09Å; M279-F281 VanDerWaalsContact C-N 3.29Å; M279-F281 HydrophobicContact CE-CD2 4.34Å; M279-F281 PolarHBondContact O-N 2.84Å; M279-C282 HydrophobicContact CB-CB 4.13Å; M279-C282 PolarHBondContact O-N 3.46Å; M279-F347 HydrophobicContact CE-CD1 4.43Å; M279-F347 HydrophobicContact CE-CE1 4.07Å; M279-F347 HydrophobicContact SD-CD1 4.45Å; M279-F347 HydrophobicContact SD-CE1 3.63Å; M279-F347 HydrophobicContact SD-CZ 4.36Å; M279-F358 HydrophobicContact CE-CD2 3.95Å; M279-F358 HydrophobicContact CE-CE2 4.05Å; M279-E361 VanDerWaalsContact CA-OE1 3.29Å; M279-E361 WeakPolarHBondContact CA-OE1 3.48Å; M279-E361 WeakPolarHBondContact CB-OE2 3.46Å; M279-E361 HydrophobicContact CE-CB 3.94Å; M279-E361 HydrophobicContact CE-CG 3.81Å; M279-E361 HydrophobicContact CG-CG 3.96Å; M279-A362 HydrophobicContact CE-CB 4Å; M279-V365 HydrophobicContact CG-CG2 4.22Å; M279-V365 HydrophobicContact SD-CG2 3.98Å
280	K	91.2	Very high	89.5	Confident	72 Å²	72	24.7 Å²	24.7	31%	0.313	13%	0.127	S	C	.	.	S	Bend	trans	-55	-49.6	174.3	176	-179.3	165.2	-167.5	0	110.3	M1 R77 E82 C282 E357 E361	M1-K280 PolarHBondContact N-O 2.67Å; R77-K280 PolarHBondContact NH1-O 3.32Å; E82-K280 WeakPolarHBondContact OE2-CE 3.32Å; K280-C282 PolarHBondContact O-N 3.48Å; K280-E357 IonicContact NZ-OE1 3.51Å; K280-E357 IonicContact NZ-OE2 2.72Å; K280-E357 PolarHBondContact NZ-OE2 3.07Å; K280-E361 PolarHBondContact N-OE2 2.89Å
281	F	95.1	Very high	88.4	Confident	5 Å²	5	25.1 Å²	25.1	2%	0.022	13%	0.133	C	C	.	.	S	Bend	trans	-72.6	-21.3	-173.3	-49.1	-73.1	0	0	0	114.3	M279 V283 F347 Y348 E354 E357 F358 E361	M279-F281 VanDerWaalsContact C-N 3.29Å; M279-F281 HydrophobicContact CE-CD2 4.34Å; M279-F281 PolarHBondContact O-N 2.84Å; F281-V283 PolarHBondContact O-N 2.73Å; F281-F347 HydrophobicContact CB-CB 4.38Å; F281-F347 HydrophobicContact CB-CD1 4.38Å; F281-F347 CarbonylContact O-C 3.5Å; F281-F347 VanDerWaalsContact O-CA 3.31Å; F281-F347 WeakPolarHBondContact O-CA 3.22Å; F281-Y348 WeakPolarHBondContact CD1-O 3.43Å; F281-Y348 PolarHBondContact O-N 3.05Å; F281-E354 HydrophobicContact CE1-CB 3.97Å; F281-E354 HydrophobicContact CE1-CG 4.17Å; F281-E357 HydrophobicContact CE1-CB 4.36Å; F281-E357 HydrophobicContact CE2-CB 4.04Å; F281-E357 HydrophobicContact CZ-CB 3.44Å; F281-E357 VanDerWaalsContact CZ-CB 3.44Å; F281-E357 HydrophobicContact CZ-CG 4.48Å; F281-E357 WeakPolarHBondContact CZ-OE2 3.14Å; F281-F358 HydrophobicContact CB-CD2 3.85Å; F281-F358 HydrophobicContact CD1-CB 4.08Å; F281-F358 HydrophobicContact CD2-CB 3.79Å; F281-F358 AromaticContact CD2-CD2 3.88Å; F281-F358 HydrophobicContact CD2-CD2 3.88Å; F281-F358 HydrophobicContact CD2-CG 4.34Å; F281-F358 HydrophobicContact CE1-CB 4.27Å; F281-F358 HydrophobicContact CE2-CB 4Å; F281-F358 HydrophobicContact CG-CB 3.86Å; F281-F358 AromaticContact CG-CD2 3.87Å; F281-F358 HydrophobicContact CG-CD2 3.87Å; F281-F358 HydrophobicContact CG-CG 4.27Å; F281-F358 HydrophobicContact CZ-CB 4.26Å; F281-E361 WeakPolarHBondContact CD2-OE2 3.46Å; F281-E361 VanDerWaalsContact CE2-OE2 3.27Å; F281-E361 WeakPolarHBondContact CE2-OE2 3.33Å
282	C	96.4	Very high	88.3	Confident	4 Å²	4	31 Å²	31	3%	0.027	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	125.4	-175.7	-173.2	0	0	0	0	111.4	R77 V276 M279 K280 G284 G346 F347	R77-C282 VanDerWaalsContact CZ-O 3.26Å; R77-C282 PolarHBondContact NH1-O 3.09Å; R77-C282 PolarHBondContact NH2-O 3.47Å; V276-C282 WeakPolarHBondContact O-CB 3.47Å; M279-C282 HydrophobicContact CB-CB 4.13Å; M279-C282 PolarHBondContact O-N 3.46Å; K280-C282 PolarHBondContact O-N 3.48Å; C282-G284 PolarHBondContact SG-N 2.98Å; C282-G346 WeakPolarHBondContact CA-O 3.41Å; C282-F347 HydrophobicContact CB-CD1 4.28Å; C282-F347 HydrophobicContact CB-CE1 4.35Å
283	V	96.5	Very high	88.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	23.6	172	-65.7	0	0	0	0	111.7	L70 E73 L253 F281 Y295 G346	L70-V283 HydrophobicContact CD2-CG2 4Å; L70-V283 HydrophobicContact CG-CG2 4.08Å; E73-V283 HydrophobicContact CG-CB 3.78Å; E73-V283 HydrophobicContact CG-CG1 4.03Å; L253-V283 HydrophobicContact CD1-CG2 3.76Å; F281-V283 PolarHBondContact O-N 2.73Å; V283-Y295 WeakPolarHBondContact O-CE2 3.47Å; V283-Y295 PolarHBondContact O-OH 3.26Å; V283-G346 VanDerWaalsContact CG2-C 3.43Å; V283-G346 WeakPolarHBondContact CG2-O 3.34Å; V283-G346 PolarHBondContact N-O 2.79Å
284	G	96.9	Very high	88.7	Confident	5 Å²	5	32.1 Å²	32.1	5%	0.052	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.6	-174.1	178	0	0	0	0	0	114.4	C282 Y296 G346	C282-G284 PolarHBondContact SG-N 2.98Å; G284-Y296 CarbonylContact C-O 3.55Å; G284-Y296 WeakPolarHBondContact CA-O 3.45Å; G284-G346 PolarHBondContact O-N 2.81Å
285	I	97.4	Very high	89	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128	-171.5	-54.8	177.4	0	0	0	110.1	L273 L277 Y295 Y296 M339 C343 T344 I345	L273-I285 HydrophobicContact CD2-CD1 3.85Å; L277-I285 HydrophobicContact CD1-CD1 4.15Å; L277-I285 HydrophobicContact CD2-CD1 3.83Å; L277-I285 HydrophobicContact CD2-CG1 3.9Å; L277-I285 HydrophobicContact CG-CD1 3.84Å; L277-I285 HydrophobicContact CG-CG1 4.46Å; I285-Y295 WeakPolarHBondContact O-CA 3.43Å; I285-Y296 HydrophobicContact CB-CD2 4.01Å; I285-Y296 HydrophobicContact CG2-CD2 4.02Å; I285-Y296 PolarHBondContact N-O 3.13Å; I285-Y296 WeakPolarHBondContact O-CD2 3.49Å; I285-Y296 PolarHBondContact O-N 2.83Å; I285-M339 HydrophobicContact CG2-CE 4.09Å; I285-C343 HydrophobicContact CG2-CB 3.73Å; I285-T344 CarbonylContact C-O 3.5Å; I285-T344 WeakPolarHBondContact CA-O 3.08Å; I285-T344 WeakPolarHBondContact CG2-O 3.25Å; I285-I345 HydrophobicContact CD1-CD1 4.35Å; I285-I345 HydrophobicContact CD1-CG1 4.06Å; I285-I345 HydrophobicContact CG1-CB 4.33Å; I285-I345 HydrophobicContact CG1-CG1 4.02Å; I285-I345 HydrophobicContact CG1-CG2 4.17Å; I285-I345 HydrophobicContact CG2-CG1 4.26Å
286	I	96.5	Very high	89.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.9	166.7	-58.4	157.2	0	0	0	107.4	T63 L70 P140 C343 T344	T63-I286 HydrophobicContact CG2-CG2 4.05Å; L70-I286 HydrophobicContact CB-CD1 4.09Å; L70-I286 HydrophobicContact CB-CG1 4.1Å; L70-I286 HydrophobicContact CD1-CD1 3.82Å; L70-I286 HydrophobicContact CD1-CG1 3.77Å; L70-I286 HydrophobicContact CG-CD1 4.45Å; P140-I286 HydrophobicContact CB-CB 4.5Å; P140-I286 HydrophobicContact CB-CG2 4.13Å; P140-I286 HydrophobicContact CG-CG2 4.23Å; I286-C343 CarbonylContact O-C 3.53Å; I286-C343 WeakPolarHBondContact O-CA 3.35Å; I286-C343 WeakPolarHBondContact O-CB 3.45Å; I286-T344 PolarHBondContact N-O 3.32Å; I286-T344 PolarHBondContact O-N 3.23Å
287	G	91.7	Very high	89.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	166.2	175.2	0	0	0	0	0	114	A293 M294	G287-A293 CarbonylContact O-C 3.43Å; G287-A293 WeakPolarHBondContact O-CA 3.47Å; G287-M294 PolarHBondContact N-O 3.2Å; G287-M294 VanDerWaalsContact N-O 3.15Å; G287-M294 PolarHBondContact O-N 3.17Å
288	G	76.7	Confident	89.4	Confident	7 Å²	7	29 Å²	29	7%	0.072	14%	0.143	C	C	.	.			trans	120.4	158.5	-174.2	0	0	0	0	0	112.9	D340 N342	G288-D340 VanDerWaalsContact CA-CB 3.5Å; G288-N342 PolarHBondContact N-O 3.45Å
289	R	69.9	Low	89.5	Confident	146 Å²	146	28 Å²	28	55%	0.551	13%	0.133	S	C	*	.	S	Bend	trans	-64.2	158.3	179.2	-65.4	-174.6	-179.8	-177.8	-2.9	111.8	E263 S291 R292 A293 D340	E263-R289 PolarHBondContact O-NH2 3.21Å; R289-S291 PolarHBondContact O-N 3.33Å; R289-R292 CarbonylContact O-C 3.43Å; R289-R292 PolarHBondContact O-N 2.92Å; R289-A293 PolarHBondContact O-N 3.45Å; R289-D340 WeakPolarHBondContact CD-OD2 3.43Å; R289-D340 HydrophobicContact CG-CB 4.13Å; R289-D340 VanDerWaalsContact CG-CG 3.47Å; R289-D340 WeakPolarHBondContact CG-OD2 3.49Å; R289-D340 IonicContact CZ-OD2 3.59Å; R289-D340 IonicContact NE-OD2 2.84Å; R289-D340 PolarHBondContact NE-OD2 3.28Å; R289-D340 IonicContact NH2-OD2 3.25Å
290	A	61.1	Low	89.4	Confident	51 Å²	51	29.6 Å²	29.6	42%	0.421	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	101.5	170.5	0	0	0	0	0	111.6	R137	R137-A290 HydrophobicContact CB-CB 4.01Å; R137-A290 WeakPolarHBondContact CD-O 3.42Å; R137-A290 PolarHBondContact NH1-O 2.85Å
291	S	67.9	Low	89.4	Confident	41 Å²	41	31.7 Å²	31.7	29%	0.287	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.2	9.3	-170.6	89.9	0	0	0	0	117.6	C62 R137 R289 H310	C62-S291 VanDerWaalsContact SG-CA 3.54Å; R137-S291 PolarHBondContact NH1-OG 2.92Å; R289-S291 PolarHBondContact O-N 3.33Å; S291-H310 PolarHBondContact O-NE2 3.43Å
292	R	85.4	Confident	89.2	Confident	187 Å²	187	35.9 Å²	35.9	71%	0.706	17%	0.169	S	C	*	.			trans	-143.3	28.9	171.8	-65.3	-169.1	-179.9	179.7	0.4	112.1	R289	R289-R292 CarbonylContact O-C 3.43Å; R289-R292 PolarHBondContact O-N 2.92Å
293	A	93.3	Very high	89	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.185	C	C	.	.			trans	-71.7	136.7	179.6	0	0	0	0	0	111.3	C62 T63 G287 R289 P309 H310	C62-A293 HydrophobicContact CB-CB 4.23Å; T63-A293 HydrophobicContact CG2-CB 4Å; T63-A293 WeakPolarHBondContact OG1-CB 3.21Å; G287-A293 CarbonylContact O-C 3.43Å; G287-A293 WeakPolarHBondContact O-CA 3.47Å; R289-A293 PolarHBondContact O-N 3.45Å; A293-P309 VanDerWaalsContact O-CD 3.31Å; A293-P309 WeakPolarHBondContact O-CD 3.24Å; A293-P309 WeakPolarHBondContact O-CG 3.32Å; A293-H310 PolarHBondContact O-CE1 3.4Å
294	M	95.4	Very high	88.9	Confident	32 Å²	32	40.1 Å²	40.1	16%	0.158	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	166.5	176.6	-73.3	176.4	-77.9	0	0	109.6	S66 G287 Y296 C306 L334	S66-M294 VanDerWaalsContact OG-C 3.27Å; S66-M294 PolarHBondContact OG-O 3Å; G287-M294 PolarHBondContact N-O 3.2Å; G287-M294 VanDerWaalsContact N-O 3.15Å; G287-M294 PolarHBondContact O-N 3.17Å; M294-Y296 HydrophobicContact CB-CE1 3.95Å; M294-Y296 HydrophobicContact CE-CE1 4.3Å; M294-C306 HydrophobicContact SD-CB 4.12Å; M294-L334 HydrophobicContact CE-CD1 4.44Å; M294-L334 HydrophobicContact CE-CD2 3.79Å
295	Y	97.4	Very high	88.8	Confident	1 Å²	1	40 Å²	40	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.9	171.7	173	-131.6	0	0	0	108.4	M69 L70 E73 V283 I285 V297 C306 M307	M69-Y295 HydrophobicContact CB-CD1 3.46Å; M69-Y295 VanDerWaalsContact CB-CD1 3.46Å; M69-Y295 HydrophobicContact CB-CE1 3.83Å; M69-Y295 HydrophobicContact CB-CG 3.98Å; M69-Y295 HydrophobicContact CE-CD1 4.49Å; M69-Y295 HydrophobicContact CG-CD1 4.36Å; M69-Y295 HydrophobicContact SD-CD1 4.11Å; L70-Y295 HydrophobicContact CB-CD2 4.24Å; L70-Y295 HydrophobicContact CB-CE2 3.79Å; L70-Y295 HydrophobicContact CD1-CE2 4.3Å; L70-Y295 HydrophobicContact CG-CE2 4.2Å; E73-Y295 VanDerWaalsContact CB-OH 3.31Å; E73-Y295 WeakPolarHBondContact CB-OH 3.46Å; E73-Y295 WeakPolarHBondContact CG-OH 3.49Å; V283-Y295 WeakPolarHBondContact O-CE2 3.47Å; V283-Y295 PolarHBondContact O-OH 3.26Å; I285-Y295 WeakPolarHBondContact O-CA 3.43Å; Y295-V297 HydrophobicContact CD1-CG1 3.62Å; Y295-V297 HydrophobicContact CE1-CG1 3.35Å; Y295-V297 HydrophobicContact CE2-CG1 4.46Å; Y295-V297 HydrophobicContact CG-CG1 4.3Å; Y295-C306 WeakPolarHBondContact O-CA 3.5Å; Y295-M307 HydrophobicContact CD1-CB 4.11Å; Y295-M307 HydrophobicContact CD1-CG 4.44Å; Y295-M307 HydrophobicContact CD1-SD 4.29Å; Y295-M307 PolarHBondContact N-O 2.97Å; Y295-M307 PolarHBondContact O-N 3.47Å
296	Y	96.5	Very high	88.6	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.5	-178.8	-48.5	-65.3	0	0	0	109.5	G284 I285 M294 L304 I305 C306 L334 M339	G284-Y296 CarbonylContact C-O 3.55Å; G284-Y296 WeakPolarHBondContact CA-O 3.45Å; I285-Y296 HydrophobicContact CB-CD2 4.01Å; I285-Y296 HydrophobicContact CG2-CD2 4.02Å; I285-Y296 PolarHBondContact N-O 3.13Å; I285-Y296 WeakPolarHBondContact O-CD2 3.49Å; I285-Y296 PolarHBondContact O-N 2.83Å; M294-Y296 HydrophobicContact CB-CE1 3.95Å; M294-Y296 HydrophobicContact CE-CE1 4.3Å; Y296-L304 HydrophobicContact CD1-CB 3.87Å; Y296-L304 HydrophobicContact CD1-CD1 3.99Å; Y296-L304 HydrophobicContact CD1-CG 4.36Å; Y296-L304 HydrophobicContact CE1-CB 4.35Å; Y296-L304 HydrophobicContact CE1-CD1 3.97Å; Y296-L304 HydrophobicContact CG-CB 4.47Å; Y296-L304 HydrophobicContact CG-CD1 4.28Å; Y296-L304 HydrophobicContact CG-CD2 4.34Å; Y296-I305 WeakPolarHBondContact CA-O 3.4Å; Y296-C306 HydrophobicContact CD1-CB 4.26Å; Y296-C306 VanDerWaalsContact CD1-SG 3.5Å; Y296-L334 HydrophobicContact CE1-CD2 3.76Å; Y296-L334 WeakPolarHBondContact OH-CD2 3.32Å; Y296-M339 HydrophobicContact CD2-CE 4.31Å; Y296-M339 HydrophobicContact CE2-CE 3.98Å; Y296-M339 HydrophobicContact CE2-CG 4.11Å; Y296-M339 HydrophobicContact CE2-SD 4.19Å
297	V	94.8	Very high	88.6	Confident	13 Å²	13	40.1 Å²	40.1	8%	0.079	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-5.7	-171	-63.9	0	0	0	0	114	F34 Y295 I305 M307	F34-V297 HydrophobicContact CD2-CG2 3.94Å; F34-V297 HydrophobicContact CE2-CG2 3.84Å; Y295-V297 HydrophobicContact CD1-CG1 3.62Å; Y295-V297 HydrophobicContact CE1-CG1 3.35Å; Y295-V297 HydrophobicContact CE2-CG1 4.46Å; Y295-V297 HydrophobicContact CG-CG1 4.3Å; V297-I305 HydrophobicContact CG2-CB 4.32Å; V297-I305 HydrophobicContact CG2-CG2 3.87Å; V297-I305 PolarHBondContact N-O 2.74Å; V297-M307 HydrophobicContact CG1-CG 4.2Å; V297-M307 HydrophobicContact CG1-SD 4.47Å
298	G	93.9	Very high	88.7	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-168.4	-177.2	0	0	0	0	0	111.3	I305	G298-I305 PolarHBondContact O-N 3.23Å
299	W	93.8	Very high	89.7	Confident	22 Å²	22	40.9 Å²	40.9	8%	0.083	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	160.4	-177.8	68.9	-85	0	0	0	112.7	Q4 K274 S278 Y303 F336	Q4-W299 HydrophobicContact CB-CH2 4.42Å; Q4-W299 HydrophobicContact CB-CZ2 3.87Å; Q4-W299 HydrophobicContact CG-CH2 3.78Å; Q4-W299 HydrophobicContact CG-CZ2 3.75Å; K274-W299 HydrophobicContact CB-CD2 4.06Å; K274-W299 HydrophobicContact CB-CG 4.38Å; K274-W299 HydrophobicContact CB-CZ2 4.16Å; K274-W299 HydrophobicContact CD-CD2 4.27Å; K274-W299 HydrophobicContact CD-CE3 3.94Å; K274-W299 HydrophobicContact CD-CH2 4.16Å; K274-W299 HydrophobicContact CD-CZ2 4.45Å; K274-W299 HydrophobicContact CD-CZ3 3.89Å; K274-W299 HydrophobicContact CG-CD2 3.76Å; K274-W299 HydrophobicContact CG-CE3 3.9Å; K274-W299 HydrophobicContact CG-CG 4.13Å; K274-W299 HydrophobicContact CG-CZ2 4.45Å; K274-W299 HydrophobicContact CG-CZ3 4.32Å; K274-W299 PolarHBondContact O-NE1 2.88Å; K274-W299 VanDerWaalsContact O-NE1 3.11Å; S278-W299 PolarHBondContact OG-NE1 2.8Å; S278-W299 VanDerWaalsContact OG-NE1 3.08Å; W299-Y303 CarbonylContact C-O 3.52Å; W299-Y303 VanDerWaalsContact CA-O 3.29Å; W299-Y303 WeakPolarHBondContact CA-O 3.48Å; W299-F336 HydrophobicContact CB-CE2 4.11Å; W299-F336 HydrophobicContact CB-CZ 3.81Å; W299-F336 HydrophobicContact CG-CZ 4.44Å
300	H	90.5	Very high	90.9	Very high	34 Å²	34	37 Å²	37	16%	0.157	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	120.2	173.1	169.5	87.7	0	0	0	110	Y5 D302 Y303 I305	Y5-H300 PolarHBondContact O-CE1 3.16Å; Y5-H300 PolarHBondContact O-ND1 2.84Å; H300-D302 PolarHBondContact O-N 2.95Å; H300-Y303 PolarHBondContact N-O 3.47Å; H300-Y303 WeakPolarHBondContact O-CB 3.36Å; H300-Y303 PolarHBondContact O-N 3.17Å; H300-I305 HydrophobicContact CB-CD1 4.25Å
301	R	89.5	Confident	92.5	Very high	115 Å²	115	41.4 Å²	41.4	43%	0.434	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	-121.4	-172.6	-61.3	178.5	174.9	176.7	-0	109.3	E9	E9-R301 IonicContact OE2-NH2 2.83Å; E9-R301 PolarHBondContact OE2-NH2 2.85Å
302	D	91.3	Very high	93.8	Very high	94 Å²	94	41.6 Å²	41.6	50%	0.503	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	16.1	-179.4	-51.3	-58.3	0	0	0	114.3	H300 L335 F336	H300-D302 PolarHBondContact O-N 2.95Å; D302-L335 HydrophobicContact CB-CD2 4.36Å; D302-L335 WeakPolarHBondContact O-CA 3.48Å; D302-F336 WeakPolarHBondContact O-CD2 3.48Å; D302-F336 PolarHBondContact O-N 3.38Å; D302-F336 VanDerWaalsContact O-N 3.08Å
303	Y	93.2	Very high	94.4	Very high	92 Å²	92	34 Å²	34	36%	0.361	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.4	-176.3	-60.4	-95.1	0	0	0	112.6	W299 H300 K333 L334 L335	W299-Y303 CarbonylContact C-O 3.52Å; W299-Y303 VanDerWaalsContact CA-O 3.29Å; W299-Y303 WeakPolarHBondContact CA-O 3.48Å; H300-Y303 PolarHBondContact N-O 3.47Å; H300-Y303 WeakPolarHBondContact O-CB 3.36Å; H300-Y303 PolarHBondContact O-N 3.17Å; Y303-K333 HydrophobicContact CD1-CB 3.82Å; Y303-K333 HydrophobicContact CG-CB 4.17Å; Y303-K333 HydrophobicContact CG-CD 4.3Å; Y303-L334 CarbonylContact C-O 3.56Å; Y303-L334 VanDerWaalsContact CA-O 3.29Å; Y303-L334 WeakPolarHBondContact CA-O 3.44Å; Y303-L335 HydrophobicContact CD1-CD2 3.89Å; Y303-L335 HydrophobicContact CD1-CG 4.04Å; Y303-L335 HydrophobicContact CD2-CD2 4.45Å; Y303-L335 HydrophobicContact CE1-CD2 3.44Å; Y303-L335 VanDerWaalsContact CE1-CD2 3.44Å; Y303-L335 HydrophobicContact CE1-CG 3.61Å; Y303-L335 HydrophobicContact CE2-CD2 4.03Å; Y303-L335 HydrophobicContact CG-CD2 4.38Å; Y303-L335 VanDerWaalsContact CZ-CD2 3.5Å
304	L	93.7	Very high	94.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	137.7	159.5	-68.5	162.3	0	0	0	109.8	L277 Y296 C306 K333 L334 F336 M339	L277-L304 HydrophobicContact CD1-CD2 3.41Å; L277-L304 VanDerWaalsContact CD1-CD2 3.41Å; Y296-L304 HydrophobicContact CD1-CB 3.87Å; Y296-L304 HydrophobicContact CD1-CD1 3.99Å; Y296-L304 HydrophobicContact CD1-CG 4.36Å; Y296-L304 HydrophobicContact CE1-CB 4.35Å; Y296-L304 HydrophobicContact CE1-CD1 3.97Å; Y296-L304 HydrophobicContact CG-CB 4.47Å; Y296-L304 HydrophobicContact CG-CD1 4.28Å; Y296-L304 HydrophobicContact CG-CD2 4.34Å; L304-C306 PolarHBondContact O-SG 2.87Å; L304-C306 VanDerWaalsContact O-SG 3.35Å; L304-K333 WeakPolarHBondContact O-CA 3.39Å; L304-L334 HydrophobicContact CB-CB 4.43Å; L304-L334 HydrophobicContact CD1-CD2 4.33Å; L304-L334 PolarHBondContact N-O 2.96Å; L304-L334 PolarHBondContact O-N 3.02Å; L304-F336 HydrophobicContact CD1-CD1 4.1Å; L304-F336 HydrophobicContact CD1-CE1 4.43Å; L304-F336 HydrophobicContact CD2-CD1 3.85Å; L304-F336 HydrophobicContact CD2-CE1 3.33Å; L304-F336 HydrophobicContact CD2-CZ 3.74Å; L304-F336 HydrophobicContact CG-CD1 3.78Å; L304-F336 HydrophobicContact CG-CE1 3.74Å; L304-F336 HydrophobicContact CG-CE2 4.47Å; L304-F336 HydrophobicContact CG-CG 4.19Å; L304-F336 HydrophobicContact CG-CZ 4.09Å; L304-M339 HydrophobicContact CD1-CB 3.99Å; L304-M339 HydrophobicContact CD1-CG 4.05Å; L304-M339 HydrophobicContact CD1-SD 3.63Å
305	I	94.7	Very high	94.7	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.5	171.9	-58.8	172	0	0	0	107.8	Y5 F30 F34 Y296 V297 G298 H300 P331	Y5-I305 HydrophobicContact CD2-CD1 3.87Å; Y5-I305 HydrophobicContact CE2-CD1 4.23Å; F30-I305 HydrophobicContact CE2-CD1 3.81Å; F30-I305 HydrophobicContact CE2-CG2 4.06Å; F30-I305 HydrophobicContact CZ-CD1 4Å; F30-I305 HydrophobicContact CZ-CG2 3.93Å; F34-I305 HydrophobicContact CD2-CG2 3.91Å; F34-I305 HydrophobicContact CE2-CG2 3.86Å; Y296-I305 WeakPolarHBondContact CA-O 3.4Å; V297-I305 HydrophobicContact CG2-CB 4.32Å; V297-I305 HydrophobicContact CG2-CG2 3.87Å; V297-I305 PolarHBondContact N-O 2.74Å; G298-I305 PolarHBondContact O-N 3.23Å; H300-I305 HydrophobicContact CB-CD1 4.25Å; I305-P331 HydrophobicContact CG2-CB 4.26Å
306	C	94.1	Very high	94.6	Very high	2 Å²	2	44 Å²	44	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.1	-163.6	-47.2	0	0	0	0	111.9	M294 Y295 Y296 L304 K332	M294-C306 HydrophobicContact SD-CB 4.12Å; Y295-C306 WeakPolarHBondContact O-CA 3.5Å; Y296-C306 HydrophobicContact CD1-CB 4.26Å; Y296-C306 VanDerWaalsContact CD1-SG 3.5Å; L304-C306 PolarHBondContact O-SG 2.87Å; L304-C306 VanDerWaalsContact O-SG 3.35Å; C306-K332 HydrophobicContact CB-CB 4.21Å; C306-K332 PolarHBondContact N-O 3.33Å; C306-K332 PolarHBondContact O-N 3.16Å
307	M	95.3	Very high	94.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.5	156.2	-70.1	-162.1	157.8	0	0	109.4	F34 R37 W39 M69 Y295 V297 C328	F34-M307 HydrophobicContact CD1-CE 4.42Å; F34-M307 HydrophobicContact CD2-CE 4.31Å; F34-M307 HydrophobicContact CE1-CE 4.08Å; F34-M307 HydrophobicContact CE2-CE 3.95Å; F34-M307 HydrophobicContact CE2-CG 3.82Å; F34-M307 HydrophobicContact CZ-CE 3.81Å; F34-M307 HydrophobicContact CZ-CG 3.73Å; F34-M307 WeakPolarHBondContact O-CE 3.43Å; R37-M307 HydrophobicContact CB-CE 3.5Å; R37-M307 VanDerWaalsContact CB-CE 3.5Å; R37-M307 HydrophobicContact CB-SD 4.17Å; W39-M307 HydrophobicContact CB-SD 4.21Å; M69-M307 HydrophobicContact CE-CB 4.29Å; M69-M307 HydrophobicContact SD-CB 3.87Å; M69-M307 HydrophobicContact SD-SD 4.23Å; Y295-M307 HydrophobicContact CD1-CB 4.11Å; Y295-M307 HydrophobicContact CD1-CG 4.44Å; Y295-M307 HydrophobicContact CD1-SD 4.29Å; Y295-M307 PolarHBondContact N-O 2.97Å; Y295-M307 PolarHBondContact O-N 3.47Å; V297-M307 HydrophobicContact CG1-CG 4.2Å; V297-M307 HydrophobicContact CG1-SD 4.47Å; M307-C328 HydrophobicContact CE-CB 4.24Å
308	D	95.2	Very high	94.4	Very high	23 Å²	23	55.1 Å²	55.1	12%	0.123	24%	0.239	C	C	.	.			trans	-104.8	115.3	-171.3	-178.8	-1.3	0	0	0	110.8	W39 H310 K332	W39-D308 WeakPolarHBondContact CZ2-O 3.33Å; W39-D308 PolarHBondContact NE1-O 3.37Å; D308-H310 VanDerWaalsContact C-N 3.27Å; D308-H310 PolarHBondContact O-N 2.88Å; D308-H310 WeakPolarHBondContact OD1-CB 3.24Å; D308-H310 IonicContact OD1-CE1 2.94Å; D308-H310 IonicContact OD1-CG 2.75Å; D308-H310 PolarHBondContact OD1-N 3.31Å; D308-H310 IonicContact OD1-ND1 2.68Å; D308-H310 PolarHBondContact OD1-ND1 3.45Å; D308-K332 HydrophobicContact CB-CD 3.81Å; D308-K332 WeakPolarHBondContact OD2-CD 3.4Å; D308-K332 WeakPolarHBondContact OD2-CE 3.35Å; D308-K332 IonicContact OD2-NZ 2.7Å; D308-K332 PolarHBondContact OD2-NZ 2.87Å
309	P	96.4	Very high	94.3	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	28%	0.279	C	S	.	.			trans	-78.1	-4.5	-179.3	32.5	-36	0	0	0	113.9	S41 Y42 C62 R65 M69 A293 Y311	S41-P309 CarbonylContact C-O 3.59Å; S41-P309 WeakPolarHBondContact CA-O 3.36Å; S41-P309 WeakPolarHBondContact CB-O 3.32Å; Y42-P309 PolarHBondContact N-O 3.22Å; C62-P309 HydrophobicContact CB-CG 3.91Å; R65-P309 HydrophobicContact CB-CB 3.72Å; R65-P309 HydrophobicContact CG-CB 4.43Å; M69-P309 HydrophobicContact CE-CB 4.23Å; A293-P309 VanDerWaalsContact O-CD 3.31Å; A293-P309 WeakPolarHBondContact O-CD 3.24Å; A293-P309 WeakPolarHBondContact O-CG 3.32Å; P309-Y311 PolarHBondContact O-N 2.9Å
310	H	95.6	Very high	94.2	Very high	65 Å²	65	63.2 Å²	63.2	30%	0.301	29%	0.289	S	S	.	.			trans	-76.5	17.8	-170.5	-59.3	85.7	0	0	0	115.5	Y42 S291 A293 D308	Y42-H310 HydrophobicContact CE2-CB 4.13Å; Y42-H310 AromaticContact CE2-CD2 3.64Å; Y42-H310 AromaticContact CZ-CD2 3.91Å; S291-H310 PolarHBondContact O-NE2 3.43Å; A293-H310 PolarHBondContact O-CE1 3.4Å; D308-H310 VanDerWaalsContact C-N 3.27Å; D308-H310 PolarHBondContact O-N 2.88Å; D308-H310 WeakPolarHBondContact OD1-CB 3.24Å; D308-H310 IonicContact OD1-CE1 2.94Å; D308-H310 IonicContact OD1-CG 2.75Å; D308-H310 PolarHBondContact OD1-N 3.31Å; D308-H310 IonicContact OD1-ND1 2.68Å; D308-H310 PolarHBondContact OD1-ND1 3.45Å
311	Y	94.9	Very high	94	Very high	143 Å²	143	67 Å²	67	56%	0.561	32%	0.315	S	S	*	.	S	Bend	trans	-101.6	127.6	173.5	-173.1	-116.6	0	0	0	111	W39 S41 Y42 P309 Q313	W39-Y311 AromaticContact CH2-CD1 3.67Å; W39-Y311 HydrophobicContact CH2-CD1 3.67Å; W39-Y311 HydrophobicContact CH2-CG 4.14Å; W39-Y311 HydrophobicContact CZ2-CD1 4.41Å; W39-Y311 HydrophobicContact CZ3-CD1 4.44Å; S41-Y311 WeakPolarHBondContact CB-O 3.24Å; S41-Y311 PolarHBondContact OG-O 3.16Å; Y42-Y311 PolarHBondContact N-O 3.07Å; Y42-Y311 VanDerWaalsContact O-O 3.06Å; P309-Y311 PolarHBondContact O-N 2.9Å; Y311-Q313 HydrophobicContact CD1-CG 3.43Å; Y311-Q313 VanDerWaalsContact CD1-CG 3.43Å; Y311-Q313 HydrophobicContact CE1-CG 3.61Å
312	S	96.1	Very high	94	Very high	45 Å²	45	64.9 Å²	64.9	32%	0.315	32%	0.318	S	S	.	.			trans	-90.8	118	-175.8	-156.7	0	0	0	0	111.6	Y42 F44	Y42-S312 WeakPolarHBondContact O-CA 2.99Å; F44-S312 WeakPolarHBondContact CD1-OG 3.4Å
313	Q	97.2	Very high	94.1	Very high	26 Å²	26	60.9 Å²	60.9	12%	0.121	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	161.3	-176.4	-61.3	-166.2	87.1	0	0	111.7	S41 Y42 R43 F44 Y311 S325	S41-Q313 PolarHBondContact OG-NE2 3.23Å; Y42-Q313 PolarHBondContact O-N 3.06Å; R43-Q313 CarbonylContact C-O 3.55Å; R43-Q313 WeakPolarHBondContact CA-O 3.17Å; F44-Q313 VanDerWaalsContact CD1-C 3.46Å; F44-Q313 WeakPolarHBondContact CD1-O 3.43Å; F44-Q313 WeakPolarHBondContact CE1-O 3.4Å; F44-Q313 PolarHBondContact N-O 3.07Å; Y311-Q313 HydrophobicContact CD1-CG 3.43Å; Y311-Q313 VanDerWaalsContact CD1-CG 3.43Å; Y311-Q313 HydrophobicContact CE1-CG 3.61Å; Q313-S325 PolarHBondContact NE2-O 2.78Å; Q313-S325 VanDerWaalsContact NE2-O 3.07Å
314	R	97.6	Very high	94	Very high	204 Å²	204	61.3 Å²	61.3	77%	0.77	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	145.7	171.5	-72.7	-178.1	174.2	178.9	-1.9	110.7	R43 F44	R43-R314 WeakPolarHBondContact CD-O 3.19Å; R43-R314 PolarHBondContact NH1-O 3Å; F44-R314 HydrophobicContact CE1-CG 4.41Å; F44-R314 HydrophobicContact CE2-CG 4.03Å; F44-R314 HydrophobicContact CZ-CG 3.77Å
315	A	97.7	Very high	94	Very high	27 Å²	27	63 Å²	63	22%	0.223	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-48.7	134.5	177.8	0	0	0	0	0	113.7	F44 F46 D111	F44-A315 PolarHBondContact O-N 3.19Å; F46-A315 HydrophobicContact CB-CB 3.69Å; D111-A315 HydrophobicContact CB-CB 4.19Å; D111-A315 WeakPolarHBondContact OD2-CA 3.47Å
316	L	96	Very high	94	Very high	12 Å²	12	62.8 Å²	62.8	6%	0.063	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-74.8	126.4	175.7	-170.3	64.5	0	0	0	109.6	L40 V106 A110 D111 F323 C326	L40-L316 HydrophobicContact CD2-CD2 4.32Å; V106-L316 HydrophobicContact CG1-CD2 4.02Å; A110-L316 HydrophobicContact CB-CG 4.42Å; D111-L316 PolarHBondContact N-O 2.73Å; D111-L316 WeakPolarHBondContact OD2-CB 3.48Å; D111-L316 PolarHBondContact OD2-N 2.9Å; L316-F323 HydrophobicContact CD1-CD1 3.47Å; L316-F323 VanDerWaalsContact CD1-CD1 3.47Å; L316-F323 HydrophobicContact CD1-CE1 3.9Å; L316-F323 HydrophobicContact CD1-CG 4.47Å; L316-F323 HydrophobicContact CG-CD1 4.36Å; L316-F323 HydrophobicContact CG-CE1 4.36Å; L316-C326 VanDerWaalsContact CD1-SG 3.54Å
317	R	94.6	Very high	94	Very high	201 Å²	201	64.3 Å²	64.3	76%	0.758	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-96.8	128	-179.5	-67	-178.7	172.3	-167.8	-4.1	110.4	N319 A320	R317-N319 PolarHBondContact O-N 2.76Å; R317-A320 HydrophobicContact CB-CB 4.37Å; R317-A320 WeakPolarHBondContact O-CB 3.29Å; R317-A320 PolarHBondContact O-N 3.25Å; R317-A320 VanDerWaalsContact O-N 3.14Å
318	K	92.2	Very high	93.8	Very high	47 Å²	47	64.8 Å²	64.8	20%	0.204	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-38.1	-178.6	-170.4	163.3	-168.8	172.2	0	113.4	A107 E108 A110 E114 A115	A107-K318 HydrophobicContact CB-CG 4.06Å; A107-K318 WeakPolarHBondContact CB-O 3.43Å; A107-K318 WeakPolarHBondContact O-CG 3.44Å; E108-K318 WeakPolarHBondContact OE1-CE 3.19Å; E108-K318 IonicContact OE1-NZ 3.76Å; E108-K318 PolarHBondContact OE1-NZ 3Å; E108-K318 IonicContact OE2-NZ 2.93Å; E108-K318 PolarHBondContact OE2-NZ 3.06Å; A110-K318 HydrophobicContact CB-CB 3.78Å; A110-K318 HydrophobicContact CB-CG 4.46Å; E114-K318 HydrophobicContact CB-CD 4.37Å; E114-K318 PolarHBondContact O-NZ 3.35Å; A115-K318 HydrophobicContact CB-CD 4.19Å
319	N	91.9	Very high	93.5	Very high	157 Å²	157	70.6 Å²	70.6	84%	0.84	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	26.6	-177.2	-55.9	-15.7	0	0	0	113.3	R317	R317-N319 PolarHBondContact O-N 2.76Å
320	A	90.5	Very high	93.2	Very high	37 Å²	37	80.3 Å²	80.3	31%	0.306	39%	0.391	S	S	.	.			trans	-72.3	145.8	176.1	0	0	0	0	0	111.4	R317 S322 F323	R317-A320 HydrophobicContact CB-CB 4.37Å; R317-A320 WeakPolarHBondContact O-CB 3.29Å; R317-A320 PolarHBondContact O-N 3.25Å; R317-A320 VanDerWaalsContact O-N 3.14Å; A320-S322 VanDerWaalsContact C-N 3.33Å; A320-F323 HydrophobicContact CB-CD1 4.1Å; A320-F323 HydrophobicContact CB-CE1 3.66Å; A320-F323 HydrophobicContact CB-CZ 4.31Å
321	T	87.4	Confident	93	Very high	114 Å²	114	79.2 Å²	79.2	70%	0.699	39%	0.39	S	S	*	.	S	Bend	trans	-74.7	-23.8	176.9	48.9	0	0	0	0	113	R103	R103-T321 PolarHBondContact NE-O 2.81Å; R103-T321 PolarHBondContact NH1-O 2.72Å; R103-T321 VanDerWaalsContact NH1-O 3.16Å
322	S	89.2	Confident	92.9	Very high	70 Å²	70	77.7 Å²	77.7	49%	0.49	39%	0.386	S	S	.	.			trans	-151.1	160.9	177.3	68	0	0	0	0	111.4	A320 P324	A320-S322 VanDerWaalsContact C-N 3.33Å; S322-P324 VanDerWaalsContact C-CD 3.42Å
323	F	92	Very high	92.8	Very high	9 Å²	9	81.3 Å²	81.3	4%	0.039	40%	0.396	C	S	.	.			trans	-127.7	53.2	-173.8	-59.4	-63.6	0	0	0	113.3	Y102 R103 V106 A107 L316 A320 S325 C326	Y102-F323 HydrophobicContact CE1-CD2 4.48Å; R103-F323 HydrophobicContact CB-CE2 4.08Å; R103-F323 HydrophobicContact CG-CD2 4.4Å; R103-F323 HydrophobicContact CG-CE2 4.27Å; R103-F323 WeakPolarHBondContact O-CE2 3.27Å; V106-F323 HydrophobicContact CB-CD2 3.74Å; V106-F323 HydrophobicContact CB-CE2 3.9Å; V106-F323 HydrophobicContact CB-CG 4.23Å; V106-F323 HydrophobicContact CB-CZ 4.47Å; V106-F323 HydrophobicContact CG1-CB 3.9Å; V106-F323 HydrophobicContact CG1-CD1 3.82Å; V106-F323 HydrophobicContact CG1-CD2 3.53Å; V106-F323 HydrophobicContact CG1-CE1 4.11Å; V106-F323 HydrophobicContact CG1-CE2 3.9Å; V106-F323 HydrophobicContact CG1-CG 3.48Å; V106-F323 VanDerWaalsContact CG1-CG 3.48Å; V106-F323 HydrophobicContact CG1-CZ 4.16Å; A107-F323 HydrophobicContact CB-CZ 4.3Å; L316-F323 HydrophobicContact CD1-CD1 3.47Å; L316-F323 VanDerWaalsContact CD1-CD1 3.47Å; L316-F323 HydrophobicContact CD1-CE1 3.9Å; L316-F323 HydrophobicContact CD1-CG 4.47Å; L316-F323 HydrophobicContact CG-CD1 4.36Å; L316-F323 HydrophobicContact CG-CE1 4.36Å; A320-F323 HydrophobicContact CB-CD1 4.1Å; A320-F323 HydrophobicContact CB-CE1 3.66Å; A320-F323 HydrophobicContact CB-CZ 4.31Å; F323-S325 PolarHBondContact O-N 2.76Å; F323-S325 VanDerWaalsContact O-N 3.16Å; F323-C326 HydrophobicContact CB-CB 4.14Å; F323-C326 WeakPolarHBondContact O-CB 3.42Å; F323-C326 PolarHBondContact O-N 2.79Å
324	P	91.1	Very high	92.5	Very high	101 Å²	101	81.7 Å²	81.7	66%	0.656	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.3	-26.7	-175.3	26.7	-35.8	0	0	0	113.4	S322 C326	S322-P324 VanDerWaalsContact C-CD 3.42Å; P324-C326 PolarHBondContact O-N 2.95Å
325	S	94	Very high	92.4	Very high	35 Å²	35	75.4 Å²	75.4	25%	0.245	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-75.2	-0.4	176.9	72	0	0	0	0	114.9	R43 Q313 F323	R43-S325 PolarHBondContact NH1-OG 2.86Å; R43-S325 PolarHBondContact NH2-O 3.31Å; R43-S325 PolarHBondContact NH2-OG 3.19Å; Q313-S325 PolarHBondContact NE2-O 2.78Å; Q313-S325 VanDerWaalsContact NE2-O 3.07Å; F323-S325 PolarHBondContact O-N 2.76Å; F323-S325 VanDerWaalsContact O-N 3.16Å
326	C	95.1	Very high	92.1	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-105.4	13.1	-176.1	-65.5	0	0	0	0	113.2	I38 W39 V106 L316 F323 P324	I38-C326 CarbonylContact C-O 3.52Å; I38-C326 WeakPolarHBondContact CA-O 3.39Å; W39-C326 PolarHBondContact N-O 3.29Å; W39-C326 WeakPolarHBondContact O-CA 3.36Å; V106-C326 HydrophobicContact CG1-CB 4.41Å; L316-C326 VanDerWaalsContact CD1-SG 3.54Å; F323-C326 HydrophobicContact CB-CB 4.14Å; F323-C326 WeakPolarHBondContact O-CB 3.42Å; F323-C326 PolarHBondContact O-N 2.79Å; P324-C326 PolarHBondContact O-N 2.95Å
327	H	93.5	Very high	91.8	Very high	35 Å²	35	76.1 Å²	76.1	16%	0.162	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-129.3	127.4	178.4	-71.8	-63	0	0	0	110.3	S35 S36 Y102	S35-H327 WeakPolarHBondContact O-CB 2.94Å; S35-H327 PolarHBondContact O-ND1 3.1Å; S36-H327 PolarHBondContact O-CE1 3.21Å; S36-H327 VanDerWaalsContact O-CE1 3.25Å; Y102-H327 AromaticContact CE2-NE2 3.76Å; Y102-H327 AromaticContact CZ-NE2 3.46Å; Y102-H327 PolarHBondContact OH-NE2 2.67Å
328	C	92.5	Very high	91.6	Very high	9 Å²	9	73.9 Å²	73.9	6%	0.061	39%	0.388	C	S	.	.			trans	-96	117.8	-178.8	-164.8	0	0	0	0	110.7	F34 S35 W39 M307 W330	F34-C328 VanDerWaalsContact CD1-O 3.29Å; F34-C328 WeakPolarHBondContact CD1-O 3.48Å; F34-C328 HydrophobicContact CE1-CB 3.82Å; F34-C328 VanDerWaalsContact CE1-O 3.27Å; F34-C328 WeakPolarHBondContact CE1-O 3.12Å; F34-C328 HydrophobicContact CZ-CB 4.34Å; S35-C328 PolarHBondContact OG-O 3.22Å; W39-C328 HydrophobicContact CB-CB 3.84Å; W39-C328 HydrophobicContact CD2-CB 3.66Å; W39-C328 HydrophobicContact CE3-CB 3.79Å; W39-C328 HydrophobicContact CG-CB 3.7Å; M307-C328 HydrophobicContact CE-CB 4.24Å; C328-W330 VanDerWaalsContact C-N 3.33Å
329	K	89.1	Confident	91.6	Very high	145 Å²	145	71.9 Å²	71.9	63%	0.63	38%	0.379	S	S	*	.	S	Bend	trans	-84.7	-4.8	175.7	-61.6	-173.6	179.2	-170.8	0	114	P331	K329-P331 WeakPolarHBondContact O-CD 3.19Å
330	W	90	Very high	91.7	Very high	205 Å²	205	65.1 Å²	65.1	78%	0.777	34%	0.343	S	S	*	.	S	Bend	trans	-127.6	82.9	-164.9	-51.2	119.3	0	0	0	111.4	C328 K332	C328-W330 VanDerWaalsContact C-N 3.33Å; W330-K332 PolarHBondContact O-N 2.82Å
331	P	90.7	Very high	91.8	Very high	42 Å²	42	63.4 Å²	63.4	27%	0.273	33%	0.329	S	S	.	.			trans	-62.8	125.3	-179.7	23.4	-32.5	0	0	0	112	F30 L31 F34 I305 K329	F30-P331 HydrophobicContact CE1-CB 4.16Å; F30-P331 HydrophobicContact CE1-CG 3.76Å; F30-P331 HydrophobicContact CZ-CB 3.71Å; F30-P331 HydrophobicContact CZ-CG 3.83Å; L31-P331 HydrophobicContact CD2-CG 3.98Å; F34-P331 HydrophobicContact CD1-CB 3.86Å; F34-P331 HydrophobicContact CD1-CG 4.23Å; F34-P331 HydrophobicContact CD2-CB 3.98Å; F34-P331 VanDerWaalsContact CE1-CA 3.48Å; F34-P331 HydrophobicContact CE1-CB 3.72Å; F34-P331 HydrophobicContact CE1-CG 4.38Å; F34-P331 HydrophobicContact CE2-CB 3.85Å; F34-P331 HydrophobicContact CG-CB 3.99Å; F34-P331 VanDerWaalsContact CZ-CA 3.44Å; F34-P331 HydrophobicContact CZ-CB 3.74Å; I305-P331 HydrophobicContact CG2-CB 4.26Å; K329-P331 WeakPolarHBondContact O-CD 3.19Å
332	K	93.3	Very high	92.1	Very high	111 Å²	111	61.3 Å²	61.3	48%	0.483	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	151.3	173.3	-64	-159.8	-174.5	-177	0	111	C306 D308 W330	C306-K332 HydrophobicContact CB-CB 4.21Å; C306-K332 PolarHBondContact N-O 3.33Å; C306-K332 PolarHBondContact O-N 3.16Å; D308-K332 HydrophobicContact CB-CD 3.81Å; D308-K332 WeakPolarHBondContact OD2-CD 3.4Å; D308-K332 WeakPolarHBondContact OD2-CE 3.35Å; D308-K332 IonicContact OD2-NZ 2.7Å; D308-K332 PolarHBondContact OD2-NZ 2.87Å; W330-K332 PolarHBondContact O-N 2.82Å
333	K	92.3	Very high	92.4	Very high	120 Å²	120	58 Å²	58	52%	0.522	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138	176.6	-72	-176.3	178.1	179	0	110.6	Y303 L304	Y303-K333 HydrophobicContact CD1-CB 3.82Å; Y303-K333 HydrophobicContact CG-CB 4.17Å; Y303-K333 HydrophobicContact CG-CD 4.3Å; L304-K333 WeakPolarHBondContact O-CA 3.39Å
334	L	92.7	Very high	92.6	Very high	35 Å²	35	57.6 Å²	57.6	18%	0.183	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.7	173.3	-179.8	74.1	0	0	0	109.1	M294 Y296 Y303 L304 F336 K338 M339	M294-L334 HydrophobicContact CE-CD1 4.44Å; M294-L334 HydrophobicContact CE-CD2 3.79Å; Y296-L334 HydrophobicContact CE1-CD2 3.76Å; Y296-L334 WeakPolarHBondContact OH-CD2 3.32Å; Y303-L334 CarbonylContact C-O 3.56Å; Y303-L334 VanDerWaalsContact CA-O 3.29Å; Y303-L334 WeakPolarHBondContact CA-O 3.44Å; L304-L334 HydrophobicContact CB-CB 4.43Å; L304-L334 HydrophobicContact CD1-CD2 4.33Å; L304-L334 PolarHBondContact N-O 2.96Å; L304-L334 PolarHBondContact O-N 3.02Å; L334-F336 PolarHBondContact O-N 2.86Å; L334-K338 HydrophobicContact CD1-CB 3.9Å; L334-K338 HydrophobicContact CG-CB 4.37Å; L334-M339 HydrophobicContact CD2-CB 4.49Å
335	L	93.7	Very high	92.9	Very high	72 Å²	72	52.8 Å²	52.8	38%	0.377	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134.9	172.3	-74.1	167.6	0	0	0	110.5	D302 Y303 G337 K338	D302-L335 HydrophobicContact CB-CD2 4.36Å; D302-L335 WeakPolarHBondContact O-CA 3.48Å; Y303-L335 HydrophobicContact CD1-CD2 3.89Å; Y303-L335 HydrophobicContact CD1-CG 4.04Å; Y303-L335 HydrophobicContact CD2-CD2 4.45Å; Y303-L335 HydrophobicContact CE1-CD2 3.44Å; Y303-L335 VanDerWaalsContact CE1-CD2 3.44Å; Y303-L335 HydrophobicContact CE1-CG 3.61Å; Y303-L335 HydrophobicContact CE2-CD2 4.03Å; Y303-L335 HydrophobicContact CG-CD2 4.38Å; Y303-L335 VanDerWaalsContact CZ-CD2 3.5Å; L335-G337 VanDerWaalsContact C-N 3.26Å; L335-G337 PolarHBondContact O-N 3.47Å; L335-K338 HydrophobicContact CB-CB 4.4Å; L335-K338 HydrophobicContact CB-CG 3.99Å; L335-K338 HydrophobicContact CD1-CG 4.5Å; L335-K338 WeakPolarHBondContact O-CA 3.44Å; L335-K338 WeakPolarHBondContact O-CB 3.26Å; L335-K338 PolarHBondContact O-N 2.82Å
336	F	91.7	Very high	93.1	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.013	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-51.8	-44.7	178.1	-82.1	-85	0	0	0	112.4	F265 I270 L273 K274 W299 D302 L304 L334 K338 M339	F265-F336 WeakPolarHBondContact CD1-O 3.42Å; F265-F336 HydrophobicContact CE1-CB 4.43Å; I270-F336 HydrophobicContact CD1-CB 4.1Å; I270-F336 HydrophobicContact CG1-CB 3.88Å; I270-F336 HydrophobicContact CG1-CG 4.35Å; I270-F336 HydrophobicContact CG2-CB 4.39Å; I270-F336 HydrophobicContact CG2-CD1 4.5Å; I270-F336 HydrophobicContact CG2-CD2 4.09Å; I270-F336 HydrophobicContact CG2-CG 4.11Å; L273-F336 HydrophobicContact CB-CD1 4.47Å; L273-F336 HydrophobicContact CB-CE1 3.88Å; L273-F336 HydrophobicContact CD1-CD1 4.35Å; L273-F336 HydrophobicContact CD1-CE1 4.4Å; K274-F336 HydrophobicContact CG-CE1 4.49Å; K274-F336 HydrophobicContact CG-CE2 3.94Å; K274-F336 HydrophobicContact CG-CZ 3.66Å; W299-F336 HydrophobicContact CB-CE2 4.11Å; W299-F336 HydrophobicContact CB-CZ 3.81Å; W299-F336 HydrophobicContact CG-CZ 4.44Å; D302-F336 WeakPolarHBondContact O-CD2 3.48Å; D302-F336 PolarHBondContact O-N 3.38Å; D302-F336 VanDerWaalsContact O-N 3.08Å; L304-F336 HydrophobicContact CD1-CD1 4.1Å; L304-F336 HydrophobicContact CD1-CE1 4.43Å; L304-F336 HydrophobicContact CD2-CD1 3.85Å; L304-F336 HydrophobicContact CD2-CE1 3.33Å; L304-F336 HydrophobicContact CD2-CZ 3.74Å; L304-F336 HydrophobicContact CG-CD1 3.78Å; L304-F336 HydrophobicContact CG-CE1 3.74Å; L304-F336 HydrophobicContact CG-CE2 4.47Å; L304-F336 HydrophobicContact CG-CG 4.19Å; L304-F336 HydrophobicContact CG-CZ 4.09Å; L334-F336 PolarHBondContact O-N 2.86Å; F336-K338 PolarHBondContact O-N 2.89Å; F336-M339 WeakPolarHBondContact O-CB 3.03Å; F336-M339 PolarHBondContact O-N 3.32Å
337	G	90.5	Very high	93.2	Very high	50 Å²	50	51.1 Å²	51.1	52%	0.515	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-65.3	1.6	176.1	0	0	0	0	0	116.1	L335	L335-G337 VanDerWaalsContact C-N 3.26Å; L335-G337 PolarHBondContact O-N 3.47Å
338	K	91.4	Very high	93.4	Very high	154 Å²	154	49.5 Å²	49.5	67%	0.67	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-113.6	-0.9	172.2	-58.9	-62.6	-175.7	-175.9	0	113	L334 L335 F336	L334-K338 HydrophobicContact CD1-CB 3.9Å; L334-K338 HydrophobicContact CG-CB 4.37Å; L335-K338 HydrophobicContact CB-CB 4.4Å; L335-K338 HydrophobicContact CB-CG 3.99Å; L335-K338 HydrophobicContact CD1-CG 4.5Å; L335-K338 WeakPolarHBondContact O-CA 3.44Å; L335-K338 WeakPolarHBondContact O-CB 3.26Å; L335-K338 PolarHBondContact O-N 2.82Å; F336-K338 PolarHBondContact O-N 2.89Å
339	M	92.1	Very high	93.6	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.03	24%	0.236	C	C	.	.	S	Bend	trans	-60.4	148.5	168.9	-171.7	174.6	163.2	0	0	109.8	F265 L273 I285 Y296 L304 L334 F336 C343	F265-M339 VanDerWaalsContact CB-O 3.29Å; F265-M339 WeakPolarHBondContact CB-O 3.22Å; F265-M339 HydrophobicContact CD2-CB 4.45Å; F265-M339 HydrophobicContact CE2-SD 4.43Å; F265-M339 HydrophobicContact CG-CB 4.38Å; L273-M339 HydrophobicContact CD1-CE 4.18Å; L273-M339 HydrophobicContact CD1-SD 3.77Å; I285-M339 HydrophobicContact CG2-CE 4.09Å; Y296-M339 HydrophobicContact CD2-CE 4.31Å; Y296-M339 HydrophobicContact CE2-CE 3.98Å; Y296-M339 HydrophobicContact CE2-CG 4.11Å; Y296-M339 HydrophobicContact CE2-SD 4.19Å; L304-M339 HydrophobicContact CD1-CB 3.99Å; L304-M339 HydrophobicContact CD1-CG 4.05Å; L304-M339 HydrophobicContact CD1-SD 3.63Å; L334-M339 HydrophobicContact CD2-CB 4.49Å; F336-M339 WeakPolarHBondContact O-CB 3.03Å; F336-M339 PolarHBondContact O-N 3.32Å; M339-C343 HydrophobicContact CE-CB 3.56Å
340	D	92.2	Very high	93.8	Very high	14 Å²	14	44.3 Å²	44.3	8%	0.075	21%	0.214	C	C	.	.			trans	-79.8	138.7	168.5	-166.5	-103.1	0	0	0	109.5	G288 R289 N342	G288-D340 VanDerWaalsContact CA-CB 3.5Å; R289-D340 WeakPolarHBondContact CD-OD2 3.43Å; R289-D340 HydrophobicContact CG-CB 4.13Å; R289-D340 VanDerWaalsContact CG-CG 3.47Å; R289-D340 WeakPolarHBondContact CG-OD2 3.49Å; R289-D340 IonicContact CZ-OD2 3.59Å; R289-D340 IonicContact NE-OD2 2.84Å; R289-D340 PolarHBondContact NE-OD2 3.28Å; R289-D340 IonicContact NH2-OD2 3.25Å; D340-N342 PolarHBondContact O-N 3.28Å; D340-N342 VanDerWaalsContact O-N 3.16Å; D340-N342 WeakPolarHBondContact OD1-CB 3.09Å; D340-N342 PolarHBondContact OD1-N 3.38Å; D340-N342 VanDerWaalsContact OD1-N 3.11Å; D340-N342 PolarHBondContact OD1-ND2 2.7Å
341	P	93.2	Very high	93.9	Very high	2 Å²	2	37 Å²	37	1%	0.013	19%	0.189	C	C	.	.	S	Bend	trans	-61.7	-22.5	-179.8	20.1	-29.7	0	0	0	113.5	H259 L260 G262 C343	H259-P341 CarbonylContact C-O 3.59Å; H259-P341 VanDerWaalsContact CA-O 3.31Å; H259-P341 WeakPolarHBondContact CA-O 3.41Å; L260-P341 PolarHBondContact N-O 3.4Å; G262-P341 WeakPolarHBondContact O-CG 3.49Å; P341-C343 PolarHBondContact O-N 3.36Å
342	N	93.2	Very high	94	Very high	69 Å²	69	38.7 Å²	38.7	37%	0.369	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.5	174.5	-56.8	-82.2	0	0	0	111	H259 G288 D340	H259-N342 PolarHBondContact CE1-OD1 2.83Å; H259-N342 PolarHBondContact ND1-OD1 3.23Å; G288-N342 PolarHBondContact N-O 3.45Å; D340-N342 PolarHBondContact O-N 3.28Å; D340-N342 VanDerWaalsContact O-N 3.16Å; D340-N342 WeakPolarHBondContact OD1-CB 3.09Å; D340-N342 PolarHBondContact OD1-N 3.38Å; D340-N342 VanDerWaalsContact OD1-N 3.11Å; D340-N342 PolarHBondContact OD1-ND2 2.7Å
343	C	95.4	Very high	94	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	165.8	175.2	64.4	0	0	0	0	113.2	S257 L258 I285 I286 M339 P341	S257-C343 CarbonylContact C-O 3.59Å; S257-C343 WeakPolarHBondContact CA-O 3.38Å; L258-C343 PolarHBondContact N-O 2.88Å; L258-C343 PolarHBondContact O-N 2.95Å; L258-C343 VanDerWaalsContact O-N 3.09Å; I285-C343 HydrophobicContact CG2-CB 3.73Å; I286-C343 CarbonylContact O-C 3.53Å; I286-C343 WeakPolarHBondContact O-CA 3.35Å; I286-C343 WeakPolarHBondContact O-CB 3.45Å; M339-C343 HydrophobicContact CE-CB 3.56Å; P341-C343 PolarHBondContact O-N 3.36Å
344	T	96.7	Very high	94.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.4	164	-60.3	0	0	0	0	108	P140 S144 L255 V256 S257 I285 I286	P140-T344 WeakPolarHBondContact CB-OG1 3.34Å; P140-T344 PolarHBondContact O-OG1 3.18Å; S144-T344 WeakPolarHBondContact OG-CG2 3.27Å; S144-T344 PolarHBondContact OG-OG1 2.98Å; L255-T344 HydrophobicContact CB-CG2 3.86Å; L255-T344 HydrophobicContact CD2-CG2 4.26Å; V256-T344 CarbonylContact O-C 3.5Å; V256-T344 VanDerWaalsContact O-CA 3.31Å; V256-T344 WeakPolarHBondContact O-CA 3.33Å; S257-T344 PolarHBondContact OG-OG1 3.45Å; I285-T344 CarbonylContact C-O 3.5Å; I285-T344 WeakPolarHBondContact CA-O 3.08Å; I285-T344 WeakPolarHBondContact CG2-O 3.25Å; I286-T344 PolarHBondContact N-O 3.32Å; I286-T344 PolarHBondContact O-N 3.23Å
345	I	96.9	Very high	94.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131	172.9	-52.5	-176	0	0	0	108	V256 L258 L273 V276 I285 F347 L377	V256-I345 PolarHBondContact N-O 3.11Å; V256-I345 PolarHBondContact O-N 2.9Å; L258-I345 HydrophobicContact CD1-CD1 3.66Å; L258-I345 HydrophobicContact CD1-CG1 4.25Å; L273-I345 HydrophobicContact CD2-CD1 3.89Å; V276-I345 HydrophobicContact CG1-CD1 4.2Å; V276-I345 HydrophobicContact CG1-CG2 3.5Å; I285-I345 HydrophobicContact CD1-CD1 4.35Å; I285-I345 HydrophobicContact CD1-CG1 4.06Å; I285-I345 HydrophobicContact CG1-CB 4.33Å; I285-I345 HydrophobicContact CG1-CG1 4.02Å; I285-I345 HydrophobicContact CG1-CG2 4.17Å; I285-I345 HydrophobicContact CG2-CG1 4.26Å; I345-F347 HydrophobicContact CB-CE2 4.3Å; I345-F347 HydrophobicContact CG2-CD2 4.32Å; I345-F347 HydrophobicContact CG2-CE1 4.06Å; I345-F347 HydrophobicContact CG2-CE2 3.6Å; I345-F347 HydrophobicContact CG2-CZ 3.46Å; I345-F347 VanDerWaalsContact CG2-CZ 3.46Å; I345-L377 HydrophobicContact CD1-CD1 4.43Å
346	G	98.2	Very high	94.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136	174.4	0	0	0	0	0	112.4	V254 C282 V283 G284	V254-G346 CarbonylContact O-C 3.55Å; V254-G346 WeakPolarHBondContact O-CA 3.32Å; C282-G346 WeakPolarHBondContact CA-O 3.41Å; V283-G346 VanDerWaalsContact CG2-C 3.43Å; V283-G346 WeakPolarHBondContact CG2-O 3.34Å; V283-G346 PolarHBondContact N-O 2.79Å; G284-G346 PolarHBondContact O-N 2.81Å
347	F	97.6	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.4	168.3	-53.6	-80.9	0	0	0	110.1	L253 V254 V256 V276 M279 F281 C282 I345 F358 F378	L253-F347 CarbonylContact C-O 3.58Å; L253-F347 WeakPolarHBondContact CA-O 3.49Å; V254-F347 HydrophobicContact CB-CB 4.29Å; V254-F347 PolarHBondContact N-O 2.68Å; V254-F347 PolarHBondContact O-N 3.28Å; V256-F347 HydrophobicContact CG2-CD2 4.09Å; V256-F347 HydrophobicContact CG2-CE2 3.89Å; V276-F347 HydrophobicContact CG1-CE1 3.91Å; V276-F347 HydrophobicContact CG1-CZ 3.89Å; V276-F347 HydrophobicContact CG2-CZ 4.46Å; M279-F347 HydrophobicContact CE-CD1 4.43Å; M279-F347 HydrophobicContact CE-CE1 4.07Å; M279-F347 HydrophobicContact SD-CD1 4.45Å; M279-F347 HydrophobicContact SD-CE1 3.63Å; M279-F347 HydrophobicContact SD-CZ 4.36Å; F281-F347 HydrophobicContact CB-CB 4.38Å; F281-F347 HydrophobicContact CB-CD1 4.38Å; F281-F347 CarbonylContact O-C 3.5Å; F281-F347 VanDerWaalsContact O-CA 3.31Å; F281-F347 WeakPolarHBondContact O-CA 3.22Å; C282-F347 HydrophobicContact CB-CD1 4.28Å; C282-F347 HydrophobicContact CB-CE1 4.35Å; I345-F347 HydrophobicContact CB-CE2 4.3Å; I345-F347 HydrophobicContact CG2-CD2 4.32Å; I345-F347 HydrophobicContact CG2-CE1 4.06Å; I345-F347 HydrophobicContact CG2-CE2 3.6Å; I345-F347 HydrophobicContact CG2-CZ 3.46Å; I345-F347 VanDerWaalsContact CG2-CZ 3.46Å; F347-F358 HydrophobicContact CB-CD2 4.42Å; F347-F358 HydrophobicContact CB-CE2 3.77Å; F347-F358 HydrophobicContact CB-CZ 4.15Å; F347-F358 HydrophobicContact CD1-CD2 4.39Å; F347-F358 AromaticContact CD1-CE2 3.64Å; F347-F358 HydrophobicContact CD1-CE2 3.64Å; F347-F358 AromaticContact CD2-CE2 3.94Å; F347-F358 HydrophobicContact CD2-CE2 3.94Å; F347-F358 HydrophobicContact CD2-CZ 4.01Å; F347-F358 HydrophobicContact CE1-CE2 4.14Å; F347-F358 HydrophobicContact CE2-CE2 4.41Å; F347-F358 HydrophobicContact CG-CD2 4.46Å; F347-F358 AromaticContact CG-CE2 3.52Å; F347-F358 HydrophobicContact CG-CE2 3.52Å; F347-F358 AromaticContact CG-CZ 3.99Å; F347-F358 HydrophobicContact CG-CZ 3.99Å; F347-F358 HydrophobicContact CZ-CE2 4.49Å; F347-F378 AromaticContact CE2-CE1 3.97Å; F347-F378 HydrophobicContact CE2-CE1 3.97Å; F347-F378 AromaticContact CE2-CZ 3.97Å; F347-F378 HydrophobicContact CE2-CZ 3.97Å; F347-F378 AromaticContact CZ-CE1 3.98Å; F347-F378 HydrophobicContact CZ-CE1 3.98Å; F347-F378 HydrophobicContact CZ-CZ 4.09Å
348	Y	97.5	Very high	94.6	Very high	1 Å²	1	34.7 Å²	34.7	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.2	176.1	174.9	-102.4	0	0	0	110	T74 R77 H78 L163 S251 F281 R350	T74-Y348 HydrophobicContact CG2-CD2 3.54Å; T74-Y348 HydrophobicContact CG2-CE2 4.11Å; T74-Y348 HydrophobicContact CG2-CG 4.27Å; R77-Y348 HydrophobicContact CB-CD1 4.1Å; R77-Y348 HydrophobicContact CB-CE1 4.15Å; H78-Y348 WeakPolarHBondContact CA-OH 3.39Å; H78-Y348 HydrophobicContact CB-CE2 4.21Å; H78-Y348 AromaticContact ND1-CZ 3.89Å; H78-Y348 PolarHBondContact ND1-OH 2.96Å; L163-Y348 HydrophobicContact CD1-CD2 4.39Å; L163-Y348 HydrophobicContact CD1-CE2 3.91Å; S251-Y348 VanDerWaalsContact CB-OH 3.25Å; S251-Y348 WeakPolarHBondContact CB-OH 3.47Å; S251-Y348 PolarHBondContact OG-OH 2.81Å; F281-Y348 WeakPolarHBondContact CD1-O 3.43Å; F281-Y348 PolarHBondContact O-N 3.05Å; Y348-R350 HydrophobicContact CE1-CB 4.09Å
349	V	96.3	Very high	94.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	116.7	179.7	177	0	0	0	0	108.3	W248 S251 V252 E354 L355 F358	W248-V349 HydrophobicContact CZ2-CG1 4.31Å; S251-V349 CarbonylContact C-O 3.57Å; S251-V349 WeakPolarHBondContact CA-O 3.4Å; V252-V349 PolarHBondContact N-O 3.33Å; V252-V349 PolarHBondContact O-N 2.75Å; V349-E354 HydrophobicContact CG1-CB 4.07Å; V349-L355 HydrophobicContact CG1-CB 3.95Å; V349-F358 HydrophobicContact CG2-CB 3.98Å; V349-F358 HydrophobicContact CG2-CD1 3.92Å; V349-F358 HydrophobicContact CG2-CG 3.86Å
350	R	94	Very high	94.7	Very high	45 Å²	45	31.3 Å²	31.3	17%	0.17	16%	0.157	C	C	.	.			trans	-80.1	-38.4	-174	-170.2	-177.3	-76.3	90.7	5.7	113.2	R77 E82 W248 S251 Y348 E354	R77-R350 PolarHBondContact O-NH2 2.95Å; E82-R350 IonicContact OE1-CZ 2.58Å; E82-R350 IonicContact OE1-NH1 3.79Å; E82-R350 PolarHBondContact OE1-NH1 3.2Å; E82-R350 IonicContact OE1-NH2 2.75Å; E82-R350 PolarHBondContact OE1-NH2 3.04Å; E82-R350 IonicContact OE2-NH1 2.75Å; W248-R350 PolarHBondContact NE1-O 3.03Å; W248-R350 VanDerWaalsContact NE1-O 3.14Å; S251-R350 PolarHBondContact OG-O 2.82Å; Y348-R350 HydrophobicContact CE1-CB 4.09Å; R350-E354 VanDerWaalsContact CB-CD 3.47Å; R350-E354 VanDerWaalsContact CB-OE1 3.32Å; R350-E354 WeakPolarHBondContact CB-OE1 3.1Å; R350-E354 WeakPolarHBondContact CB-OE2 3.33Å; R350-E354 IonicContact CZ-OE1 3.74Å; R350-E354 PolarHBondContact N-OE2 3.23Å; R350-E354 IonicContact NH1-OE1 3.65Å; R350-E354 PolarHBondContact NH1-OE1 3.47Å; R350-E354 IonicContact NH1-OE2 2.86Å; R350-E354 PolarHBondContact NH1-OE2 3.35Å
351	N	93	Very high	94.7	Very high	50 Å²	50	33.3 Å²	33.3	27%	0.267	17%	0.166	S	C	.	.	S	Bend	trans	-151	173.2	-167.7	62.7	62.7	0	0	0	113	H353 E354 L355	N351-H353 VanDerWaalsContact C-N 3.27Å; N351-H353 PolarHBondContact O-N 3.38Å; N351-H353 WeakPolarHBondContact OD1-CA 3.48Å; N351-H353 WeakPolarHBondContact OD1-CB 3.32Å; N351-H353 PolarHBondContact OD1-N 2.93Å; N351-E354 PolarHBondContact ND2-OE1 3.4Å; N351-E354 PolarHBondContact O-N 3.24Å; N351-E354 PolarHBondContact OD1-N 3.23Å; N351-L355 PolarHBondContact O-N 3.04Å
352	R	92.6	Very high	94.4	Very high	78 Å²	78	33.3 Å²	33.3	29%	0.294	17%	0.166	S	C	.	.	H	α-helix	trans	-62.7	-25.8	-177.5	-174.2	59.2	-175.4	91	-11.6	114.9	E179 Y183 W248 Q356	E179-R352 IonicContact OE1-CZ 3.67Å; E179-R352 IonicContact OE1-NE 2.67Å; E179-R352 PolarHBondContact OE1-NE 3.27Å; E179-R352 IonicContact OE1-NH1 2.76Å; E179-R352 IonicContact OE1-NH2 2.83Å; E179-R352 PolarHBondContact OE1-NH2 3.36Å; Y183-R352 WeakPolarHBondContact OH-CD 3.42Å; Y183-R352 PolarHBondContact OH-NE 3.16Å; W248-R352 HydrophobicContact CB-CB 4.23Å; W248-R352 HydrophobicContact CD2-CB 4.16Å; W248-R352 HydrophobicContact CE3-CB 3.7Å; W248-R352 HydrophobicContact CE3-CG 4.32Å; W248-R352 HydrophobicContact CG-CB 4.43Å; W248-R352 HydrophobicContact CZ3-CB 4.37Å; R352-Q356 VanDerWaalsContact NH1-CG 3.28Å
353	H	92.8	Very high	94	Very high	115 Å²	115	30.9 Å²	30.9	53%	0.532	16%	0.155	S	C	.	.	H	α-helix	trans	-78.6	-47	176.9	178.9	56.6	0	0	0	110.8	N351 L355 Q356 E357	N351-H353 VanDerWaalsContact C-N 3.27Å; N351-H353 PolarHBondContact O-N 3.38Å; N351-H353 WeakPolarHBondContact OD1-CA 3.48Å; N351-H353 WeakPolarHBondContact OD1-CB 3.32Å; N351-H353 PolarHBondContact OD1-N 2.93Å; H353-L355 PolarHBondContact O-N 2.87Å; H353-Q356 WeakPolarHBondContact O-CA 3.04Å; H353-Q356 WeakPolarHBondContact O-CB 3.17Å; H353-Q356 PolarHBondContact O-N 2.78Å; H353-E357 IonicContact NE2-OE1 3.87Å; H353-E357 PolarHBondContact O-N 2.85Å; H353-E357 VanDerWaalsContact O-N 3.14Å
354	E	94.4	Very high	93.4	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.065	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-28.3	170.5	-77	175.7	-142.5	0	0	112.6	F281 V349 R350 N351 Q356 E357 F358	F281-E354 HydrophobicContact CE1-CB 3.97Å; F281-E354 HydrophobicContact CE1-CG 4.17Å; V349-E354 HydrophobicContact CG1-CB 4.07Å; R350-E354 VanDerWaalsContact CB-CD 3.47Å; R350-E354 VanDerWaalsContact CB-OE1 3.32Å; R350-E354 WeakPolarHBondContact CB-OE1 3.1Å; R350-E354 WeakPolarHBondContact CB-OE2 3.33Å; R350-E354 IonicContact CZ-OE1 3.74Å; R350-E354 PolarHBondContact N-OE2 3.23Å; R350-E354 IonicContact NH1-OE1 3.65Å; R350-E354 PolarHBondContact NH1-OE1 3.47Å; R350-E354 IonicContact NH1-OE2 2.86Å; R350-E354 PolarHBondContact NH1-OE2 3.35Å; N351-E354 PolarHBondContact ND2-OE1 3.4Å; N351-E354 PolarHBondContact O-N 3.24Å; N351-E354 PolarHBondContact OD1-N 3.23Å; E354-Q356 VanDerWaalsContact C-N 3.33Å; E354-E357 PolarHBondContact O-N 2.96Å; E354-F358 WeakPolarHBondContact O-CB 3.44Å; E354-F358 PolarHBondContact O-N 3.26Å
355	L	95.1	Very high	92.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-40.3	170.5	178.9	60.4	0	0	0	111.7	L178 E179 W248 V349 N351 H353 F358 L359	L178-L355 HydrophobicContact CD1-CD1 3.79Å; L178-L355 HydrophobicContact CD2-CD1 3.69Å; L178-L355 HydrophobicContact CD2-CD2 4.26Å; L178-L355 HydrophobicContact CG-CD1 4.34Å; E179-L355 HydrophobicContact CG-CD2 3.55Å; W248-L355 HydrophobicContact CH2-CB 4.26Å; W248-L355 HydrophobicContact CH2-CD2 3.87Å; W248-L355 HydrophobicContact CZ3-CD2 3.78Å; V349-L355 HydrophobicContact CG1-CB 3.95Å; N351-L355 PolarHBondContact O-N 3.04Å; H353-L355 PolarHBondContact O-N 2.87Å; L355-F358 HydrophobicContact CD1-CD1 4.25Å; L355-F358 PolarHBondContact O-N 2.76Å; L355-L359 HydrophobicContact CD1-CD1 3.81Å; L355-L359 HydrophobicContact CD1-CD2 4.42Å; L355-L359 HydrophobicContact CD1-CG 3.89Å; L355-L359 HydrophobicContact CG-CD1 3.84Å; L355-L359 HydrophobicContact CG-CG 4.34Å; L355-L359 WeakPolarHBondContact O-CB 3.45Å; L355-L359 WeakPolarHBondContact O-CG 3.38Å; L355-L359 PolarHBondContact O-N 3.25Å
356	Q	94	Very high	91.6	Very high	109 Å²	109	37.7 Å²	37.7	51%	0.509	19%	0.189	S	C	.	.	H	α-helix	trans	-67.2	-45.7	177.7	-61.6	171.6	-30.4	0	0	110.8	R352 H353 E354 F358 L359 A360	R352-Q356 VanDerWaalsContact NH1-CG 3.28Å; H353-Q356 WeakPolarHBondContact O-CA 3.04Å; H353-Q356 WeakPolarHBondContact O-CB 3.17Å; H353-Q356 PolarHBondContact O-N 2.78Å; E354-Q356 VanDerWaalsContact C-N 3.33Å; Q356-F358 PolarHBondContact O-N 3.09Å; Q356-L359 PolarHBondContact O-N 3.05Å; Q356-A360 WeakPolarHBondContact O-CB 3.45Å; Q356-A360 PolarHBondContact O-N 2.9Å
357	E	95.1	Very high	90.2	Very high	69 Å²	69	40.2 Å²	40.2	32%	0.322	21%	0.21	S	C	.	.	H	α-helix	trans	-57.5	-48.1	174.1	-61.7	-175	147.8	0	0	111.4	K280 F281 H353 E354 A360 E361	K280-E357 IonicContact NZ-OE1 3.51Å; K280-E357 IonicContact NZ-OE2 2.72Å; K280-E357 PolarHBondContact NZ-OE2 3.07Å; F281-E357 HydrophobicContact CE1-CB 4.36Å; F281-E357 HydrophobicContact CE2-CB 4.04Å; F281-E357 HydrophobicContact CZ-CB 3.44Å; F281-E357 VanDerWaalsContact CZ-CB 3.44Å; F281-E357 HydrophobicContact CZ-CG 4.48Å; F281-E357 WeakPolarHBondContact CZ-OE2 3.14Å; H353-E357 IonicContact NE2-OE1 3.87Å; H353-E357 PolarHBondContact O-N 2.85Å; H353-E357 VanDerWaalsContact O-N 3.14Å; E354-E357 PolarHBondContact O-N 2.96Å; E357-A360 PolarHBondContact O-N 3.46Å; E357-E361 WeakPolarHBondContact O-CB 3.36Å; E357-E361 PolarHBondContact O-N 3.23Å
358	F	95.2	Very high	88.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-45.1	179.6	167.4	-111.3	0	0	0	112.4	L173 L178 M279 F281 F347 V349 E354 L355 Q356 A360 E361 A362	L173-F358 HydrophobicContact CD1-CE1 3.88Å; L173-F358 HydrophobicContact CD1-CZ 3.93Å; L178-F358 HydrophobicContact CD1-CE1 4.33Å; M279-F358 HydrophobicContact CE-CD2 3.95Å; M279-F358 HydrophobicContact CE-CE2 4.05Å; F281-F358 HydrophobicContact CB-CD2 3.85Å; F281-F358 HydrophobicContact CD1-CB 4.08Å; F281-F358 HydrophobicContact CD2-CB 3.79Å; F281-F358 AromaticContact CD2-CD2 3.88Å; F281-F358 HydrophobicContact CD2-CD2 3.88Å; F281-F358 HydrophobicContact CD2-CG 4.34Å; F281-F358 HydrophobicContact CE1-CB 4.27Å; F281-F358 HydrophobicContact CE2-CB 4Å; F281-F358 HydrophobicContact CG-CB 3.86Å; F281-F358 AromaticContact CG-CD2 3.87Å; F281-F358 HydrophobicContact CG-CD2 3.87Å; F281-F358 HydrophobicContact CG-CG 4.27Å; F281-F358 HydrophobicContact CZ-CB 4.26Å; F347-F358 HydrophobicContact CB-CD2 4.42Å; F347-F358 HydrophobicContact CB-CE2 3.77Å; F347-F358 HydrophobicContact CB-CZ 4.15Å; F347-F358 HydrophobicContact CD1-CD2 4.39Å; F347-F358 AromaticContact CD1-CE2 3.64Å; F347-F358 HydrophobicContact CD1-CE2 3.64Å; F347-F358 AromaticContact CD2-CE2 3.94Å; F347-F358 HydrophobicContact CD2-CE2 3.94Å; F347-F358 HydrophobicContact CD2-CZ 4.01Å; F347-F358 HydrophobicContact CE1-CE2 4.14Å; F347-F358 HydrophobicContact CE2-CE2 4.41Å; F347-F358 HydrophobicContact CG-CD2 4.46Å; F347-F358 AromaticContact CG-CE2 3.52Å; F347-F358 HydrophobicContact CG-CE2 3.52Å; F347-F358 AromaticContact CG-CZ 3.99Å; F347-F358 HydrophobicContact CG-CZ 3.99Å; F347-F358 HydrophobicContact CZ-CE2 4.49Å; V349-F358 HydrophobicContact CG2-CB 3.98Å; V349-F358 HydrophobicContact CG2-CD1 3.92Å; V349-F358 HydrophobicContact CG2-CG 3.86Å; E354-F358 WeakPolarHBondContact O-CB 3.44Å; E354-F358 PolarHBondContact O-N 3.26Å; L355-F358 HydrophobicContact CD1-CD1 4.25Å; L355-F358 PolarHBondContact O-N 2.76Å; Q356-F358 PolarHBondContact O-N 3.09Å; F358-A360 VanDerWaalsContact C-N 3.35Å; F358-E361 PolarHBondContact O-N 2.73Å; F358-A362 HydrophobicContact CD2-CB 4.42Å; F358-A362 HydrophobicContact CE2-CB 4.06Å; F358-A362 HydrophobicContact CZ-CB 4.28Å; F358-A362 WeakPolarHBondContact O-CB 3.27Å; F358-A362 PolarHBondContact O-N 3.47Å
359	L	93.7	Very high	86.8	Confident	26 Å²	26	46.1 Å²	46.1	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-66.9	-37.1	179.5	-69.3	170	0	0	0	111.6	I175 L355 Q356 S363 I380	I175-L359 HydrophobicContact CD1-CD1 3.92Å; I175-L359 HydrophobicContact CD1-CD2 4.11Å; I175-L359 HydrophobicContact CG1-CD1 4.07Å; I175-L359 HydrophobicContact CG1-CD2 3.89Å; I175-L359 HydrophobicContact CG2-CD1 4.18Å; L355-L359 HydrophobicContact CD1-CD1 3.81Å; L355-L359 HydrophobicContact CD1-CD2 4.42Å; L355-L359 HydrophobicContact CD1-CG 3.89Å; L355-L359 HydrophobicContact CG-CD1 3.84Å; L355-L359 HydrophobicContact CG-CG 4.34Å; L355-L359 WeakPolarHBondContact O-CB 3.45Å; L355-L359 WeakPolarHBondContact O-CG 3.38Å; L355-L359 PolarHBondContact O-N 3.25Å; Q356-L359 PolarHBondContact O-N 3.05Å; L359-S363 VanDerWaalsContact O-CB 3.25Å; L359-S363 WeakPolarHBondContact O-CB 3.49Å; L359-S363 PolarHBondContact O-N 3.4Å; L359-S363 PolarHBondContact O-OG 2.67Å; L359-I380 HydrophobicContact CD2-CD1 4.35Å; L359-I380 HydrophobicContact CD2-CG2 3.85Å
360	A	92.1	Very high	84.6	Confident	64 Å²	64	48 Å²	48	53%	0.529	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-52.7	174.2	0	0	0	0	0	111.4	Q356 E357 F358 S363 E364	Q356-A360 WeakPolarHBondContact O-CB 3.45Å; Q356-A360 PolarHBondContact O-N 2.9Å; E357-A360 PolarHBondContact O-N 3.46Å; F358-A360 VanDerWaalsContact C-N 3.35Å; A360-S363 PolarHBondContact O-N 2.92Å; A360-E364 PolarHBondContact O-N 2.99Å
361	E	90.8	Very high	82.6	Confident	56 Å²	56	53.2 Å²	53.2	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-62	-47	179.5	-167	-178.3	-155.6	0	0	110.9	M279 K280 F281 E357 F358 S363 E364 V365	M279-E361 VanDerWaalsContact CA-OE1 3.29Å; M279-E361 WeakPolarHBondContact CA-OE1 3.48Å; M279-E361 WeakPolarHBondContact CB-OE2 3.46Å; M279-E361 HydrophobicContact CE-CB 3.94Å; M279-E361 HydrophobicContact CE-CG 3.81Å; M279-E361 HydrophobicContact CG-CG 3.96Å; K280-E361 PolarHBondContact N-OE2 2.89Å; F281-E361 WeakPolarHBondContact CD2-OE2 3.46Å; F281-E361 VanDerWaalsContact CE2-OE2 3.27Å; F281-E361 WeakPolarHBondContact CE2-OE2 3.33Å; E357-E361 WeakPolarHBondContact O-CB 3.36Å; E357-E361 PolarHBondContact O-N 3.23Å; F358-E361 PolarHBondContact O-N 2.73Å; E361-S363 VanDerWaalsContact C-N 3.31Å; E361-S363 PolarHBondContact O-N 3.35Å; E361-E364 WeakPolarHBondContact O-CB 3.11Å; E361-E364 PolarHBondContact O-N 2.85Å; E361-E364 VanDerWaalsContact O-N 3.16Å; E361-V365 WeakPolarHBondContact O-CG2 3.32Å; E361-V365 PolarHBondContact O-N 2.8Å
362	A	88.2	Confident	80.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-33.4	179.2	0	0	0	0	0	113.4	M279 F358 S366 F378 I380	M279-A362 HydrophobicContact CE-CB 4Å; F358-A362 HydrophobicContact CD2-CB 4.42Å; F358-A362 HydrophobicContact CE2-CB 4.06Å; F358-A362 HydrophobicContact CZ-CB 4.28Å; F358-A362 WeakPolarHBondContact O-CB 3.27Å; F358-A362 PolarHBondContact O-N 3.47Å; A362-S366 WeakPolarHBondContact O-CB 3.29Å; A362-S366 PolarHBondContact O-N 3.03Å; A362-S366 PolarHBondContact O-OG 3.13Å; A362-F378 HydrophobicContact CB-CE2 4.49Å; A362-F378 HydrophobicContact CB-CZ 4.17Å; A362-I380 HydrophobicContact CB-CD1 3.72Å
363	S	84.1	Confident	78.7	Confident	19 Å²	19	56.2 Å²	56.2	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-68.6	-41.9	173.5	-59.4	0	0	0	0	111.2	L359 A360 E361 S366 A367	L359-S363 VanDerWaalsContact O-CB 3.25Å; L359-S363 WeakPolarHBondContact O-CB 3.49Å; L359-S363 PolarHBondContact O-N 3.4Å; L359-S363 PolarHBondContact O-OG 2.67Å; A360-S363 PolarHBondContact O-N 2.92Å; E361-S363 VanDerWaalsContact C-N 3.31Å; E361-S363 PolarHBondContact O-N 3.35Å; S363-S366 PolarHBondContact O-N 2.99Å; S363-A367 WeakPolarHBondContact O-CB 3.4Å; S363-A367 PolarHBondContact O-N 3.06Å
364	E	84.1	Confident	77.3	Confident	115 Å²	115	54.2 Å²	54.2	54%	0.537	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-41.3	175.1	-163.4	-138.7	117.7	0	0	112.1	K275 A360 E361 S366 A367 Y368	K275-E364 IonicContact NZ-OE1 3.56Å; K275-E364 PolarHBondContact NZ-OE1 3.1Å; A360-E364 PolarHBondContact O-N 2.99Å; E361-E364 WeakPolarHBondContact O-CB 3.11Å; E361-E364 PolarHBondContact O-N 2.85Å; E361-E364 VanDerWaalsContact O-N 3.16Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 2.93Å; E364-A367 PolarHBondContact O-N 3.14Å; E364-Y368 WeakPolarHBondContact O-CB 3.33Å; E364-Y368 PolarHBondContact O-N 3.03Å
365	V	82	Confident	76.1	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-64	-36.4	174.1	178.8	0	0	0	0	111.8	H272 K275 V276 M279 E361 Y368	H272-V365 PolarHBondContact CD2-O 3.1Å; K275-V365 HydrophobicContact CB-CB 4.37Å; K275-V365 HydrophobicContact CB-CG1 3.74Å; K275-V365 HydrophobicContact CB-CG2 3.82Å; K275-V365 HydrophobicContact CD-CG2 4.1Å; V276-V365 HydrophobicContact CG2-CG1 3.76Å; M279-V365 HydrophobicContact CG-CG2 4.22Å; M279-V365 HydrophobicContact SD-CG2 3.98Å; E361-V365 WeakPolarHBondContact O-CG2 3.32Å; E361-V365 PolarHBondContact O-N 2.8Å; V365-Y368 PolarHBondContact O-N 3.32Å
366	S	72.7	Confident	75.3	Confident	22 Å²	22	60 Å²	60	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-73.9	-28.5	178.3	-57.6	0	0	0	0	113	A362 S363 E364	A362-S366 WeakPolarHBondContact O-CB 3.29Å; A362-S366 PolarHBondContact O-N 3.03Å; A362-S366 PolarHBondContact O-OG 3.13Å; S363-S366 PolarHBondContact O-N 2.99Å; E364-S366 VanDerWaalsContact C-N 3.31Å; E364-S366 PolarHBondContact O-N 2.93Å
367	A	69.7	Low	74.9	Confident	53 Å²	53	55.2 Å²	55.2	44%	0.438	32%	0.323	S	S	.	.	H	α-helix	trans	-85.9	-11.5	173.5	0	0	0	0	0	113.6	S363 E364 C370	S363-A367 WeakPolarHBondContact O-CB 3.4Å; S363-A367 PolarHBondContact O-N 3.06Å; E364-A367 PolarHBondContact O-N 3.14Å; A367-C370 VanDerWaalsContact C-SG 3.54Å; A367-C370 VanDerWaalsContact O-CB 3.24Å; A367-C370 WeakPolarHBondContact O-CB 3.41Å; A367-C370 PolarHBondContact O-SG 3.49Å
368	Y	66.8	Low	74.5	Confident	71 Å²	71	52.3 Å²	52.3	28%	0.278	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	148.7	-178.3	-170.9	-113.8	0	0	0	112.3	Y18 D271 H272 K275 E364 V365 C370	Y18-Y368 PolarHBondContact OH-OH 3.03Å; D271-Y368 HydrophobicContact CB-CE1 4.16Å; H272-Y368 PolarHBondContact NE2-O 3.48Å; H272-Y368 VanDerWaalsContact NE2-O 3.14Å; K275-Y368 HydrophobicContact CD-CD1 3.65Å; K275-Y368 HydrophobicContact CD-CD2 4.23Å; K275-Y368 HydrophobicContact CD-CE1 4.18Å; K275-Y368 HydrophobicContact CD-CG 3.65Å; K275-Y368 HydrophobicContact CG-CD1 4.17Å; K275-Y368 HydrophobicContact CG-CE1 4.41Å; K275-Y368 VanDerWaalsContact NZ-CG 3.33Å; E364-Y368 WeakPolarHBondContact O-CB 3.33Å; E364-Y368 PolarHBondContact O-N 3.03Å; V365-Y368 PolarHBondContact O-N 3.32Å; Y368-C370 PolarHBondContact O-N 3.2Å
369	G	56.3	Low	74.1	Confident	54 Å²	54	54.8 Å²	54.8	56%	0.557	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	12.7	179	0	0	0	0	0	114.7	L371	G369-L371 PolarHBondContact O-N 2.98Å
370	C	50.3	Low	73.9	Confident	40 Å²	40	55 Å²	55	27%	0.27	33%	0.326	S	S	.	.			trans	-71.6	59.1	-178.5	-80.6	0	0	0	0	114.2	A367 Y368 K374	A367-C370 VanDerWaalsContact C-SG 3.54Å; A367-C370 VanDerWaalsContact O-CB 3.24Å; A367-C370 WeakPolarHBondContact O-CB 3.41Å; A367-C370 PolarHBondContact O-SG 3.49Å; Y368-C370 PolarHBondContact O-N 3.2Å; C370-K374 HydrophobicContact CB-CD 4.02Å; C370-K374 HydrophobicContact CB-CG 3.8Å; C370-K374 VanDerWaalsContact SG-CG 3.53Å
371	L	50.7	Low	73.8	Confident	154 Å²	154	53.4 Å²	53.4	81%	0.806	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-69.2	125.3	150.1	-68.4	172.1	0	0	0	107.3	G369 P373	G369-L371 PolarHBondContact O-N 2.98Å; L371-P373 CarbonylContact O-C 3.55Å
372	S	53	Low	73.7	Confident	114 Å²	114	52.6 Å²	52.6	80%	0.797	31%	0.309	S	S	*	.	S	Bend	trans	-56.3	134.8	-179.9	179.8	0	0	0	0	111.5
373	P	51.5	Low	73.5	Confident	78 Å²	78	53.5 Å²	53.5	51%	0.506	32%	0.315	S	S	.	.	S	Bend	cis	-83.8	145.5	2	32	-33.5	0	0	0	113.8	L371 Y375	L371-P373 CarbonylContact O-C 3.55Å; P373-Y375 HydrophobicContact CB-CE2 4.39Å; P373-Y375 HydrophobicContact CG-CE2 3.69Å; P373-Y375 WeakPolarHBondContact CG-OH 3.4Å; P373-Y375 WeakPolarHBondContact O-CD2 3.47Å
374	K	62.8	Low	73.3	Confident	72 Å²	72	54.7 Å²	54.7	31%	0.313	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-78.7	130.4	-177.8	-58.8	-179.8	171.9	179.4	0	111.2	C370 V422	C370-K374 HydrophobicContact CB-CD 4.02Å; C370-K374 HydrophobicContact CB-CG 3.8Å; C370-K374 VanDerWaalsContact SG-CG 3.53Å; K374-V422 WeakPolarHBondContact CD-OXT 3.5Å; K374-V422 WeakPolarHBondContact CE-OXT 3.35Å; K374-V422 PolarHBondContact NZ-O 2.7Å; K374-V422 PolarHBondContact NZ-OXT 2.66Å
375	Y	69.9	Low	73.1	Confident	90 Å²	90	54.7 Å²	54.7	35%	0.353	33%	0.326	S	S	.	.			trans	-124.9	75.3	177	-63.4	-67.9	0	0	0	110.1	V268 Y269 P373	V268-Y375 HydrophobicContact CG2-CD2 4.23Å; Y269-Y375 WeakPolarHBondContact CE1-O 3.27Å; P373-Y375 HydrophobicContact CB-CE2 4.39Å; P373-Y375 HydrophobicContact CG-CE2 3.69Å; P373-Y375 WeakPolarHBondContact CG-OH 3.4Å; P373-Y375 WeakPolarHBondContact O-CD2 3.47Å
376	P	78.6	Confident	73	Confident	45 Å²	45	55.8 Å²	55.8	29%	0.292	33%	0.331	S	S	.	.			trans	-60.1	148.2	177.1	27.6	-35.5	0	0	0	110.7	F378	P376-F378 VanDerWaalsContact C-N 3.31Å; P376-F378 PolarHBondContact O-N 3.18Å
377	L	84.9	Confident	73.3	Confident	10 Å²	10	56 Å²	56	5%	0.052	33%	0.329	C	S	.	.	S	Bend	trans	-63.9	-39.1	176.3	-74.8	174.9	0	0	0	111.8	L258 L260 Y269 H272 L273 V276 I345	L258-L377 HydrophobicContact CD1-CB 4.2Å; L258-L377 WeakPolarHBondContact CD1-O 3.44Å; L258-L377 WeakPolarHBondContact CD2-O 3.36Å; L260-L377 HydrophobicContact CD1-CD2 3.98Å; L260-L377 HydrophobicContact CD2-CD2 3.54Å; L260-L377 HydrophobicContact CG-CD2 4.43Å; Y269-L377 HydrophobicContact CD1-CD2 3.57Å; Y269-L377 HydrophobicContact CD1-CG 4.47Å; Y269-L377 HydrophobicContact CE1-CD2 4.33Å; Y269-L377 HydrophobicContact CG-CD2 4.03Å; H272-L377 HydrophobicContact CB-CD1 3.66Å; H272-L377 HydrophobicContact CB-CD2 4.18Å; H272-L377 HydrophobicContact CB-CG 3.75Å; L273-L377 HydrophobicContact CD2-CD1 4.15Å; L273-L377 HydrophobicContact CD2-CD2 4.29Å; V276-L377 HydrophobicContact CG2-CD1 3.5Å; V276-L377 VanDerWaalsContact CG2-CD1 3.5Å; I345-L377 HydrophobicContact CD1-CD1 4.43Å
378	F	87.1	Confident	73.8	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.035	33%	0.327	C	S	.	.	S	Bend	trans	-152.8	158.8	175.2	57	-86.6	0	0	0	108.8	G171 L173 V256 L258 F347 A362 P376 I380	G171-F378 CarbonylContact O-C 3.57Å; G171-F378 WeakPolarHBondContact O-CA 3.29Å; G171-F378 VanDerWaalsContact O-CB 3.28Å; G171-F378 WeakPolarHBondContact O-CB 3.5Å; L173-F378 HydrophobicContact CB-CD2 4.31Å; L173-F378 HydrophobicContact CD1-CE2 4.08Å; V256-F378 HydrophobicContact CG1-CB 3.83Å; V256-F378 HydrophobicContact CG1-CD1 4.1Å; V256-F378 HydrophobicContact CG1-CG 3.98Å; L258-F378 HydrophobicContact CD2-CB 4.32Å; F347-F378 AromaticContact CE2-CE1 3.97Å; F347-F378 HydrophobicContact CE2-CE1 3.97Å; F347-F378 AromaticContact CE2-CZ 3.97Å; F347-F378 HydrophobicContact CE2-CZ 3.97Å; F347-F378 AromaticContact CZ-CE1 3.98Å; F347-F378 HydrophobicContact CZ-CE1 3.98Å; F347-F378 HydrophobicContact CZ-CZ 4.09Å; A362-F378 HydrophobicContact CB-CE2 4.49Å; A362-F378 HydrophobicContact CB-CZ 4.17Å; P376-F378 VanDerWaalsContact C-N 3.31Å; P376-F378 PolarHBondContact O-N 3.18Å; F378-I380 HydrophobicContact CD2-CG1 4.06Å; F378-I380 HydrophobicContact CE2-CD1 4.01Å; F378-I380 HydrophobicContact CE2-CG1 3.78Å
379	T	87.3	Confident	74.3	Confident	52 Å²	52	59.4 Å²	59.4	32%	0.319	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.7	175.5	-50.5	0	0	0	0	109.4	G171 V172 L173 L381	G171-T379 PolarHBondContact O-N 2.88Å; V172-T379 CarbonylContact C-O 3.49Å; V172-T379 WeakPolarHBondContact CA-O 3.44Å; L173-T379 PolarHBondContact N-O 2.86Å; T379-L381 HydrophobicContact CG2-CD2 3.96Å; T379-L381 HydrophobicContact CG2-CG 4.05Å
380	I	89.5	Confident	75.2	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.3	169.9	-60.2	171.5	0	0	0	107	L173 I175 L359 A362 F378	L173-I380 HydrophobicContact CB-CG1 4.46Å; L173-I380 HydrophobicContact CD2-CG2 4.49Å; L173-I380 WeakPolarHBondContact O-CA 3.48Å; I175-I380 HydrophobicContact CD1-CG2 3.94Å; I175-I380 HydrophobicContact CG1-CG2 3.95Å; L359-I380 HydrophobicContact CD2-CD1 4.35Å; L359-I380 HydrophobicContact CD2-CG2 3.85Å; A362-I380 HydrophobicContact CB-CD1 3.72Å; F378-I380 HydrophobicContact CD2-CG1 4.06Å; F378-I380 HydrophobicContact CE2-CD1 4.01Å; F378-I380 HydrophobicContact CE2-CG1 3.78Å
381	L	89.2	Confident	76.2	Confident	30 Å²	30	63 Å²	63	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	152.2	173.4	-59.8	176.4	0	0	0	109	V172 L173 L174 I175 T379 D386 K387 L390	V172-L381 HydrophobicContact CG1-CD1 3.63Å; V172-L381 HydrophobicContact CG1-CG 4.01Å; L173-L381 PolarHBondContact O-N 3.4Å; L174-L381 WeakPolarHBondContact CA-O 3.42Å; L174-L381 HydrophobicContact CD2-CB 3.95Å; I175-L381 PolarHBondContact N-O 3.41Å; T379-L381 HydrophobicContact CG2-CD2 3.96Å; T379-L381 HydrophobicContact CG2-CG 4.05Å; L381-D386 HydrophobicContact CB-CB 4.44Å; L381-K387 HydrophobicContact CD1-CB 3.86Å; L381-K387 HydrophobicContact CD1-CG 4.41Å; L381-L390 HydrophobicContact CD1-CD2 4.17Å
382	S	88.6	Confident	77.1	Confident	39 Å²	39	65.7 Å²	65.7	27%	0.273	33%	0.333	S	S	.	.	S	Bend	trans	-62	-62.1	175.2	-43.6	0	0	0	0	110.1	I175 D176	I175-S382 PolarHBondContact N-O 3.12Å; I175-S382 VanDerWaalsContact N-O 3.14Å; D176-S382 PolarHBondContact N-O 2.91Å
383	S	85.2	Confident	77.2	Confident	20 Å²	20	62.5 Å²	62.5	14%	0.14	31%	0.311	C	S	.	.			trans	-123.3	165	-168.7	76.4	0	0	0	0	115.1	D176 E385 D386 K387	D176-S383 WeakPolarHBondContact OD2-CA 3.2Å; D176-S383 WeakPolarHBondContact OD2-CB 3.4Å; S383-E385 PolarHBondContact O-N 3.41Å; S383-E385 WeakPolarHBondContact OG-CB 3.5Å; S383-E385 PolarHBondContact OG-N 2.83Å; S383-E385 VanDerWaalsContact OG-N 3.15Å; S383-D386 WeakPolarHBondContact CB-OD2 3.25Å; S383-D386 PolarHBondContact N-OD2 3.25Å; S383-D386 PolarHBondContact O-N 2.93Å; S383-D386 PolarHBondContact OG-N 3.49Å; S383-D386 PolarHBondContact OG-OD2 2.94Å; S383-K387 PolarHBondContact O-N 3.31Å
384	A	79.8	Confident	76.9	Confident	43 Å²	43	65 Å²	65	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-67	-17.3	167.3	0	0	0	0	0	113.1	L174 R388	L174-A384 HydrophobicContact CD1-CB 3.9Å; A384-R388 WeakPolarHBondContact O-CG 3.2Å; A384-R388 PolarHBondContact O-N 3.41Å; A384-R388 PolarHBondContact O-NE 2.91Å
385	E	79.8	Confident	75.8	Confident	116 Å²	116	70.6 Å²	70.6	54%	0.542	35%	0.352	S	S	.	.	H	α-helix	trans	-72.3	-43.7	170.8	-165.7	-178	136.2	0	0	110.5	S383 K387 R388 K389	S383-E385 PolarHBondContact O-N 3.41Å; S383-E385 WeakPolarHBondContact OG-CB 3.5Å; S383-E385 PolarHBondContact OG-N 2.83Å; S383-E385 VanDerWaalsContact OG-N 3.15Å; E385-K387 VanDerWaalsContact C-N 3.29Å; E385-K387 PolarHBondContact O-N 2.83Å; E385-R388 CarbonylContact O-C 3.54Å; E385-R388 WeakPolarHBondContact O-CA 3.42Å; E385-R388 WeakPolarHBondContact O-CB 3.5Å; E385-R388 PolarHBondContact O-N 3.41Å; E385-K389 WeakPolarHBondContact O-CG 3.44Å; E385-K389 PolarHBondContact O-N 3.32Å
386	D	78.8	Confident	74.2	Confident	29 Å²	29	75.7 Å²	75.7	16%	0.155	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-36.9	177.8	-52.4	-47.3	0	0	0	111.3	L381 S383 R388 K389 L390	L381-D386 HydrophobicContact CB-CB 4.44Å; S383-D386 WeakPolarHBondContact CB-OD2 3.25Å; S383-D386 PolarHBondContact N-OD2 3.25Å; S383-D386 PolarHBondContact O-N 2.93Å; S383-D386 PolarHBondContact OG-N 3.49Å; S383-D386 PolarHBondContact OG-OD2 2.94Å; D386-R388 VanDerWaalsContact C-N 3.29Å; D386-R388 PolarHBondContact O-N 3.48Å; D386-K389 PolarHBondContact O-N 2.84Å; D386-K389 IonicContact OD1-NZ 2.8Å; D386-K389 PolarHBondContact OD1-NZ 2.88Å; D386-L390 WeakPolarHBondContact O-CB 3.37Å; D386-L390 PolarHBondContact O-N 3.27Å
387	K	80.2	Confident	71.8	Confident	27 Å²	27	79.2 Å²	79.2	12%	0.117	40%	0.396	C	S	.	.	H	α-helix	trans	-58.4	-40.1	169.3	-171.2	174	178.6	175.3	0	111.8	D170 V172 L174 L381 S383 E385 Q391	D170-K387 IonicContact OD2-NZ 2.68Å; D170-K387 PolarHBondContact OD2-NZ 3.06Å; V172-K387 HydrophobicContact CB-CD 4.28Å; V172-K387 HydrophobicContact CG1-CD 4Å; V172-K387 HydrophobicContact CG1-CG 4.3Å; L174-K387 HydrophobicContact CD2-CB 4.31Å; L174-K387 HydrophobicContact CD2-CD 4.49Å; L381-K387 HydrophobicContact CD1-CB 3.86Å; L381-K387 HydrophobicContact CD1-CG 4.41Å; S383-K387 PolarHBondContact O-N 3.31Å; E385-K387 VanDerWaalsContact C-N 3.29Å; E385-K387 PolarHBondContact O-N 2.83Å; K387-Q391 WeakPolarHBondContact O-CB 3.36Å; K387-Q391 VanDerWaalsContact O-CG 3.25Å; K387-Q391 WeakPolarHBondContact O-CG 3.28Å; K387-Q391 PolarHBondContact O-N 3.16Å
388	R	79.5	Confident	69.2	Low	104 Å²	104	81.3 Å²	81.3	39%	0.392	42%	0.415	S	S	.	.	H	α-helix	trans	-73	-37.8	176.8	-75.8	-174.6	-81.4	-160.1	-1.3	112.8	A384 E385 D386 Q391 R392	A384-R388 WeakPolarHBondContact O-CG 3.2Å; A384-R388 PolarHBondContact O-N 3.41Å; A384-R388 PolarHBondContact O-NE 2.91Å; E385-R388 CarbonylContact O-C 3.54Å; E385-R388 WeakPolarHBondContact O-CA 3.42Å; E385-R388 WeakPolarHBondContact O-CB 3.5Å; E385-R388 PolarHBondContact O-N 3.41Å; D386-R388 VanDerWaalsContact C-N 3.29Å; D386-R388 PolarHBondContact O-N 3.48Å; R388-Q391 PolarHBondContact O-N 2.83Å; R388-R392 WeakPolarHBondContact O-CB 3.35Å; R388-R392 VanDerWaalsContact O-CG 3.3Å; R388-R392 WeakPolarHBondContact O-CG 3.25Å; R388-R392 PolarHBondContact O-N 3.04Å; R388-R392 VanDerWaalsContact O-N 3.07Å
389	K	78.2	Confident	66.7	Low	91 Å²	91	88 Å²	88	40%	0.396	46%	0.457	S	S	.	.	H	α-helix	trans	-58.9	-50	170.9	-65.6	174.7	-170.3	159.6	0	110.3	E385 D386 Q391 R392 S393 E418	E385-K389 WeakPolarHBondContact O-CG 3.44Å; E385-K389 PolarHBondContact O-N 3.32Å; D386-K389 PolarHBondContact O-N 2.84Å; D386-K389 IonicContact OD1-NZ 2.8Å; D386-K389 PolarHBondContact OD1-NZ 2.88Å; K389-Q391 VanDerWaalsContact C-N 3.34Å; K389-Q391 PolarHBondContact O-N 2.87Å; K389-R392 PolarHBondContact O-N 3.1Å; K389-R392 VanDerWaalsContact O-N 3.11Å; K389-S393 PolarHBondContact O-N 3.18Å; K389-S393 VanDerWaalsContact O-N 3.1Å; K389-E418 IonicContact NZ-OE1 2.91Å; K389-E418 PolarHBondContact NZ-OE1 3.04Å
390	L	73.4	Confident	64	Low	96 Å²	96	89.4 Å²	89.4	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-38.7	179.3	-170.9	68.1	0	0	0	112.4	L381 D386 R392 S393	L381-L390 HydrophobicContact CD1-CD2 4.17Å; D386-L390 WeakPolarHBondContact O-CB 3.37Å; D386-L390 PolarHBondContact O-N 3.27Å; L390-R392 VanDerWaalsContact C-N 3.34Å; L390-S393 WeakPolarHBondContact O-CB 3.2Å; L390-S393 PolarHBondContact O-N 3.1Å
391	Q	73.3	Confident	61.1	Low	75 Å²	75	95 Å²	95	35%	0.35	50%	0.503	S	S	.	.	H	α-helix	trans	-71.7	-24.3	175.8	-75.4	177.5	-10.5	0	0	114.2	K387 R388 K389	K387-Q391 WeakPolarHBondContact O-CB 3.36Å; K387-Q391 VanDerWaalsContact O-CG 3.25Å; K387-Q391 WeakPolarHBondContact O-CG 3.28Å; K387-Q391 PolarHBondContact O-N 3.16Å; R388-Q391 PolarHBondContact O-N 2.83Å; K389-Q391 VanDerWaalsContact C-N 3.34Å; K389-Q391 PolarHBondContact O-N 2.87Å
392	R	68.4	Low	58.1	Low	209 Å²	209	98.7 Å²	98.7	79%	0.789	54%	0.538	S	S	*	.	H	α-helix	trans	-86.8	-12.7	175.3	-72.6	172.7	176.3	175.1	-1.6	113.4	R388 K389 L390	R388-R392 WeakPolarHBondContact O-CB 3.35Å; R388-R392 VanDerWaalsContact O-CG 3.3Å; R388-R392 WeakPolarHBondContact O-CG 3.25Å; R388-R392 PolarHBondContact O-N 3.04Å; R388-R392 VanDerWaalsContact O-N 3.07Å; K389-R392 PolarHBondContact O-N 3.1Å; K389-R392 VanDerWaalsContact O-N 3.11Å; L390-R392 VanDerWaalsContact C-N 3.34Å
393	S	55.2	Low	55.3	Low	47 Å²	47	104.9 Å²	104.9	33%	0.329	56%	0.56	S	S	.	*	S	Bend	trans	-61.5	132.5	172.5	178.8	0	0	0	0	111.1	K389 L390 F395	K389-S393 PolarHBondContact O-N 3.18Å; K389-S393 VanDerWaalsContact O-N 3.1Å; L390-S393 WeakPolarHBondContact O-CB 3.2Å; L390-S393 PolarHBondContact O-N 3.1Å; S393-F395 PolarHBondContact O-N 3.43Å; S393-F395 PolarHBondContact OG-N 3.46Å
394	P	44.7	Very low	52.8	Low	131 Å²	131	109.9 Å²	109.9	85%	0.851	60%	0.595	S	S	*	*	S	Bend	trans	-62.5	-18.9	172.7	-22.5	33.7	0	0	0	113.9	R396	P394-R396 PolarHBondContact O-N 3.16Å; P394-R396 VanDerWaalsContact O-N 3.1Å
395	F	41.3	Very low	50.3	Low	189 Å²	189	111.6 Å²	111.6	83%	0.829	62%	0.617	S	S	*	*			trans	-84.8	75.9	-178.7	-95.1	-94.3	0	0	0	112.3	S393	S393-F395 PolarHBondContact O-N 3.43Å; S393-F395 PolarHBondContact OG-N 3.46Å
396	R	35.1	Very low	47.9	Very low	197 Å²	197	112 Å²	112	74%	0.743	63%	0.632	S	S	*	*			trans	-92.7	109.3	165	-96.3	-170.7	169	-153.2	-1.3	111.4	P394	P394-R396 PolarHBondContact O-N 3.16Å; P394-R396 VanDerWaalsContact O-N 3.1Å
397	S	28.9	Very low	45.4	Very low	120 Å²	120	116 Å²	116	84%	0.839	66%	0.663	S	S	*	*			trans	-165.3	91.1	159.9	-84.8	0	0	0	0	111.3
398	A	30.4	Very low	43	Very low	54 Å²	54	123 Å²	123	45%	0.446	70%	0.7	S	S	.	*	S	Bend	trans	-178.6	29.9	157.7	0	0	0	0	0	115.7
399	T	34.8	Very low	40.4	Very low	148 Å²	148	123 Å²	123	91%	0.908	72%	0.716	S	S	*	*	S	Bend	trans	-154	3.3	165.9	-12.7	0	0	0	0	115.4
400	A	29.1	Very low	38.1	Very low	81 Å²	81	125.9 Å²	125.9	67%	0.669	73%	0.734	S	S	*	*	S	Bend	trans	-139	144.9	171.6	0	0	0	0	0	109.1
401	L	29.7	Very low	36	Very low	149 Å²	149	126.5 Å²	126.5	78%	0.78	75%	0.747	S	S	*	*			trans	63.8	84.9	-176.4	-67.7	88.6	0	0	0	116.3	K403	L401-K403 PolarHBondContact O-N 2.93Å
402	A	26.6	Very low	33.8	Very low	107 Å²	107	130.6 Å²	130.6	88%	0.884	77%	0.766	S	S	*	*			trans	-71.6	74.2	143.8	0	0	0	0	0	109.9
403	K	28.5	Very low	31.9	Very low	169 Å²	169	129.5 Å²	129.5	74%	0.735	77%	0.772	S	S	*	*			trans	-145.6	121.6	168.5	-77.6	-165.4	176.1	-176.8	0	110.6	L401	L401-K403 PolarHBondContact O-N 2.93Å
404	S	32.5	Very low	30.5	Very low	125 Å²	125	135.8 Å²	135.8	87%	0.874	80%	0.796	S	S	*	*			trans	54.9	122.5	171.7	53.1	0	0	0	0	117.3
405	G	27.2	Very low	29.7	Very low	79 Å²	79	133 Å²	133	81%	0.814	79%	0.791	S	S	*	*			trans	-91.2	159	-178.8	0	0	0	0	0	114.7
406	S	30.6	Very low	29.1	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	78%	0.784	S	S	*	*			trans	-160.1	148.7	147.5	48.4	0	0	0	0	108.1
407	S	26.1	Very low	28.7	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	79%	0.794	S	S	*	*			trans	-93.1	131.6	-172.3	55.5	0	0	0	0	112.3
408	L	28.9	Very low	28.7	Very low	174 Å²	174	130.4 Å²	130.4	91%	0.911	78%	0.777	S	S	*	*			trans	-140.5	140.8	160.3	-72.9	176.6	0	0	0	110.4
409	S	26.2	Very low	28.6	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	79%	0.788	S	S	*	*			trans	-120.7	164.7	179.4	50.4	0	0	0	0	110.1
410	I	28.6	Very low	28.2	Very low	153 Å²	153	133.2 Å²	133.2	79%	0.785	78%	0.775	S	S	*	*			trans	150.5	138.4	135.9	-78.4	159.3	0	0	0	114.9
411	S	29.8	Very low	28.2	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	77%	0.771	S	S	*	*			trans	64.2	127.6	156.8	65.8	0	0	0	0	123.1
412	Q	26.6	Very low	28.2	Very low	162 Å²	162	135 Å²	135	76%	0.757	77%	0.772	S	S	*	*			trans	-77.9	151.8	159	-64.8	166.7	-61.2	0	0	111.8
413	M	28.6	Very low	28.2	Very low	185 Å²	185	136.4 Å²	136.4	91%	0.911	77%	0.766	S	S	*	*			trans	-127.2	140.9	155.9	-78.8	-93.2	90.3	0	0	108.7
414	H	27.5	Very low	28.2	Very low	179 Å²	179	134.7 Å²	134.7	83%	0.829	77%	0.768	S	S	*	*			trans	-88.4	157.4	-179.8	-77.9	56.4	0	0	0	111.6
415	G	26.2	Very low	28	Very low	73 Å²	73	135.2 Å²	135.2	75%	0.753	76%	0.762	S	S	*	*			trans	122.6	53.8	149.5	0	0	0	0	0	118.2
416	S	28.7	Very low	28	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	76%	0.759	S	S	*	*	S	Bend	trans	-163.6	164.2	152.8	-84.4	0	0	0	0	109.3	E418	S416-E418 PolarHBondContact O-N 2.66Å
417	R	26.8	Very low	27.9	Very low	253 Å²	253	139.4 Å²	139.4	96%	0.955	75%	0.752	S	S	*	*	S	Bend	trans	-73.6	65.2	172.7	-77.3	179.5	167.4	176.2	-5.9	110.6
418	E	28.5	Very low	28	Very low	101 Å²	101	141.1 Å²	141.1	47%	0.472	75%	0.749	S	S	.	*			trans	-114.8	115.7	175.3	-65.6	-172.4	150.9	0	0	109	K389 S416 V420	K389-E418 IonicContact NZ-OE1 2.91Å; K389-E418 PolarHBondContact NZ-OE1 3.04Å; S416-E418 PolarHBondContact O-N 2.66Å; E418-V420 HydrophobicContact CB-CG2 4.02Å; E418-V420 PolarHBondContact O-N 2.78Å
419	F	28.4	Very low	27.9	Very low	157 Å²	157	138.8 Å²	138.8	69%	0.689	74%	0.738	S	S	*	*			trans	-75.6	72.9	170.5	-72.7	-78.9	0	0	0	109.8	F421	F419-F421 HydrophobicContact CB-CD2 4.35Å; F419-F421 HydrophobicContact CB-CE2 3.87Å; F419-F421 HydrophobicContact CB-CZ 4.49Å; F419-F421 AromaticContact CD1-CE2 3.98Å; F419-F421 HydrophobicContact CD1-CE2 3.98Å; F419-F421 AromaticContact CD1-CZ 3.81Å; F419-F421 HydrophobicContact CD1-CZ 3.81Å; F419-F421 HydrophobicContact CG-CE2 4.3Å; F419-F421 PolarHBondContact O-N 3.11Å
420	V	26.3	Very low	28.1	Very low	104 Å²	104	141.5 Å²	141.5	63%	0.63	74%	0.739	S	S	*	*			trans	-85.9	88.5	170.2	-174	0	0	0	0	108.6	E418 V422	E418-V420 HydrophobicContact CB-CG2 4.02Å; E418-V420 PolarHBondContact O-N 2.78Å; V420-V422 PolarHBondContact O-N 3.21Å; V420-V422 VanDerWaalsContact O-N 3.13Å
421	F	30.9	Very low	28	Very low	136 Å²	136	140.6 Å²	140.6	60%	0.596	74%	0.736	S	S	*	*			trans	-74.5	100	165.7	-63.4	-70.3	0	0	0	108.5	F419	F419-F421 HydrophobicContact CB-CD2 4.35Å; F419-F421 HydrophobicContact CB-CE2 3.87Å; F419-F421 HydrophobicContact CB-CZ 4.49Å; F419-F421 AromaticContact CD1-CE2 3.98Å; F419-F421 HydrophobicContact CD1-CE2 3.98Å; F419-F421 AromaticContact CD1-CZ 3.81Å; F419-F421 HydrophobicContact CD1-CZ 3.81Å; F419-F421 HydrophobicContact CG-CE2 4.3Å; F419-F421 PolarHBondContact O-N 3.11Å
422	V	28.1	Very low	27.9	Very low	131 Å²	131	143.5 Å²	143.5	79%	0.794	73%	0.734	S	S	*	*			trans	-56.1	0	174.1	-172	0	0	0	0	109.9	K374 V420	K374-V422 WeakPolarHBondContact CD-OXT 3.5Å; K374-V422 WeakPolarHBondContact CE-OXT 3.35Å; K374-V422 PolarHBondContact NZ-O 2.7Å; K374-V422 PolarHBondContact NZ-OXT 2.66Å; V420-V422 PolarHBondContact O-N 3.21Å; V420-V422 VanDerWaalsContact O-N 3.13Å

Retrieved 422 of 422 residues in 121 ms (Link to these results)

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