G4LWX4_SCHMA Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit 2

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity.

AlphaFold DB , UniProt , Accession G4LWX4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 721 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	52.8	Low	66.3	Low	208 Å²	208	107.7 Å²	107.7	100%	1.025	60%	0.597	S	S	*	*				0	-55.3	0	-123.7	174.6	-177.8	0	0	112.3	H3 V4 T5	M1-H3 PolarHBondContact O-N 3.17Å; M1-V4 PolarHBondContact O-N 3.27Å; M1-T5 PolarHBondContact O-N 3.3Å; M1-T5 PolarHBondContact O-OG1 3.08Å
2	V	61.9	Low	65.1	Low	113 Å²	113	108.5 Å²	108.5	69%	0.685	59%	0.592	S	S	*	*	H	α-helix	trans	-54.1	-42.2	-176.2	-178.2	0	0	0	0	114.5	V4 T5 V6	V2-V4 VanDerWaalsContact C-N 3.35Å; V2-V4 PolarHBondContact O-N 2.96Å; V2-T5 PolarHBondContact O-N 2.83Å; V2-V6 WeakPolarHBondContact O-CG2 3.43Å; V2-V6 PolarHBondContact O-N 2.68Å
3	H	56.6	Low	64.3	Low	161 Å²	161	106.8 Å²	106.8	75%	0.745	58%	0.581	S	S	*	*	H	α-helix	trans	-64.8	-34.5	178	-89.5	30.4	0	0	0	113.8	M1 V7	M1-H3 PolarHBondContact O-N 3.17Å; H3-V7 WeakPolarHBondContact O-CG2 3.4Å; H3-V7 PolarHBondContact O-N 3.49Å
4	V	71.2	Confident	63.2	Low	93 Å²	93	106.6 Å²	106.6	56%	0.564	58%	0.578	S	S	*	*	H	α-helix	trans	-70.3	-39	179.2	179.7	0	0	0	0	110.2	M1 V2 V7 L8	M1-V4 PolarHBondContact O-N 3.27Å; V2-V4 VanDerWaalsContact C-N 3.35Å; V2-V4 PolarHBondContact O-N 2.96Å; V4-V7 PolarHBondContact O-N 3.25Å; V4-L8 HydrophobicContact CG1-CD1 3.79Å; V4-L8 WeakPolarHBondContact O-CD1 3.46Å; V4-L8 PolarHBondContact O-N 2.9Å
5	T	69.6	Low	61.8	Low	84 Å²	84	108.1 Å²	108.1	52%	0.515	58%	0.584	S	S	.	*	H	α-helix	trans	-65.6	-40.8	178.3	-35.9	0	0	0	0	112.1	M1 V2 L8 L9	M1-T5 PolarHBondContact O-N 3.3Å; M1-T5 PolarHBondContact O-OG1 3.08Å; V2-T5 PolarHBondContact O-N 2.83Å; T5-L8 PolarHBondContact O-N 3.35Å; T5-L9 WeakPolarHBondContact O-CB 3.45Å; T5-L9 PolarHBondContact O-N 3.01Å
6	V	73.1	Confident	60.4	Low	81 Å²	81	107.4 Å²	107.4	49%	0.491	58%	0.584	S	S	.	*	H	α-helix	trans	-66.6	-41	178.4	175	0	0	0	0	111.4	V2 L9 L10	V2-V6 WeakPolarHBondContact O-CG2 3.43Å; V2-V6 PolarHBondContact O-N 2.68Å; V6-L9 PolarHBondContact O-N 3.22Å; V6-L10 HydrophobicContact CG1-CD1 4.29Å; V6-L10 PolarHBondContact O-N 2.72Å
7	V	76.8	Confident	58.9	Low	102 Å²	102	109.2 Å²	109.2	62%	0.618	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-40.4	177.2	174.7	0	0	0	0	111.2	H3 V4 L10 A11	H3-V7 WeakPolarHBondContact O-CG2 3.4Å; H3-V7 PolarHBondContact O-N 3.49Å; V4-V7 PolarHBondContact O-N 3.25Å; V7-L10 PolarHBondContact O-N 3.36Å; V7-A11 VanDerWaalsContact O-CB 3.31Å; V7-A11 WeakPolarHBondContact O-CB 3.46Å; V7-A11 PolarHBondContact O-N 3.4Å
8	L	70.9	Confident	57.5	Low	92 Å²	92	108.6 Å²	108.6	48%	0.482	59%	0.591	S	S	.	*	H	α-helix	trans	-64.6	-39.1	174.1	-102	110.9	0	0	0	112.4	V4 T5 A11 H12	V4-L8 HydrophobicContact CG1-CD1 3.79Å; V4-L8 WeakPolarHBondContact O-CD1 3.46Å; V4-L8 PolarHBondContact O-N 2.9Å; T5-L8 PolarHBondContact O-N 3.35Å; L8-A11 PolarHBondContact O-N 2.87Å; L8-H12 WeakPolarHBondContact O-CB 3.45Å; L8-H12 PolarHBondContact O-N 2.85Å; L8-H12 PolarHBondContact O-ND1 3.22Å
9	L	68	Low	56.2	Low	108 Å²	108	107.1 Å²	107.1	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-66.5	-41.8	176.8	-134.5	102.9	0	0	0	111.1	T5 V6 H12 I13	T5-L9 WeakPolarHBondContact O-CB 3.45Å; T5-L9 PolarHBondContact O-N 3.01Å; V6-L9 PolarHBondContact O-N 3.22Å; L9-H12 PolarHBondContact O-N 3.31Å; L9-I13 HydrophobicContact CD2-CD1 4.25Å; L9-I13 WeakPolarHBondContact O-CB 3.41Å; L9-I13 VanDerWaalsContact O-CG1 3.24Å; L9-I13 WeakPolarHBondContact O-CG1 3.28Å; L9-I13 PolarHBondContact O-N 3.29Å
10	L	65.1	Low	55.1	Low	101 Å²	101	111.4 Å²	111.4	53%	0.529	60%	0.596	S	S	.	*	H	α-helix	trans	-63.9	-42.9	174	-113.6	89.1	0	0	0	111.2	V6 V7 H12 I13 I14	V6-L10 HydrophobicContact CG1-CD1 4.29Å; V6-L10 PolarHBondContact O-N 2.72Å; V7-L10 PolarHBondContact O-N 3.36Å; L10-H12 VanDerWaalsContact C-N 3.31Å; L10-H12 PolarHBondContact O-N 3.12Å; L10-I13 PolarHBondContact O-N 2.81Å; L10-I14 WeakPolarHBondContact O-CB 3.14Å; L10-I14 WeakPolarHBondContact O-CG1 3.44Å; L10-I14 PolarHBondContact O-N 3.4Å
11	A	63.2	Low	54.5	Low	42 Å²	42	110.7 Å²	110.7	35%	0.347	60%	0.596	S	S	.	*	H	α-helix	trans	-63.4	-37.5	176.1	0	0	0	0	0	111.5	V7 L8 I14 L15	V7-A11 VanDerWaalsContact O-CB 3.31Å; V7-A11 WeakPolarHBondContact O-CB 3.46Å; V7-A11 PolarHBondContact O-N 3.4Å; L8-A11 PolarHBondContact O-N 2.87Å; A11-I14 PolarHBondContact O-N 2.8Å; A11-L15 WeakPolarHBondContact O-CB 3.49Å; A11-L15 PolarHBondContact O-N 2.94Å
12	H	52.2	Low	54.1	Low	117 Å²	117	108.5 Å²	108.5	54%	0.542	59%	0.589	S	S	.	*	H	α-helix	trans	-70.2	-38.5	174	-80.2	53.5	0	0	0	111.9	L8 L9 L10 I14 L15 V16	L8-H12 WeakPolarHBondContact O-CB 3.45Å; L8-H12 PolarHBondContact O-N 2.85Å; L8-H12 PolarHBondContact O-ND1 3.22Å; L9-H12 PolarHBondContact O-N 3.31Å; L10-H12 VanDerWaalsContact C-N 3.31Å; L10-H12 PolarHBondContact O-N 3.12Å; H12-I14 VanDerWaalsContact C-N 3.31Å; H12-I14 PolarHBondContact O-N 2.63Å; H12-L15 PolarHBondContact O-N 3Å; H12-V16 VanDerWaalsContact O-CB 3.22Å; H12-V16 WeakPolarHBondContact O-CB 3.36Å; H12-V16 WeakPolarHBondContact O-CG2 3.35Å; H12-V16 PolarHBondContact O-N 2.86Å
13	I	54.2	Low	53.8	Low	86 Å²	86	110.2 Å²	110.2	44%	0.441	59%	0.589	S	S	.	*	H	α-helix	trans	-66.6	-36.6	174	-68.1	164.3	0	0	0	110.5	L9 L10 K17	L9-I13 HydrophobicContact CD2-CD1 4.25Å; L9-I13 WeakPolarHBondContact O-CB 3.41Å; L9-I13 VanDerWaalsContact O-CG1 3.24Å; L9-I13 WeakPolarHBondContact O-CG1 3.28Å; L9-I13 PolarHBondContact O-N 3.29Å; L10-I13 PolarHBondContact O-N 2.81Å; I13-K17 HydrophobicContact CG2-CD 4.33Å; I13-K17 WeakPolarHBondContact O-CB 3.46Å; I13-K17 VanDerWaalsContact O-CG 3.29Å; I13-K17 WeakPolarHBondContact O-CG 3.31Å; I13-K17 PolarHBondContact O-N 2.86Å
14	I	49.6	Very low	54.3	Low	105 Å²	105	104 Å²	104	54%	0.538	56%	0.563	S	S	.	*	H	α-helix	trans	-72	-39.6	175.3	-67.1	164.6	0	0	0	110.6	L10 A11 H12 K17 S18	L10-I14 WeakPolarHBondContact O-CB 3.14Å; L10-I14 WeakPolarHBondContact O-CG1 3.44Å; L10-I14 PolarHBondContact O-N 3.4Å; A11-I14 PolarHBondContact O-N 2.8Å; H12-I14 VanDerWaalsContact C-N 3.31Å; H12-I14 PolarHBondContact O-N 2.63Å; I14-K17 CarbonylContact O-C 3.58Å; I14-K17 PolarHBondContact O-N 2.87Å; I14-S18 WeakPolarHBondContact O-CB 3.36Å; I14-S18 PolarHBondContact O-N 3.44Å
15	L	41.3	Very low	54.9	Low	128 Å²	128	101.1 Å²	101.1	67%	0.67	55%	0.545	S	S	*	.	H	α-helix	trans	-67.7	-43.6	175.4	-116.1	90.6	0	0	0	111.3	A11 H12 K17 S18 S19	A11-L15 WeakPolarHBondContact O-CB 3.49Å; A11-L15 PolarHBondContact O-N 2.94Å; H12-L15 PolarHBondContact O-N 3Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 2.96Å; L15-S18 CarbonylContact O-C 3.6Å; L15-S18 PolarHBondContact O-N 2.86Å; L15-S18 VanDerWaalsContact O-N 3.14Å; L15-S19 WeakPolarHBondContact O-CB 3.23Å; L15-S19 PolarHBondContact O-N 2.98Å; L15-S19 PolarHBondContact O-OG 3.08Å
16	V	40.2	Very low	55.8	Low	98 Å²	98	97.9 Å²	97.9	59%	0.594	53%	0.525	S	S	*	.	H	α-helix	trans	-68.6	-30.9	176.9	173.9	0	0	0	0	111	H12 S19 R20	H12-V16 VanDerWaalsContact O-CB 3.22Å; H12-V16 WeakPolarHBondContact O-CB 3.36Å; H12-V16 WeakPolarHBondContact O-CG2 3.35Å; H12-V16 PolarHBondContact O-N 2.86Å; V16-S19 WeakPolarHBondContact CA-OG 3.24Å; V16-S19 PolarHBondContact O-OG 3.08Å; V16-S19 VanDerWaalsContact O-OG 3.07Å; V16-R20 PolarHBondContact O-N 2.88Å
17	K	34.9	Very low	56.6	Low	137 Å²	137	94.7 Å²	94.7	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-75.5	-32.4	168.9	-80.4	-176.2	175.4	-177.9	0	112.8	I13 I14 L15 S19 R20	I13-K17 HydrophobicContact CG2-CD 4.33Å; I13-K17 WeakPolarHBondContact O-CB 3.46Å; I13-K17 VanDerWaalsContact O-CG 3.29Å; I13-K17 WeakPolarHBondContact O-CG 3.31Å; I13-K17 PolarHBondContact O-N 2.86Å; I14-K17 CarbonylContact O-C 3.58Å; I14-K17 PolarHBondContact O-N 2.87Å; L15-K17 VanDerWaalsContact C-N 3.29Å; L15-K17 PolarHBondContact O-N 2.96Å; K17-S19 VanDerWaalsContact C-N 3.29Å; K17-R20 WeakPolarHBondContact O-CB 3.46Å; K17-R20 PolarHBondContact O-N 3.3Å
18	S	32.9	Very low	57.3	Low	98 Å²	98	89.9 Å²	89.9	69%	0.685	48%	0.476	S	S	*	.	H	α-helix	trans	-76	-20.6	175.6	-172	0	0	0	0	112	I14 L15 R20	I14-S18 WeakPolarHBondContact O-CB 3.36Å; I14-S18 PolarHBondContact O-N 3.44Å; L15-S18 CarbonylContact O-C 3.6Å; L15-S18 PolarHBondContact O-N 2.86Å; L15-S18 VanDerWaalsContact O-N 3.14Å; S18-R20 VanDerWaalsContact C-N 3.3Å
19	S	34.2	Very low	58.1	Low	81 Å²	81	86 Å²	86	57%	0.566	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	6.9	168.7	69.8	0	0	0	0	112.7	L15 V16 K17 T21	L15-S19 WeakPolarHBondContact O-CB 3.23Å; L15-S19 PolarHBondContact O-N 2.98Å; L15-S19 PolarHBondContact O-OG 3.08Å; V16-S19 WeakPolarHBondContact CA-OG 3.24Å; V16-S19 PolarHBondContact O-OG 3.08Å; V16-S19 VanDerWaalsContact O-OG 3.07Å; K17-S19 VanDerWaalsContact C-N 3.29Å; S19-T21 PolarHBondContact O-N 3.16Å
20	R	34.1	Very low	59.1	Low	193 Å²	193	81.3 Å²	81.3	73%	0.728	43%	0.433	S	S	*	.	S	Bend	trans	-65.3	88.3	147.5	-78	-179.4	173.3	173.7	-4.1	104.8	V16 K17 S18 D22	V16-R20 PolarHBondContact O-N 2.88Å; K17-R20 WeakPolarHBondContact O-CB 3.46Å; K17-R20 PolarHBondContact O-N 3.3Å; S18-R20 VanDerWaalsContact C-N 3.3Å; R20-D22 PolarHBondContact O-N 3.24Å; R20-D22 VanDerWaalsContact O-N 3.12Å
21	T	40.9	Very low	60.2	Low	97 Å²	97	76.8 Å²	76.8	60%	0.595	41%	0.41	S	S	*	.			trans	-27.7	119.7	154.5	36.1	0	0	0	0	107.2	S19 Q23	S19-T21 PolarHBondContact O-N 3.16Å; T21-Q23 VanDerWaalsContact C-N 3.33Å; T21-Q23 WeakPolarHBondContact O-CA 3.44Å; T21-Q23 PolarHBondContact O-N 2.9Å
22	D	44.9	Very low	61.6	Low	162 Å²	162	74.8 Å²	74.8	87%	0.866	39%	0.393	S	S	*	.			trans	-44.9	108.1	170.9	-121.6	-17.8	0	0	0	105.5	R20 S24	R20-D22 PolarHBondContact O-N 3.24Å; R20-D22 VanDerWaalsContact O-N 3.12Å; D22-S24 PolarHBondContact O-N 3.32Å
23	Q	56.6	Low	63.3	Low	149 Å²	149	70.4 Å²	70.4	70%	0.696	38%	0.376	S	S	*	.			trans	-71.5	101.9	-160.6	-148.5	-178.8	13.1	0	0	105.3	T21 N25	T21-Q23 VanDerWaalsContact C-N 3.33Å; T21-Q23 WeakPolarHBondContact O-CA 3.44Å; T21-Q23 PolarHBondContact O-N 2.9Å; Q23-N25 PolarHBondContact O-N 2.81Å
24	S	67.1	Low	65	Low	29 Å²	29	70.6 Å²	70.6	20%	0.203	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-54.3	143.5	-176.3	57.4	0	0	0	0	109.4	D22 Q403	D22-S24 PolarHBondContact O-N 3.32Å; S24-Q403 VanDerWaalsContact CB-CD 3.47Å; S24-Q403 PolarHBondContact OG-NE2 3.46Å; S24-Q403 PolarHBondContact OG-OE1 2.86Å; S24-Q403 VanDerWaalsContact OG-OE1 3.06Å
25	N	82.8	Confident	66.8	Low	34 Å²	34	73.8 Å²	73.8	18%	0.182	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-67.3	145.7	175.1	-74.4	-36.1	0	0	0	110.1	Q23 N238 A400 S401 V402	Q23-N25 PolarHBondContact O-N 2.81Å; N25-N238 WeakPolarHBondContact OD1-CB 3.3Å; N25-A400 WeakPolarHBondContact CB-O 3.43Å; N25-A400 PolarHBondContact ND2-O 2.82Å; N25-S401 PolarHBondContact N-O 2.94Å; N25-V402 HydrophobicContact CB-CG1 4Å; N25-V402 WeakPolarHBondContact O-CG1 3.39Å
26	T	89	Confident	69.2	Low	16 Å²	16	68 Å²	68	10%	0.098	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-73.7	141.4	178.1	-52.1	0	0	0	0	109.3	N204 N238 V241 K242 N245	T26-N204 HydrophobicContact CG2-CB 3.7Å; T26-N238 VanDerWaalsContact CB-OD1 3.27Å; T26-N238 WeakPolarHBondContact CB-OD1 3.4Å; T26-N238 PolarHBondContact N-OD1 3.06Å; T26-N238 PolarHBondContact OG1-OD1 3.5Å; T26-V241 HydrophobicContact CG2-CG1 4.33Å; T26-V241 VanDerWaalsContact O-CG1 3.31Å; T26-V241 WeakPolarHBondContact O-CG1 3.31Å; T26-K242 HydrophobicContact CG2-CG 4.12Å; T26-K242 WeakPolarHBondContact OG1-CE 3.28Å; T26-K242 WeakPolarHBondContact OG1-CG 3.49Å; T26-N245 WeakPolarHBondContact CG2-ND2 3.36Å
27	L	90	Very high	71.8	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-77	148.9	170.2	-67.8	168.4	0	0	0	111.2	N245 I280 P296 G398 V402 Q403 I404	L27-N245 PolarHBondContact O-ND2 3.2Å; L27-N245 PolarHBondContact O-OD1 3.01Å; L27-I280 HydrophobicContact CD2-CD1 3.72Å; L27-I280 HydrophobicContact CD2-CG1 4.27Å; L27-P296 HydrophobicContact CD1-CG 4.35Å; L27-G398 WeakPolarHBondContact CD2-O 3.41Å; L27-V402 HydrophobicContact CD2-CB 3.58Å; L27-V402 HydrophobicContact CD2-CG1 3.97Å; L27-V402 HydrophobicContact CD2-CG2 3.54Å; L27-V402 HydrophobicContact CG-CB 4.11Å; L27-Q403 WeakPolarHBondContact CD1-O 3.39Å; L27-I404 HydrophobicContact CD1-CB 4.4Å; L27-I404 HydrophobicContact CD1-CG1 4.12Å; L27-I404 HydrophobicContact CD2-CG1 4.38Å
28	F	91.9	Very high	74.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.009	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-67.9	133.6	160.8	-73.6	-69.5	0	0	0	110	G30 V241 F244 N245 L269 P277 V278 V279 I314 L397	F28-G30 VanDerWaalsContact C-N 3.31Å; F28-G30 PolarHBondContact O-N 2.81Å; F28-V241 HydrophobicContact CD1-CG1 3.77Å; F28-V241 HydrophobicContact CD2-CG1 4.36Å; F28-V241 HydrophobicContact CE1-CB 4.23Å; F28-V241 HydrophobicContact CE1-CG1 3.84Å; F28-V241 HydrophobicContact CE1-CG2 4.19Å; F28-V241 HydrophobicContact CE2-CG1 4.43Å; F28-V241 HydrophobicContact CE2-CG2 4.02Å; F28-V241 HydrophobicContact CG-CG1 4.05Å; F28-V241 HydrophobicContact CZ-CB 4.32Å; F28-V241 HydrophobicContact CZ-CG1 4.19Å; F28-V241 HydrophobicContact CZ-CG2 3.78Å; F28-F244 HydrophobicContact CD1-CB 4.35Å; F28-F244 HydrophobicContact CE1-CB 3.72Å; F28-F244 HydrophobicContact CE1-CG 4.45Å; F28-N245 VanDerWaalsContact CA-OD1 3.32Å; F28-N245 WeakPolarHBondContact CA-OD1 3.48Å; F28-L269 HydrophobicContact CZ-CD2 4.28Å; F28-P277 HydrophobicContact CE2-CB 3.75Å; F28-P277 HydrophobicContact CZ-CB 3.88Å; F28-V278 WeakPolarHBondContact CD2-O 3.07Å; F28-V279 HydrophobicContact CB-CB 4.46Å; F28-V279 HydrophobicContact CB-CG1 4.48Å; F28-V279 HydrophobicContact CB-CG2 3.83Å; F28-V279 HydrophobicContact CG-CG2 4.46Å; F28-I314 HydrophobicContact CD1-CD1 3.42Å; F28-I314 VanDerWaalsContact CD1-CD1 3.42Å; F28-I314 HydrophobicContact CD1-CG1 4.47Å; F28-I314 HydrophobicContact CD2-CD1 4.47Å; F28-I314 HydrophobicContact CE1-CD1 3.41Å; F28-I314 VanDerWaalsContact CE1-CD1 3.41Å; F28-I314 HydrophobicContact CE2-CD1 4.47Å; F28-I314 HydrophobicContact CG-CD1 3.98Å; F28-I314 HydrophobicContact CZ-CD1 3.97Å; F28-L397 HydrophobicContact CE2-CB 3.88Å; F28-L397 WeakPolarHBondContact CE2-O 3.15Å; F28-L397 HydrophobicContact CZ-CB 4.2Å
29	I	87.5	Confident	77.5	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.056	31%	0.307	C	S	.	.			trans	-82.3	-5.9	-178.1	62.7	174.5	0	0	0	114	N245 Y248 T249 P295	I29-N245 HydrophobicContact CD1-CB 4.15Å; I29-N245 WeakPolarHBondContact CD1-O 3.33Å; I29-N245 HydrophobicContact CG1-CB 4.2Å; I29-N245 HydrophobicContact CG2-CB 4.43Å; I29-N245 PolarHBondContact N-OD1 2.77Å; I29-Y248 HydrophobicContact CD1-CD1 3.61Å; I29-Y248 HydrophobicContact CD1-CE1 4.44Å; I29-Y248 HydrophobicContact CD1-CG 4.37Å; I29-Y248 HydrophobicContact CG1-CD1 3.48Å; I29-Y248 VanDerWaalsContact CG1-CD1 3.48Å; I29-Y248 HydrophobicContact CG1-CE1 4.15Å; I29-Y248 HydrophobicContact CG1-CG 4.07Å; I29-T249 HydrophobicContact CD1-CG2 3.66Å; I29-P295 HydrophobicContact CG2-CB 4.22Å; I29-P295 HydrophobicContact CG2-CG 3.93Å
30	G	87.8	Confident	80.5	Confident	8 Å²	8	55.6 Å²	55.6	8%	0.082	28%	0.28	C	S	.	.			trans	166.2	173.2	177.8	0	0	0	0	0	113.8	F28	F28-G30 VanDerWaalsContact C-N 3.31Å; F28-G30 PolarHBondContact O-N 2.81Å
31	S	89.7	Confident	83.4	Confident	6 Å²	6	51 Å²	51	4%	0.042	26%	0.263	C	S	.	.			trans	-110.6	145.7	178.6	65.9	0	0	0	0	112.3	S33 Y248 K312 I314	S31-S33 PolarHBondContact O-N 2.95Å; S31-S33 VanDerWaalsContact O-N 3.13Å; S31-Y248 WeakPolarHBondContact O-CE2 3.34Å; S31-K312 VanDerWaalsContact OG-CE 3.25Å; S31-K312 WeakPolarHBondContact OG-CE 3.31Å; S31-K312 PolarHBondContact OG-NZ 3.29Å; S31-I314 CarbonylContact C-O 3.41Å; S31-I314 VanDerWaalsContact CA-O 3.31Å; S31-I314 WeakPolarHBondContact CA-O 3.35Å
32	I	91.3	Very high	86	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.			trans	-66.1	108.8	171	-58.6	-61.6	0	0	0	109.4	D36 K37 Y248 R251 F266 I314 W315	I32-D36 HydrophobicContact CG2-CB 3.99Å; I32-K37 HydrophobicContact CG2-CG 3.94Å; I32-Y248 HydrophobicContact CD1-CD2 4.06Å; I32-Y248 HydrophobicContact CD1-CE2 4.49Å; I32-R251 HydrophobicContact CD1-CB 4.07Å; I32-F266 HydrophobicContact CD1-CD1 4.44Å; I32-F266 HydrophobicContact CD1-CD2 4.36Å; I32-F266 HydrophobicContact CD1-CE1 4.12Å; I32-F266 HydrophobicContact CD1-CE2 4.03Å; I32-F266 HydrophobicContact CD1-CZ 3.91Å; I32-F266 HydrophobicContact CG1-CD1 3.75Å; I32-F266 HydrophobicContact CG1-CD2 4.3Å; I32-F266 HydrophobicContact CG1-CE1 3.8Å; I32-F266 HydrophobicContact CG1-CE2 4.34Å; I32-F266 HydrophobicContact CG1-CG 4.02Å; I32-F266 HydrophobicContact CG1-CZ 4.11Å; I32-I314 PolarHBondContact N-O 3.02Å; I32-W315 HydrophobicContact CB-CE3 3.9Å; I32-W315 HydrophobicContact CB-CZ3 4.14Å; I32-W315 HydrophobicContact CG1-CE3 4Å; I32-W315 HydrophobicContact CG1-CZ3 4.07Å; I32-W315 HydrophobicContact CG2-CE3 4.05Å; I32-W315 HydrophobicContact CG2-CZ3 3.89Å
33	S	88.4	Confident	88.3	Confident	25 Å²	25	41.9 Å²	41.9	18%	0.175	22%	0.216	C	C	.	.			trans	-80	168	-177.7	68.4	0	0	0	0	112.7	S31 R35 D36 K37	S31-S33 PolarHBondContact O-N 2.95Å; S31-S33 VanDerWaalsContact O-N 3.13Å; S33-R35 PolarHBondContact O-N 2.79Å; S33-R35 PolarHBondContact OG-N 2.91Å; S33-D36 WeakPolarHBondContact CB-OD2 3.38Å; S33-D36 PolarHBondContact N-OD2 3.15Å; S33-D36 PolarHBondContact O-N 3.43Å; S33-D36 VanDerWaalsContact O-N 3.14Å; S33-D36 VanDerWaalsContact OG-CG 3.23Å; S33-D36 PolarHBondContact OG-N 3.07Å; S33-D36 PolarHBondContact OG-OD2 2.97Å; S33-K37 WeakPolarHBondContact O-CG 3.34Å; S33-K37 PolarHBondContact O-N 2.91Å
34	V	89	Confident	90.1	Very high	90 Å²	90	34.8 Å²	34.8	55%	0.545	18%	0.183	S	C	.	.	H	α-helix	trans	-55.1	-39.2	169.3	170.7	0	0	0	0	111.2	D36 K37 S38 D317	V34-D36 PolarHBondContact O-N 3.4Å; V34-K37 PolarHBondContact O-N 2.88Å; V34-S38 PolarHBondContact O-N 2.92Å; V34-S38 PolarHBondContact O-OG 2.9Å; V34-S38 VanDerWaalsContact O-OG 3.09Å; V34-D317 VanDerWaalsContact CG2-OD2 3.29Å; V34-D317 WeakPolarHBondContact CG2-OD2 2.99Å; V34-D317 PolarHBondContact N-OD2 3.38Å
35	R	88.7	Confident	91.3	Very high	173 Å²	173	36.6 Å²	36.6	65%	0.653	19%	0.188	S	C	*	.	H	α-helix	trans	-61.6	-43.7	176.8	-175.4	-171.5	-64.9	-173.5	2.2	111.6	S33 K37 S38 H39	S33-R35 PolarHBondContact O-N 2.79Å; S33-R35 PolarHBondContact OG-N 2.91Å; R35-K37 VanDerWaalsContact C-N 3.34Å; R35-S38 PolarHBondContact O-N 2.8Å; R35-H39 PolarHBondContact O-N 3.01Å
36	D	91.7	Very high	91.7	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-40.6	178.1	-58.9	-57	0	0	0	110.9	I32 S33 V34 H39 F40 R251 Q252	I32-D36 HydrophobicContact CG2-CB 3.99Å; S33-D36 WeakPolarHBondContact CB-OD2 3.38Å; S33-D36 PolarHBondContact N-OD2 3.15Å; S33-D36 PolarHBondContact O-N 3.43Å; S33-D36 VanDerWaalsContact O-N 3.14Å; S33-D36 VanDerWaalsContact OG-CG 3.23Å; S33-D36 PolarHBondContact OG-N 3.07Å; S33-D36 PolarHBondContact OG-OD2 2.97Å; V34-D36 PolarHBondContact O-N 3.4Å; D36-H39 WeakPolarHBondContact O-CB 3.44Å; D36-H39 PolarHBondContact O-N 2.91Å; D36-F40 HydrophobicContact CB-CE2 4.46Å; D36-F40 WeakPolarHBondContact O-CD2 3.3Å; D36-F40 PolarHBondContact O-N 2.83Å; D36-R251 VanDerWaalsContact CG-CD 3.48Å; D36-R251 VanDerWaalsContact OD1-CD 3.26Å; D36-R251 WeakPolarHBondContact OD1-CD 3.35Å; D36-R251 WeakPolarHBondContact OD1-CG 3.45Å; D36-R251 IonicContact OD1-NE 3.47Å; D36-R251 PolarHBondContact OD1-NE 2.71Å; D36-R251 IonicContact OD2-NE 2.74Å; D36-R251 PolarHBondContact OD2-NE 3.41Å; D36-Q252 PolarHBondContact OD1-NE2 3.4Å
37	K	94.1	Very high	91.7	Very high	45 Å²	45	41.4 Å²	41.4	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-43	174	-66.7	-178.7	-175.5	-177.6	0	112.1	I32 S33 V34 R35 H39 F40 R41 L68 W315	I32-K37 HydrophobicContact CG2-CG 3.94Å; S33-K37 WeakPolarHBondContact O-CG 3.34Å; S33-K37 PolarHBondContact O-N 2.91Å; V34-K37 PolarHBondContact O-N 2.88Å; R35-K37 VanDerWaalsContact C-N 3.34Å; K37-H39 VanDerWaalsContact C-N 3.33Å; K37-H39 PolarHBondContact O-N 3.45Å; K37-F40 PolarHBondContact O-N 2.82Å; K37-R41 WeakPolarHBondContact O-CB 3.31Å; K37-R41 PolarHBondContact O-N 3.05Å; K37-L68 HydrophobicContact CB-CD2 4.09Å; K37-L68 HydrophobicContact CG-CD2 3.95Å; K37-W315 WeakPolarHBondContact CE-O 3.33Å; K37-W315 PolarHBondContact NZ-O 2.9Å
38	S	93.5	Very high	91.4	Very high	67 Å²	67	41.9 Å²	41.9	47%	0.469	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-38.8	174.6	-59.2	0	0	0	0	112.4	V34 R35 R41 S42	V34-S38 PolarHBondContact O-N 2.92Å; V34-S38 PolarHBondContact O-OG 2.9Å; V34-S38 VanDerWaalsContact O-OG 3.09Å; R35-S38 PolarHBondContact O-N 2.8Å; S38-R41 PolarHBondContact O-N 2.81Å; S38-S42 PolarHBondContact O-N 2.85Å
39	H	94.7	Very high	90.9	Very high	43 Å²	43	46 Å²	46	20%	0.199	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-54	173	172.1	70.9	0	0	0	111	R35 D36 K37 R41 S42 V43 Q252 T253	R35-H39 PolarHBondContact O-N 3.01Å; D36-H39 WeakPolarHBondContact O-CB 3.44Å; D36-H39 PolarHBondContact O-N 2.91Å; K37-H39 VanDerWaalsContact C-N 3.33Å; K37-H39 PolarHBondContact O-N 3.45Å; H39-R41 VanDerWaalsContact C-N 3.29Å; H39-R41 PolarHBondContact O-N 2.87Å; H39-S42 PolarHBondContact O-N 3.48Å; H39-S42 VanDerWaalsContact O-N 3.13Å; H39-S42 PolarHBondContact O-OG 3.33Å; H39-V43 WeakPolarHBondContact O-CG2 3.41Å; H39-V43 PolarHBondContact O-N 2.96Å; H39-V43 VanDerWaalsContact O-N 3.09Å; H39-Q252 PolarHBondContact NE2-O 3.45Å; H39-T253 PolarHBondContact NE2-O 3.19Å
40	F	96.4	Very high	90.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.6	-44.3	178	-70.4	-53.5	0	0	0	112.5	D36 K37 S42 V43 F44 L68 R251 T253 L262 V263	D36-F40 HydrophobicContact CB-CE2 4.46Å; D36-F40 WeakPolarHBondContact O-CD2 3.3Å; D36-F40 PolarHBondContact O-N 2.83Å; K37-F40 PolarHBondContact O-N 2.82Å; F40-S42 PolarHBondContact O-N 3.14Å; F40-V43 WeakPolarHBondContact O-CB 3.16Å; F40-V43 PolarHBondContact O-N 2.95Å; F40-F44 HydrophobicContact CB-CD2 4.44Å; F40-F44 HydrophobicContact CB-CE2 3.81Å; F40-F44 HydrophobicContact CB-CZ 4.37Å; F40-F44 WeakPolarHBondContact O-CD2 3.44Å; F40-F44 WeakPolarHBondContact O-CE2 3.39Å; F40-F44 VanDerWaalsContact O-CG 3.31Å; F40-F44 WeakPolarHBondContact O-CG 3.46Å; F40-F44 PolarHBondContact O-N 2.81Å; F40-L68 HydrophobicContact CB-CD1 4.07Å; F40-R251 WeakPolarHBondContact CE1-O 3.32Å; F40-R251 HydrophobicContact CE2-CB 4.46Å; F40-R251 HydrophobicContact CZ-CB 4.03Å; F40-R251 WeakPolarHBondContact CZ-O 3.35Å; F40-T253 HydrophobicContact CE1-CG2 4.32Å; F40-L262 HydrophobicContact CE1-CD2 4.13Å; F40-L262 HydrophobicContact CE2-CD2 4.09Å; F40-L262 HydrophobicContact CZ-CD1 4.36Å; F40-L262 HydrophobicContact CZ-CD2 3.44Å; F40-L262 VanDerWaalsContact CZ-CD2 3.44Å; F40-V263 HydrophobicContact CB-CG2 4.08Å; F40-V263 HydrophobicContact CD1-CG2 3.8Å; F40-V263 HydrophobicContact CD2-CG2 3.56Å; F40-V263 HydrophobicContact CE1-CG2 4.05Å; F40-V263 HydrophobicContact CE2-CG2 3.83Å; F40-V263 HydrophobicContact CG-CG2 3.54Å; F40-V263 HydrophobicContact CZ-CG2 4.06Å
41	R	95.4	Very high	89.8	Confident	96 Å²	96	53.1 Å²	53.1	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-55.7	-50	176.2	-176.3	-176.4	-179.9	147.5	0.6	111.4	K37 S38 H39 V43 F44 E45 L68 E70	K37-R41 WeakPolarHBondContact O-CB 3.31Å; K37-R41 PolarHBondContact O-N 3.05Å; S38-R41 PolarHBondContact O-N 2.81Å; H39-R41 VanDerWaalsContact C-N 3.29Å; H39-R41 PolarHBondContact O-N 2.87Å; R41-V43 VanDerWaalsContact C-N 3.29Å; R41-V43 PolarHBondContact O-N 2.92Å; R41-F44 PolarHBondContact O-N 2.72Å; R41-F44 VanDerWaalsContact O-N 3.11Å; R41-E45 HydrophobicContact CG-CG 4.1Å; R41-E45 IonicContact CZ-OE1 3.88Å; R41-E45 IonicContact NE-OE1 2.86Å; R41-E45 PolarHBondContact NE-OE1 2.79Å; R41-E45 IonicContact NE-OE2 2.83Å; R41-E45 IonicContact NH2-OE1 2.59Å; R41-E45 PolarHBondContact NH2-OE1 2.61Å; R41-E45 VanDerWaalsContact NH2-OE1 3.14Å; R41-E45 WeakPolarHBondContact O-CB 3.14Å; R41-E45 WeakPolarHBondContact O-CG 3.44Å; R41-E45 PolarHBondContact O-N 2.83Å; R41-L68 HydrophobicContact CB-CD1 4.15Å; R41-E70 WeakPolarHBondContact CD-OE2 3.34Å; R41-E70 WeakPolarHBondContact CG-OE2 3.12Å; R41-E70 IonicContact CZ-OE1 2.71Å; R41-E70 IonicContact CZ-OE2 2.63Å; R41-E70 VanDerWaalsContact CZ-OE2 3.23Å; R41-E70 IonicContact NE-OE2 2.58Å; R41-E70 PolarHBondContact NE-OE2 3.37Å; R41-E70 IonicContact NH1-OE1 2.67Å; R41-E70 PolarHBondContact NH1-OE1 2.93Å; R41-E70 IonicContact NH1-OE2 2.9Å; R41-E70 PolarHBondContact NH1-OE2 3.46Å; R41-E70 VanDerWaalsContact NH1-OE2 3.13Å
42	S	94.7	Very high	88.7	Confident	62 Å²	62	55.9 Å²	55.9	43%	0.434	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-36.6	179.7	71.7	0	0	0	0	112.7	S38 H39 F40 R46	S38-S42 PolarHBondContact O-N 2.85Å; H39-S42 PolarHBondContact O-N 3.48Å; H39-S42 VanDerWaalsContact O-N 3.13Å; H39-S42 PolarHBondContact O-OG 3.33Å; F40-S42 PolarHBondContact O-N 3.14Å; S42-R46 WeakPolarHBondContact O-CB 3.2Å; S42-R46 PolarHBondContact O-N 2.77Å
43	V	94.2	Very high	87.6	Confident	6 Å²	6	60.1 Å²	60.1	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-62	-44.1	174.2	172.2	0	0	0	0	111.5	H39 F40 R41 Q47 A254 V256	H39-V43 WeakPolarHBondContact O-CG2 3.41Å; H39-V43 PolarHBondContact O-N 2.96Å; H39-V43 VanDerWaalsContact O-N 3.09Å; F40-V43 WeakPolarHBondContact O-CB 3.16Å; F40-V43 PolarHBondContact O-N 2.95Å; R41-V43 VanDerWaalsContact C-N 3.29Å; R41-V43 PolarHBondContact O-N 2.92Å; V43-Q47 PolarHBondContact O-N 3.31Å; V43-A254 WeakPolarHBondContact CG1-O 3.13Å; V43-V256 HydrophobicContact CG1-CG2 4.12Å
44	F	94.9	Very high	87.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-75.1	-43.4	-178.5	-56.2	-44	0	0	0	112.8	F40 R41 R46 Q47 I48 A61 I65 L68 V256 A260 V263	F40-F44 HydrophobicContact CB-CD2 4.44Å; F40-F44 HydrophobicContact CB-CE2 3.81Å; F40-F44 HydrophobicContact CB-CZ 4.37Å; F40-F44 WeakPolarHBondContact O-CD2 3.44Å; F40-F44 WeakPolarHBondContact O-CE2 3.39Å; F40-F44 VanDerWaalsContact O-CG 3.31Å; F40-F44 WeakPolarHBondContact O-CG 3.46Å; F40-F44 PolarHBondContact O-N 2.81Å; R41-F44 PolarHBondContact O-N 2.72Å; R41-F44 VanDerWaalsContact O-N 3.11Å; F44-R46 VanDerWaalsContact C-N 3.34Å; F44-R46 PolarHBondContact O-N 2.89Å; F44-Q47 PolarHBondContact O-N 3.31Å; F44-I48 WeakPolarHBondContact O-CG1 3.36Å; F44-I48 PolarHBondContact O-N 3.27Å; F44-I48 VanDerWaalsContact O-N 3.12Å; F44-A61 HydrophobicContact CB-CB 4.13Å; F44-A61 HydrophobicContact CD1-CB 4.43Å; F44-I65 HydrophobicContact CB-CD1 3.85Å; F44-I65 HydrophobicContact CB-CG1 3.6Å; F44-I65 HydrophobicContact CD2-CG1 4.09Å; F44-I65 HydrophobicContact CG-CG1 4.22Å; F44-L68 HydrophobicContact CD2-CD1 4.07Å; F44-L68 HydrophobicContact CE2-CD1 4.03Å; F44-V256 HydrophobicContact CD1-CG1 4.25Å; F44-A260 HydrophobicContact CE1-CB 4.03Å; F44-A260 HydrophobicContact CZ-CB 4.35Å; F44-V263 HydrophobicContact CE2-CG2 4.28Å; F44-V263 HydrophobicContact CZ-CG2 4.22Å
45	E	91.7	Very high	86.8	Confident	66 Å²	66	57.9 Å²	57.9	31%	0.308	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-43.6	177.5	-71.4	-178.1	159.5	0	0	110.9	R41 Q47 I48 S49 P73	R41-E45 HydrophobicContact CG-CG 4.1Å; R41-E45 IonicContact CZ-OE1 3.88Å; R41-E45 IonicContact NE-OE1 2.86Å; R41-E45 PolarHBondContact NE-OE1 2.79Å; R41-E45 IonicContact NE-OE2 2.83Å; R41-E45 IonicContact NH2-OE1 2.59Å; R41-E45 PolarHBondContact NH2-OE1 2.61Å; R41-E45 VanDerWaalsContact NH2-OE1 3.14Å; R41-E45 WeakPolarHBondContact O-CB 3.14Å; R41-E45 WeakPolarHBondContact O-CG 3.44Å; R41-E45 PolarHBondContact O-N 2.83Å; E45-Q47 VanDerWaalsContact C-N 3.32Å; E45-Q47 PolarHBondContact O-N 2.84Å; E45-I48 PolarHBondContact O-N 3.26Å; E45-S49 PolarHBondContact O-N 3.14Å; E45-S49 PolarHBondContact O-OG 2.86Å; E45-P73 HydrophobicContact CG-CG 3.89Å
46	R	90.6	Very high	86.7	Confident	129 Å²	129	50.3 Å²	50.3	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-42.2	175	-174.9	175.7	68.3	156.3	1.7	112.3	S42 F44 I48 S49 E50	S42-R46 WeakPolarHBondContact O-CB 3.2Å; S42-R46 PolarHBondContact O-N 2.77Å; F44-R46 VanDerWaalsContact C-N 3.34Å; F44-R46 PolarHBondContact O-N 2.89Å; R46-I48 VanDerWaalsContact C-N 3.32Å; R46-I48 PolarHBondContact O-N 3.13Å; R46-S49 WeakPolarHBondContact CA-OG 3.38Å; R46-S49 PolarHBondContact O-N 2.98Å; R46-S49 PolarHBondContact O-OG 3.23Å; R46-E50 WeakPolarHBondContact CD-OE1 3.42Å; R46-E50 HydrophobicContact CG-CG 4.05Å; R46-E50 WeakPolarHBondContact CG-OE1 3.42Å; R46-E50 WeakPolarHBondContact O-CB 3.32Å; R46-E50 WeakPolarHBondContact O-CG 3.39Å; R46-E50 PolarHBondContact O-N 3.1Å
47	Q	89	Confident	86.5	Confident	22 Å²	22	54.6 Å²	54.6	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-37.9	178.6	-180	61.2	49.9	0	0	112.3	V43 F44 E45 S51 K57 A61 V256	V43-Q47 PolarHBondContact O-N 3.31Å; F44-Q47 PolarHBondContact O-N 3.31Å; E45-Q47 VanDerWaalsContact C-N 3.32Å; E45-Q47 PolarHBondContact O-N 2.84Å; Q47-S51 VanDerWaalsContact NE2-CB 3.32Å; Q47-S51 PolarHBondContact O-N 2.83Å; Q47-K57 HydrophobicContact CG-CB 4.07Å; Q47-K57 VanDerWaalsContact NE2-CB 3.31Å; Q47-A61 HydrophobicContact CB-CB 4.14Å; Q47-A61 HydrophobicContact CG-CB 4.13Å; Q47-V256 HydrophobicContact CB-CG1 4.33Å; Q47-V256 HydrophobicContact CB-CG2 3.86Å; Q47-V256 HydrophobicContact CG-CG1 4.02Å; Q47-V256 HydrophobicContact CG-CG2 3.92Å
48	I	84.5	Confident	86.2	Confident	23 Å²	23	52.5 Å²	52.5	12%	0.118	29%	0.285	C	S	.	.	H	α-helix	trans	-68.6	-38.9	177.6	-68.4	174.5	0	0	0	110.7	F44 E45 R46 A61 I65 V72 A78	F44-I48 WeakPolarHBondContact O-CG1 3.36Å; F44-I48 PolarHBondContact O-N 3.27Å; F44-I48 VanDerWaalsContact O-N 3.12Å; E45-I48 PolarHBondContact O-N 3.26Å; R46-I48 VanDerWaalsContact C-N 3.32Å; R46-I48 PolarHBondContact O-N 3.13Å; I48-A61 HydrophobicContact CD1-CB 4.17Å; I48-A61 HydrophobicContact CG1-CB 3.82Å; I48-I65 HydrophobicContact CD1-CD1 3.45Å; I48-I65 VanDerWaalsContact CD1-CD1 3.45Å; I48-V72 HydrophobicContact CD1-CG1 4.03Å; I48-A78 HydrophobicContact CG2-CB 4.48Å
49	S	82.1	Confident	86.1	Confident	89 Å²	89	49.5 Å²	49.5	62%	0.622	26%	0.263	S	S	*	.	H	α-helix	trans	-74.6	-40.7	179.9	57.8	0	0	0	0	113.9	E45 R46	E45-S49 PolarHBondContact O-N 3.14Å; E45-S49 PolarHBondContact O-OG 2.86Å; R46-S49 WeakPolarHBondContact CA-OG 3.38Å; R46-S49 PolarHBondContact O-N 2.98Å; R46-S49 PolarHBondContact O-OG 3.23Å
50	E	80.8	Confident	86.1	Confident	125 Å²	125	47.6 Å²	47.6	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-88.1	-25.7	-169.7	-69.8	178.1	177.4	0	0	114.2	R46	R46-E50 WeakPolarHBondContact CD-OE1 3.42Å; R46-E50 HydrophobicContact CG-CG 4.05Å; R46-E50 WeakPolarHBondContact CG-OE1 3.42Å; R46-E50 WeakPolarHBondContact O-CB 3.32Å; R46-E50 WeakPolarHBondContact O-CG 3.39Å; R46-E50 PolarHBondContact O-N 3.1Å
51	S	70.5	Confident	86	Confident	43 Å²	43	47.6 Å²	47.6	30%	0.301	25%	0.254	S	S	.	.			trans	-145.6	66.9	-169.1	-74	0	0	0	0	113.1	Q47 S53	Q47-S51 VanDerWaalsContact NE2-CB 3.32Å; Q47-S51 PolarHBondContact O-N 2.83Å; S51-S53 PolarHBondContact O-N 2.88Å
52	P	65.8	Low	85.9	Confident	65 Å²	65	43 Å²	43	42%	0.422	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-7.4	-179.2	28.5	-34.8	0	0	0	114	S81	P52-S81 VanDerWaalsContact CB-OG 3.22Å; P52-S81 WeakPolarHBondContact CB-OG 3.41Å; P52-S81 WeakPolarHBondContact O-CB 3.35Å; P52-S81 PolarHBondContact O-OG 2.99Å
53	S	69.8	Low	86	Confident	89 Å²	89	40.7 Å²	40.7	62%	0.622	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-20.9	-173.7	60	0	0	0	0	114.9	S51 A55 K84	S51-S53 PolarHBondContact O-N 2.88Å; S53-A55 PolarHBondContact O-N 3.39Å; S53-K84 WeakPolarHBondContact O-CE 3.49Å; S53-K84 PolarHBondContact O-NZ 2.96Å
54	D	79.3	Confident	86.1	Confident	56 Å²	56	40.4 Å²	40.4	30%	0.299	22%	0.218	S	C	.	.			trans	-92	100.6	-178.8	-175.8	-20.2	0	0	0	110.6	S56 K57 V58	D54-S56 PolarHBondContact O-N 3.02Å; D54-S56 WeakPolarHBondContact OD1-CB 3.31Å; D54-S56 PolarHBondContact OD1-N 3.48Å; D54-K57 HydrophobicContact CB-CB 4.16Å; D54-K57 HydrophobicContact CB-CD 4.19Å; D54-K57 HydrophobicContact CB-CG 4.28Å; D54-K57 PolarHBondContact O-N 3.06Å; D54-K57 PolarHBondContact OD1-N 3.32Å; D54-K57 VanDerWaalsContact OD2-CD 3.25Å; D54-K57 WeakPolarHBondContact OD2-CD 3.38Å; D54-K57 WeakPolarHBondContact OD2-CE 3.33Å; D54-K57 VanDerWaalsContact OD2-CG 3.3Å; D54-K57 WeakPolarHBondContact OD2-CG 3.47Å; D54-K57 IonicContact OD2-NZ 2.99Å; D54-V58 WeakPolarHBondContact O-CB 3.47Å; D54-V58 VanDerWaalsContact O-CG2 3.28Å; D54-V58 WeakPolarHBondContact O-CG2 3.23Å; D54-V58 PolarHBondContact O-N 2.93Å
55	A	79.9	Confident	86.1	Confident	11 Å²	11	40.4 Å²	40.4	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-33.9	-177.5	0	0	0	0	0	112.7	S53 Y59 L82 K84	S53-A55 PolarHBondContact O-N 3.39Å; A55-Y59 VanDerWaalsContact O-CB 3.27Å; A55-Y59 WeakPolarHBondContact O-CB 3.4Å; A55-Y59 PolarHBondContact O-N 3Å; A55-L82 HydrophobicContact CB-CD2 4.26Å; A55-K84 HydrophobicContact CB-CD 4.24Å
56	S	86.5	Confident	86.3	Confident	14 Å²	14	41.5 Å²	41.5	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-65.3	-54.3	176.5	-172.7	0	0	0	0	109.4	D54 V58 Y59 H60 Y94 R257	D54-S56 PolarHBondContact O-N 3.02Å; D54-S56 WeakPolarHBondContact OD1-CB 3.31Å; D54-S56 PolarHBondContact OD1-N 3.48Å; S56-V58 VanDerWaalsContact C-N 3.34Å; S56-V58 PolarHBondContact O-N 3.49Å; S56-Y59 PolarHBondContact O-N 3.02Å; S56-H60 PolarHBondContact O-N 2.93Å; S56-H60 PolarHBondContact O-ND1 3.11Å; S56-H60 PolarHBondContact OG-CE1 3.42Å; S56-Y94 PolarHBondContact OG-OH 3.2Å; S56-Y94 VanDerWaalsContact OG-OH 3.08Å; S56-R257 PolarHBondContact OG-NH2 3.05Å
57	K	88.1	Confident	86.5	Confident	95 Å²	95	35.8 Å²	35.8	41%	0.413	20%	0.203	S	C	.	.	H	α-helix	trans	-63.6	-39.4	-178.5	-68.3	178.6	-171.4	173.2	0	112.7	Q47 D54 H60 A61	Q47-K57 HydrophobicContact CG-CB 4.07Å; Q47-K57 VanDerWaalsContact NE2-CB 3.31Å; D54-K57 HydrophobicContact CB-CB 4.16Å; D54-K57 HydrophobicContact CB-CD 4.19Å; D54-K57 HydrophobicContact CB-CG 4.28Å; D54-K57 PolarHBondContact O-N 3.06Å; D54-K57 PolarHBondContact OD1-N 3.32Å; D54-K57 VanDerWaalsContact OD2-CD 3.25Å; D54-K57 WeakPolarHBondContact OD2-CD 3.38Å; D54-K57 WeakPolarHBondContact OD2-CE 3.33Å; D54-K57 VanDerWaalsContact OD2-CG 3.3Å; D54-K57 WeakPolarHBondContact OD2-CG 3.47Å; D54-K57 IonicContact OD2-NZ 2.99Å; K57-H60 PolarHBondContact O-N 3.37Å; K57-A61 PolarHBondContact O-N 2.59Å
58	V	88.8	Confident	86.8	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-47.1	175.9	172.3	0	0	0	0	110.5	D54 S56 H60 A61 I62 L82	D54-V58 WeakPolarHBondContact O-CB 3.47Å; D54-V58 VanDerWaalsContact O-CG2 3.28Å; D54-V58 WeakPolarHBondContact O-CG2 3.23Å; D54-V58 PolarHBondContact O-N 2.93Å; S56-V58 VanDerWaalsContact C-N 3.34Å; S56-V58 PolarHBondContact O-N 3.49Å; V58-H60 PolarHBondContact O-N 3.14Å; V58-A61 PolarHBondContact O-N 3.22Å; V58-I62 HydrophobicContact CG1-CD1 3.71Å; V58-I62 WeakPolarHBondContact O-CD1 3.34Å; V58-I62 VanDerWaalsContact O-CG1 3.32Å; V58-I62 WeakPolarHBondContact O-CG1 3.48Å; V58-I62 PolarHBondContact O-N 3.35Å; V58-L82 HydrophobicContact CB-CD2 4.47Å; V58-L82 HydrophobicContact CG1-CD2 4.15Å; V58-L82 HydrophobicContact CG1-CG 4.21Å
59	Y	91.5	Very high	87.2	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-56.7	-47.3	174.5	162.9	-102.4	0	0	0	112.2	A55 S56 A61 I62 L63 F93 Y94 A97 L101	A55-Y59 VanDerWaalsContact O-CB 3.27Å; A55-Y59 WeakPolarHBondContact O-CB 3.4Å; A55-Y59 PolarHBondContact O-N 3Å; S56-Y59 PolarHBondContact O-N 3.02Å; Y59-A61 VanDerWaalsContact C-N 3.33Å; Y59-A61 PolarHBondContact O-N 3.14Å; Y59-I62 WeakPolarHBondContact O-CB 3.3Å; Y59-I62 PolarHBondContact O-N 2.82Å; Y59-L63 HydrophobicContact CE1-CD2 4.35Å; Y59-L63 HydrophobicContact CE2-CB 4.48Å; Y59-L63 WeakPolarHBondContact O-CB 3.39Å; Y59-L63 PolarHBondContact O-N 3.26Å; Y59-F93 AromaticContact CE1-CE1 3.71Å; Y59-F93 HydrophobicContact CE1-CE1 3.71Å; Y59-F93 HydrophobicContact CE1-CZ 4.25Å; Y59-F93 HydrophobicContact CE2-CE1 4.49Å; Y59-F93 AromaticContact CZ-CE1 3.68Å; Y59-F93 AromaticContact CZ-CZ 3.79Å; Y59-F93 VanDerWaalsContact OH-CZ 3.23Å; Y59-F93 WeakPolarHBondContact OH-CZ 3.34Å; Y59-Y94 AromaticContact CD1-CD1 3.25Å; Y59-Y94 HydrophobicContact CD1-CD1 3.25Å; Y59-Y94 AromaticContact CD1-CE1 3.5Å; Y59-Y94 HydrophobicContact CD1-CE1 3.5Å; Y59-Y94 HydrophobicContact CD1-CG 4.33Å; Y59-Y94 HydrophobicContact CD2-CD1 4.32Å; Y59-Y94 AromaticContact CE1-CD1 3.88Å; Y59-Y94 HydrophobicContact CE1-CD1 3.88Å; Y59-Y94 AromaticContact CE1-CE1 3.96Å; Y59-Y94 HydrophobicContact CE1-CE1 3.96Å; Y59-Y94 AromaticContact CG-CD1 3.5Å; Y59-Y94 HydrophobicContact CG-CD1 3.5Å; Y59-Y94 HydrophobicContact CG-CE1 4.22Å; Y59-Y94 HydrophobicContact CG-CG 4.23Å; Y59-A97 HydrophobicContact CD2-CB 4.08Å; Y59-A97 HydrophobicContact CE2-CB 3.44Å; Y59-A97 VanDerWaalsContact CE2-CB 3.44Å; Y59-L101 HydrophobicContact CE2-CD1 4.15Å
60	H	94.4	Very high	87.6	Confident	3 Å²	3	37 Å²	37	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-39	-179.8	-70.4	89.5	0	0	0	111.7	S56 K57 V58 L63 G64 V256 A260 Y261	S56-H60 PolarHBondContact O-N 2.93Å; S56-H60 PolarHBondContact O-ND1 3.11Å; S56-H60 PolarHBondContact OG-CE1 3.42Å; K57-H60 PolarHBondContact O-N 3.37Å; V58-H60 PolarHBondContact O-N 3.14Å; H60-L63 PolarHBondContact O-N 3.05Å; H60-G64 PolarHBondContact O-N 2.97Å; H60-V256 HydrophobicContact CB-CG1 4.04Å; H60-A260 HydrophobicContact CB-CB 3.98Å; H60-A260 WeakPolarHBondContact O-CB 3.42Å; H60-Y261 AromaticContact CD2-CD2 3.88Å; H60-Y261 AromaticContact CD2-CE2 3.59Å; H60-Y261 AromaticContact NE2-CE2 3.54Å
61	A	94.1	Very high	88	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-43.6	174	0	0	0	0	0	112	F44 Q47 I48 K57 V58 Y59 G64 I65 V256	F44-A61 HydrophobicContact CB-CB 4.13Å; F44-A61 HydrophobicContact CD1-CB 4.43Å; Q47-A61 HydrophobicContact CB-CB 4.14Å; Q47-A61 HydrophobicContact CG-CB 4.13Å; I48-A61 HydrophobicContact CD1-CB 4.17Å; I48-A61 HydrophobicContact CG1-CB 3.82Å; K57-A61 PolarHBondContact O-N 2.59Å; V58-A61 PolarHBondContact O-N 3.22Å; Y59-A61 VanDerWaalsContact C-N 3.33Å; Y59-A61 PolarHBondContact O-N 3.14Å; A61-G64 PolarHBondContact O-N 3.46Å; A61-I65 WeakPolarHBondContact O-CG1 3.37Å; A61-I65 PolarHBondContact O-N 2.86Å; A61-V256 HydrophobicContact CB-CG1 4.2Å
62	I	93.6	Very high	88.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-46.8	175.4	-69	158.4	0	0	0	111.2	V58 Y59 G64 I65 H66 V72 L82 L101 I102	V58-I62 HydrophobicContact CG1-CD1 3.71Å; V58-I62 WeakPolarHBondContact O-CD1 3.34Å; V58-I62 VanDerWaalsContact O-CG1 3.32Å; V58-I62 WeakPolarHBondContact O-CG1 3.48Å; V58-I62 PolarHBondContact O-N 3.35Å; Y59-I62 WeakPolarHBondContact O-CB 3.3Å; Y59-I62 PolarHBondContact O-N 2.82Å; I62-G64 VanDerWaalsContact C-N 3.27Å; I62-G64 PolarHBondContact O-N 3.22Å; I62-I65 PolarHBondContact O-N 2.76Å; I62-H66 VanDerWaalsContact O-CB 3.29Å; I62-H66 WeakPolarHBondContact O-CB 3.24Å; I62-H66 PolarHBondContact O-N 2.79Å; I62-V72 HydrophobicContact CG1-CG1 4.25Å; I62-V72 HydrophobicContact CG1-CG2 4.4Å; I62-V72 HydrophobicContact CG2-CG2 4.1Å; I62-L82 HydrophobicContact CD1-CD1 3.74Å; I62-L101 HydrophobicContact CG2-CB 3.66Å; I62-L101 HydrophobicContact CG2-CD1 4.29Å; I62-I102 HydrophobicContact CD1-CD1 3.66Å; I62-I102 HydrophobicContact CD1-CG1 3.91Å; I62-I102 HydrophobicContact CG1-CD1 4.46Å; I62-I102 HydrophobicContact CG1-CG1 4.23Å; I62-I102 HydrophobicContact CG2-CG1 4Å
63	L	95.6	Very high	89.7	Confident	12 Å²	12	40 Å²	40	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-56.1	-44.6	175.9	174.2	65.6	0	0	0	111	Y59 H60 S67 L101 A260 Y261 A264	Y59-L63 HydrophobicContact CE1-CD2 4.35Å; Y59-L63 HydrophobicContact CE2-CB 4.48Å; Y59-L63 WeakPolarHBondContact O-CB 3.39Å; Y59-L63 PolarHBondContact O-N 3.26Å; H60-L63 PolarHBondContact O-N 3.05Å; L63-S67 VanDerWaalsContact O-CB 3.27Å; L63-S67 WeakPolarHBondContact O-CB 2.83Å; L63-S67 PolarHBondContact O-N 2.83Å; L63-S67 PolarHBondContact O-OG 2.93Å; L63-L101 HydrophobicContact CB-CD1 4.45Å; L63-L101 HydrophobicContact CD1-CD1 4.26Å; L63-A260 HydrophobicContact CD2-CB 4.34Å; L63-Y261 HydrophobicContact CD2-CD2 4.2Å; L63-Y261 HydrophobicContact CD2-CE1 4.37Å; L63-Y261 HydrophobicContact CD2-CE2 3.96Å; L63-A264 HydrophobicContact CD1-CB 4.47Å; L63-A264 HydrophobicContact CG-CB 4.49Å
64	G	96.4	Very high	90.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-52.4	177.1	0	0	0	0	0	112.8	H60 A61 I62 H66 S67 L68	H60-G64 PolarHBondContact O-N 2.97Å; A61-G64 PolarHBondContact O-N 3.46Å; I62-G64 VanDerWaalsContact C-N 3.27Å; I62-G64 PolarHBondContact O-N 3.22Å; G64-H66 PolarHBondContact O-N 2.85Å; G64-S67 PolarHBondContact O-N 2.92Å; G64-L68 WeakPolarHBondContact O-CG 3.49Å; G64-L68 PolarHBondContact O-N 2.89Å
65	I	95.6	Very high	90.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-44.4	179.4	-66.9	166.4	0	0	0	111.2	F44 I48 A61 I62 S67 L68 S69 E70 V72	F44-I65 HydrophobicContact CB-CD1 3.85Å; F44-I65 HydrophobicContact CB-CG1 3.6Å; F44-I65 HydrophobicContact CD2-CG1 4.09Å; F44-I65 HydrophobicContact CG-CG1 4.22Å; I48-I65 HydrophobicContact CD1-CD1 3.45Å; I48-I65 VanDerWaalsContact CD1-CD1 3.45Å; A61-I65 WeakPolarHBondContact O-CG1 3.37Å; A61-I65 PolarHBondContact O-N 2.86Å; I62-I65 PolarHBondContact O-N 2.76Å; I65-S67 VanDerWaalsContact C-N 3.32Å; I65-S67 PolarHBondContact O-N 2.88Å; I65-L68 WeakPolarHBondContact O-CB 3.45Å; I65-L68 PolarHBondContact O-N 2.82Å; I65-S69 PolarHBondContact O-N 3.31Å; I65-E70 HydrophobicContact CG2-CB 3.96Å; I65-E70 PolarHBondContact O-N 2.82Å; I65-E70 VanDerWaalsContact O-N 3.13Å; I65-V72 HydrophobicContact CG2-CG2 4.25Å
66	H	94.7	Very high	90.7	Very high	89 Å²	89	43.7 Å²	43.7	41%	0.412	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-41.9	176.1	-176.9	88.6	0	0	0	111.6	I62 G64 L68 S69 L101	I62-H66 VanDerWaalsContact O-CB 3.29Å; I62-H66 WeakPolarHBondContact O-CB 3.24Å; I62-H66 PolarHBondContact O-N 2.79Å; G64-H66 PolarHBondContact O-N 2.85Å; H66-L68 VanDerWaalsContact C-N 3.27Å; H66-L68 PolarHBondContact O-N 2.83Å; H66-S69 WeakPolarHBondContact O-CA 3.32Å; H66-S69 PolarHBondContact O-N 2.93Å; H66-L101 HydrophobicContact CB-CB 4.41Å; H66-L101 HydrophobicContact CB-CD2 4.21Å; H66-L101 VanDerWaalsContact CD2-CD2 3.44Å; H66-L101 WeakPolarHBondContact CD2-CD2 3.26Å
67	S	95.9	Very high	90.5	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-67.3	-28.2	178	-58.7	0	0	0	0	112.4	L63 G64 I65 S69 K267	L63-S67 VanDerWaalsContact O-CB 3.27Å; L63-S67 WeakPolarHBondContact O-CB 2.83Å; L63-S67 PolarHBondContact O-N 2.83Å; L63-S67 PolarHBondContact O-OG 2.93Å; G64-S67 PolarHBondContact O-N 2.92Å; I65-S67 VanDerWaalsContact C-N 3.32Å; I65-S67 PolarHBondContact O-N 2.88Å; S67-S69 PolarHBondContact O-N 3.34Å; S67-K267 WeakPolarHBondContact O-CD 3.25Å; S67-K267 WeakPolarHBondContact O-CE 3.45Å; S67-K267 WeakPolarHBondContact O-CG 3.47Å
68	L	95.2	Very high	90.2	Very high	14 Å²	14	41.1 Å²	41.1	7%	0.073	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-4.2	168	-68.7	171.8	0	0	0	113.3	K37 F40 R41 F44 G64 I65 H66 E70 V263 W315	K37-L68 HydrophobicContact CB-CD2 4.09Å; K37-L68 HydrophobicContact CG-CD2 3.95Å; F40-L68 HydrophobicContact CB-CD1 4.07Å; R41-L68 HydrophobicContact CB-CD1 4.15Å; F44-L68 HydrophobicContact CD2-CD1 4.07Å; F44-L68 HydrophobicContact CE2-CD1 4.03Å; G64-L68 WeakPolarHBondContact O-CG 3.49Å; G64-L68 PolarHBondContact O-N 2.89Å; I65-L68 WeakPolarHBondContact O-CB 3.45Å; I65-L68 PolarHBondContact O-N 2.82Å; H66-L68 VanDerWaalsContact C-N 3.27Å; H66-L68 PolarHBondContact O-N 2.83Å; L68-E70 VanDerWaalsContact C-N 3.25Å; L68-E70 HydrophobicContact CB-CG 4.17Å; L68-E70 PolarHBondContact O-N 2.84Å; L68-V263 HydrophobicContact CD2-CG1 3.77Å; L68-V263 HydrophobicContact CG-CG1 3.79Å; L68-W315 HydrophobicContact CD2-CH2 4.11Å; L68-W315 HydrophobicContact CD2-CZ2 4.18Å
69	S	92.5	Very high	89.9	Confident	83 Å²	83	41.1 Å²	41.1	58%	0.58	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	31.4	-173.6	-47.6	0	0	0	0	113.1	I65 H66 S67 K267	I65-S69 PolarHBondContact O-N 3.31Å; H66-S69 WeakPolarHBondContact O-CA 3.32Å; H66-S69 PolarHBondContact O-N 2.93Å; S67-S69 PolarHBondContact O-N 3.34Å; S69-K267 WeakPolarHBondContact OG-CE 3.4Å
70	E	91.2	Very high	89.5	Confident	62 Å²	62	46.9 Å²	46.9	29%	0.29	25%	0.248	S	C	.	.			trans	-108.5	163.4	178	-65.1	-170.3	162.4	0	0	111.6	R41 I65 L68	R41-E70 WeakPolarHBondContact CD-OE2 3.34Å; R41-E70 WeakPolarHBondContact CG-OE2 3.12Å; R41-E70 IonicContact CZ-OE1 2.71Å; R41-E70 IonicContact CZ-OE2 2.63Å; R41-E70 VanDerWaalsContact CZ-OE2 3.23Å; R41-E70 IonicContact NE-OE2 2.58Å; R41-E70 PolarHBondContact NE-OE2 3.37Å; R41-E70 IonicContact NH1-OE1 2.67Å; R41-E70 PolarHBondContact NH1-OE1 2.93Å; R41-E70 IonicContact NH1-OE2 2.9Å; R41-E70 PolarHBondContact NH1-OE2 3.46Å; R41-E70 VanDerWaalsContact NH1-OE2 3.13Å; I65-E70 HydrophobicContact CG2-CB 3.96Å; I65-E70 PolarHBondContact O-N 2.82Å; I65-E70 VanDerWaalsContact O-N 3.13Å; L68-E70 VanDerWaalsContact C-N 3.25Å; L68-E70 HydrophobicContact CB-CG 4.17Å; L68-E70 PolarHBondContact O-N 2.84Å
71	R	88.2	Confident	88.9	Confident	237 Å²	237	47.7 Å²	47.7	89%	0.894	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-86.7	136.7	176.4	-67.3	-173.9	-179.2	-175.4	0.8	110.5
72	V	88.1	Confident	88.3	Confident	16 Å²	16	47.8 Å²	47.8	10%	0.097	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-62.8	126.6	175.7	-177.8	0	0	0	0	110	I48 I62 I65 A78 I102	I48-V72 HydrophobicContact CD1-CG1 4.03Å; I62-V72 HydrophobicContact CG1-CG1 4.25Å; I62-V72 HydrophobicContact CG1-CG2 4.4Å; I62-V72 HydrophobicContact CG2-CG2 4.1Å; I65-V72 HydrophobicContact CG2-CG2 4.25Å; V72-A78 HydrophobicContact CG1-CB 4.03Å; V72-I102 HydrophobicContact CG2-CG1 4.39Å
73	P	84.9	Confident	87.7	Confident	43 Å²	43	52.4 Å²	52.4	28%	0.279	28%	0.279	S	S	.	.	S	Bend	trans	-64.2	139.1	174.1	-7.6	17	0	0	0	110.6	E45	E45-P73 HydrophobicContact CG-CG 3.89Å
74	N	82.9	Confident	86.9	Confident	126 Å²	126	55.7 Å²	55.7	67%	0.674	29%	0.293	S	S	*	.	S	Bend	trans	46.1	61.7	179.6	-63.5	-26.4	0	0	0	112.6	D76 A77 A78	N74-D76 PolarHBondContact O-N 2.88Å; N74-A77 HydrophobicContact CB-CB 4.08Å; N74-A77 PolarHBondContact O-N 3.09Å; N74-A78 PolarHBondContact O-N 2.92Å; N74-A78 VanDerWaalsContact O-N 3.11Å
75	P	83.7	Confident	86.2	Confident	52 Å²	52	60.4 Å²	60.4	34%	0.338	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-31.9	-170.2	24	-35.1	0	0	0	112.9	C79 I102	P75-C79 WeakPolarHBondContact O-CB 3.47Å; P75-C79 PolarHBondContact O-N 3.32Å; P75-I102 HydrophobicContact CB-CG2 3.46Å; P75-I102 VanDerWaalsContact CB-CG2 3.46Å
76	D	83.3	Confident	85.7	Confident	55 Å²	55	61.3 Å²	61.3	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-68.6	-40	176.8	-67.7	-16	0	0	0	112.8	N74 C79 L80 S104 K106	N74-D76 PolarHBondContact O-N 2.88Å; D76-C79 WeakPolarHBondContact O-CB 3.3Å; D76-C79 PolarHBondContact O-N 3.2Å; D76-L80 VanDerWaalsContact O-CG 3.3Å; D76-L80 WeakPolarHBondContact O-CG 3.38Å; D76-L80 PolarHBondContact O-N 3.18Å; D76-S104 PolarHBondContact OD1-OG 3.32Å; D76-K106 HydrophobicContact CB-CD 4.28Å; D76-K106 WeakPolarHBondContact OD2-CD 3.47Å; D76-K106 VanDerWaalsContact OD2-CE 3.29Å; D76-K106 WeakPolarHBondContact OD2-CE 3.17Å; D76-K106 IonicContact OD2-NZ 2.69Å; D76-K106 PolarHBondContact OD2-NZ 3.43Å
77	A	81.3	Confident	85.3	Confident	53 Å²	53	61.6 Å²	61.6	44%	0.438	34%	0.336	S	S	.	.	H	α-helix	trans	-69.7	-45.5	177.8	0	0	0	0	0	111	N74 C79 L80 S81	N74-A77 HydrophobicContact CB-CB 4.08Å; N74-A77 PolarHBondContact O-N 3.09Å; A77-C79 PolarHBondContact O-N 3.02Å; A77-L80 PolarHBondContact O-N 2.78Å; A77-S81 PolarHBondContact O-N 2.85Å; A77-S81 PolarHBondContact O-OG 3.41Å
78	A	82.7	Confident	85	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.017	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-33.8	174.7	0	0	0	0	0	112.1	I48 V72 N74 S81 I102	I48-A78 HydrophobicContact CG2-CB 4.48Å; V72-A78 HydrophobicContact CG1-CB 4.03Å; N74-A78 PolarHBondContact O-N 2.92Å; N74-A78 VanDerWaalsContact O-N 3.11Å; A78-S81 WeakPolarHBondContact O-CB 2.94Å; A78-I102 HydrophobicContact CB-CD1 4.24Å
79	C	83	Confident	84.9	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.02	35%	0.345	C	S	.	.	H	α-helix	trans	-66.1	-46.2	173.4	161.3	0	0	0	0	112.3	P75 D76 A77 S81 L82 N83 I102 C107	P75-C79 WeakPolarHBondContact O-CB 3.47Å; P75-C79 PolarHBondContact O-N 3.32Å; D76-C79 WeakPolarHBondContact O-CB 3.3Å; D76-C79 PolarHBondContact O-N 3.2Å; A77-C79 PolarHBondContact O-N 3.02Å; C79-S81 PolarHBondContact O-N 3.41Å; C79-L82 PolarHBondContact O-N 3.3Å; C79-N83 PolarHBondContact O-N 2.87Å; C79-I102 HydrophobicContact CB-CD1 4.18Å; C79-C107 WeakPolarHBondContact CA-SG 3.49Å; C79-C107 HydrophobicContact CB-CB 4.24Å; C79-C107 WeakPolarHBondContact CB-SG 3.45Å; C79-C107 WeakPolarHBondContact SG-CA 3.47Å; C79-C107 WeakPolarHBondContact SG-CB 3.44Å; C79-C107 PolarHBondContact SG-N 2.86Å; C79-C107 VanDerWaalsContact SG-N 3.38Å; C79-C107 CovalentContact SG-SG 2Å; C79-C107 PolarHBondContact SG-SG 2.89Å
80	L	82.2	Confident	84.9	Confident	125 Å²	125	62.8 Å²	62.8	65%	0.654	33%	0.333	S	S	*	.	H	α-helix	trans	-59.5	-35.9	178.1	-73.1	168.6	0	0	0	112.2	D76 A77 L82 N83	D76-L80 VanDerWaalsContact O-CG 3.3Å; D76-L80 WeakPolarHBondContact O-CG 3.38Å; D76-L80 PolarHBondContact O-N 3.18Å; A77-L80 PolarHBondContact O-N 2.78Å; L80-L82 PolarHBondContact O-N 3.42Å; L80-N83 WeakPolarHBondContact O-CB 3.27Å; L80-N83 PolarHBondContact O-N 3.11Å; L80-N83 VanDerWaalsContact O-N 3.1Å
81	S	81.3	Confident	84.8	Confident	19 Å²	19	62.4 Å²	62.4	13%	0.133	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-29.6	173.2	-70	0	0	0	0	114.7	P52 A77 A78 C79	P52-S81 VanDerWaalsContact CB-OG 3.22Å; P52-S81 WeakPolarHBondContact CB-OG 3.41Å; P52-S81 WeakPolarHBondContact O-CB 3.35Å; P52-S81 PolarHBondContact O-OG 2.99Å; A77-S81 PolarHBondContact O-N 2.85Å; A77-S81 PolarHBondContact O-OG 3.41Å; A78-S81 WeakPolarHBondContact O-CB 2.94Å; C79-S81 PolarHBondContact O-N 3.41Å
82	L	82.9	Confident	84.9	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-90.1	-10.1	177.8	-65.1	174.3	0	0	0	112.5	A55 V58 I62 C79 L80 K84 V95 I102	A55-L82 HydrophobicContact CB-CD2 4.26Å; V58-L82 HydrophobicContact CB-CD2 4.47Å; V58-L82 HydrophobicContact CG1-CD2 4.15Å; V58-L82 HydrophobicContact CG1-CG 4.21Å; I62-L82 HydrophobicContact CD1-CD1 3.74Å; C79-L82 PolarHBondContact O-N 3.3Å; L80-L82 PolarHBondContact O-N 3.42Å; L82-K84 PolarHBondContact O-N 2.66Å; L82-V95 WeakPolarHBondContact O-CG2 3.2Å; L82-I102 HydrophobicContact CD1-CD1 3.93Å
83	N	79.9	Confident	85.2	Confident	98 Å²	98	50.5 Å²	50.5	52%	0.524	29%	0.285	S	S	.	.			trans	-78.9	64.3	-177	-162.5	25.5	0	0	0	111.5	C79 L80	C79-N83 PolarHBondContact O-N 2.87Å; L80-N83 WeakPolarHBondContact O-CB 3.27Å; L80-N83 PolarHBondContact O-N 3.11Å; L80-N83 VanDerWaalsContact O-N 3.1Å
84	K	78.4	Confident	85.5	Confident	81 Å²	81	49 Å²	49	35%	0.352	27%	0.274	S	S	.	.			trans	-104.9	149.4	177	-65	-166.7	-179.1	-170.5	0	110.4	S53 A55 L82 I86	S53-K84 WeakPolarHBondContact O-CE 3.49Å; S53-K84 PolarHBondContact O-NZ 2.96Å; A55-K84 HydrophobicContact CB-CD 4.24Å; L82-K84 PolarHBondContact O-N 2.66Å; K84-I86 PolarHBondContact O-N 2.97Å
85	P	82	Confident	85.7	Confident	98 Å²	98	43.4 Å²	43.4	64%	0.636	24%	0.244	S	C	*	.			trans	-58.7	136.9	173.4	25.1	-33.5	0	0	0	110.1	T87	P85-T87 PolarHBondContact O-N 3.19Å
86	I	85.3	Confident	86.1	Confident	20 Å²	20	40.9 Å²	40.9	10%	0.103	23%	0.228	C	C	.	.			trans	-83.7	100.6	-177.3	-60.7	178.1	0	0	0	108.5	K84 A92 V109 P110 V114 L117	K84-I86 PolarHBondContact O-N 2.97Å; I86-A92 HydrophobicContact CG2-CB 3.59Å; I86-V109 HydrophobicContact CD1-CG1 4.46Å; I86-P110 HydrophobicContact CD1-CB 4.43Å; I86-P110 HydrophobicContact CD1-CG 4.33Å; I86-V114 HydrophobicContact CD1-CG2 3.55Å; I86-L117 HydrophobicContact CG2-CD2 4.22Å
87	T	86	Confident	86.4	Confident	96 Å²	96	38.3 Å²	38.3	59%	0.589	21%	0.214	S	C	*	.			trans	-98.3	-24.8	-179.9	68.7	0	0	0	0	113.3	P85 E91	P85-T87 PolarHBondContact O-N 3.19Å; T87-E91 WeakPolarHBondContact CB-OE2 3.3Å; T87-E91 PolarHBondContact N-OE2 2.96Å; T87-E91 PolarHBondContact OG1-OE2 3.36Å
88	N	90.1	Very high	86.8	Confident	53 Å²	53	35.8 Å²	35.8	28%	0.283	19%	0.193	S	C	.	.	S	Bend	trans	-147.5	166.8	-173.6	64.7	62.9	0	0	0	112.1	E90 E91 A92	N88-E90 VanDerWaalsContact C-N 3.32Å; N88-E90 PolarHBondContact O-N 3.49Å; N88-E90 WeakPolarHBondContact OD1-CB 3.47Å; N88-E90 PolarHBondContact OD1-N 3.18Å; N88-E91 PolarHBondContact ND2-OE2 2.89Å; N88-E91 PolarHBondContact O-N 2.91Å; N88-E91 PolarHBondContact OD1-N 3.49Å; N88-A92 PolarHBondContact O-N 3.29Å; N88-A92 VanDerWaalsContact O-N 3.08Å
89	P	92.3	Very high	87	Confident	7 Å²	7	38.1 Å²	38.1	5%	0.045	20%	0.204	C	C	.	.	H	α-helix	trans	-55.5	-39.7	179.2	-33.2	40.2	0	0	0	115.3	A92 F93 L117 L121 N130 Y133 L134	P89-A92 WeakPolarHBondContact O-CB 3.28Å; P89-A92 PolarHBondContact O-N 3.28Å; P89-F93 PolarHBondContact O-N 3.33Å; P89-L117 HydrophobicContact CG-CD2 4.41Å; P89-L121 HydrophobicContact CG-CD1 3.65Å; P89-N130 HydrophobicContact CB-CB 4.17Å; P89-N130 HydrophobicContact CG-CB 4.09Å; P89-Y133 WeakPolarHBondContact O-CB 3.35Å; P89-L134 HydrophobicContact CB-CD2 3.91Å; P89-L134 HydrophobicContact CB-CG 3.87Å; P89-L134 HydrophobicContact CG-CD1 4.28Å; P89-L134 HydrophobicContact CG-CD2 4Å; P89-L134 HydrophobicContact CG-CG 4Å
90	E	92.6	Very high	87.2	Confident	71 Å²	71	43.6 Å²	43.6	33%	0.332	23%	0.227	S	C	.	.	H	α-helix	trans	-66.1	-44.4	-177	179.1	176.3	-169.6	0	0	111.3	N88 F93 Y94 Y133	N88-E90 VanDerWaalsContact C-N 3.32Å; N88-E90 PolarHBondContact O-N 3.49Å; N88-E90 WeakPolarHBondContact OD1-CB 3.47Å; N88-E90 PolarHBondContact OD1-N 3.18Å; E90-F93 WeakPolarHBondContact O-CB 3.34Å; E90-F93 PolarHBondContact O-N 3.25Å; E90-Y94 HydrophobicContact CG-CD2 3.95Å; E90-Y94 HydrophobicContact CG-CE1 4.5Å; E90-Y94 HydrophobicContact CG-CE2 3.26Å; E90-Y94 WeakPolarHBondContact O-CD2 3.35Å; E90-Y94 PolarHBondContact O-N 2.86Å; E90-Y94 VanDerWaalsContact OE1-CE2 3.23Å; E90-Y94 WeakPolarHBondContact OE1-CE2 3.32Å; E90-Y94 VanDerWaalsContact OE1-CZ 3.23Å; E90-Y94 PolarHBondContact OE1-OH 3.05Å; E90-Y133 HydrophobicContact CB-CD2 3.76Å; E90-Y133 HydrophobicContact CB-CE2 3.71Å; E90-Y133 HydrophobicContact CB-CG 4.47Å; E90-Y133 HydrophobicContact CG-CD2 4.33Å; E90-Y133 HydrophobicContact CG-CE2 3.87Å
91	E	89.9	Confident	87.6	Confident	53 Å²	53	38.7 Å²	38.7	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-45.7	172.8	-72.6	176.4	165.7	0	0	111.2	T87 N88 F93 Y94 V95	T87-E91 WeakPolarHBondContact CB-OE2 3.3Å; T87-E91 PolarHBondContact N-OE2 2.96Å; T87-E91 PolarHBondContact OG1-OE2 3.36Å; N88-E91 PolarHBondContact ND2-OE2 2.89Å; N88-E91 PolarHBondContact O-N 2.91Å; N88-E91 PolarHBondContact OD1-N 3.49Å; E91-F93 PolarHBondContact O-N 3.12Å; E91-Y94 PolarHBondContact O-N 2.95Å; E91-V95 VanDerWaalsContact O-CG2 3.27Å; E91-V95 WeakPolarHBondContact O-CG2 3.32Å; E91-V95 PolarHBondContact O-N 3.45Å
92	A	91.1	Very high	87.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-53.1	-41.4	175.8	0	0	0	0	0	111.4	I86 N88 P89 S96 V114 L117 S137	I86-A92 HydrophobicContact CG2-CB 3.59Å; N88-A92 PolarHBondContact O-N 3.29Å; N88-A92 VanDerWaalsContact O-N 3.08Å; P89-A92 WeakPolarHBondContact O-CB 3.28Å; P89-A92 PolarHBondContact O-N 3.28Å; A92-S96 WeakPolarHBondContact O-CB 3.43Å; A92-S96 PolarHBondContact O-N 2.94Å; A92-S96 PolarHBondContact O-OG 3.35Å; A92-V114 HydrophobicContact CB-CG2 4.12Å; A92-L117 HydrophobicContact CB-CD2 4.25Å; A92-S137 VanDerWaalsContact C-OG 3.22Å; A92-S137 PolarHBondContact O-OG 3.02Å
93	F	93.4	Very high	87.7	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-67.5	-51.2	178.3	172.4	-108.6	0	0	0	112.6	Y59 P89 E90 E91 V95 S96 A97 F132 Y133 S136 S137 Y140	Y59-F93 AromaticContact CE1-CE1 3.71Å; Y59-F93 HydrophobicContact CE1-CE1 3.71Å; Y59-F93 HydrophobicContact CE1-CZ 4.25Å; Y59-F93 HydrophobicContact CE2-CE1 4.49Å; Y59-F93 AromaticContact CZ-CE1 3.68Å; Y59-F93 AromaticContact CZ-CZ 3.79Å; Y59-F93 VanDerWaalsContact OH-CZ 3.23Å; Y59-F93 WeakPolarHBondContact OH-CZ 3.34Å; P89-F93 PolarHBondContact O-N 3.33Å; E90-F93 WeakPolarHBondContact O-CB 3.34Å; E90-F93 PolarHBondContact O-N 3.25Å; E91-F93 PolarHBondContact O-N 3.12Å; F93-V95 VanDerWaalsContact C-N 3.31Å; F93-V95 PolarHBondContact O-N 2.83Å; F93-S96 PolarHBondContact O-N 2.87Å; F93-S96 PolarHBondContact O-OG 2.94Å; F93-A97 HydrophobicContact CD2-CB 4.38Å; F93-A97 HydrophobicContact CE2-CB 4.21Å; F93-A97 WeakPolarHBondContact O-CB 3.34Å; F93-A97 PolarHBondContact O-N 2.93Å; F93-F132 HydrophobicContact CE1-CE1 4.26Å; F93-F132 HydrophobicContact CE2-CE1 4.25Å; F93-F132 HydrophobicContact CE2-CZ 4.15Å; F93-F132 AromaticContact CZ-CE1 3.92Å; F93-F132 HydrophobicContact CZ-CE1 3.92Å; F93-F132 AromaticContact CZ-CZ 3.94Å; F93-F132 HydrophobicContact CZ-CZ 3.94Å; F93-Y133 HydrophobicContact CB-CD1 3.81Å; F93-Y133 HydrophobicContact CB-CG 4.06Å; F93-Y133 AromaticContact CD1-CD1 3.43Å; F93-Y133 HydrophobicContact CD1-CD1 3.43Å; F93-Y133 VanDerWaalsContact CD1-CD1 3.43Å; F93-Y133 AromaticContact CD1-CE1 3.74Å; F93-Y133 HydrophobicContact CD1-CE1 3.74Å; F93-Y133 HydrophobicContact CD1-CG 4.45Å; F93-Y133 HydrophobicContact CD2-CD1 4.33Å; F93-Y133 HydrophobicContact CE1-CD1 4.03Å; F93-Y133 HydrophobicContact CE1-CE1 4.07Å; F93-Y133 AromaticContact CG-CD1 3.6Å; F93-Y133 HydrophobicContact CG-CD1 3.6Å; F93-Y133 HydrophobicContact CG-CE1 4.37Å; F93-Y133 HydrophobicContact CG-CG 4.33Å; F93-S136 VanDerWaalsContact CD2-CB 3.47Å; F93-S136 VanDerWaalsContact CE2-CB 3.42Å; F93-S137 WeakPolarHBondContact CA-OG 3.25Å; F93-S137 PolarHBondContact N-OG 2.76Å; F93-Y140 HydrophobicContact CE2-CE2 4.04Å
94	Y	90.7	Very high	87.6	Confident	11 Å²	11	37.8 Å²	37.8	4%	0.043	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-40.1	-179.5	-63.7	-33.8	0	0	0	112.5	S56 Y59 E90 E91 G98	S56-Y94 PolarHBondContact OG-OH 3.2Å; S56-Y94 VanDerWaalsContact OG-OH 3.08Å; Y59-Y94 AromaticContact CD1-CD1 3.25Å; Y59-Y94 HydrophobicContact CD1-CD1 3.25Å; Y59-Y94 AromaticContact CD1-CE1 3.5Å; Y59-Y94 HydrophobicContact CD1-CE1 3.5Å; Y59-Y94 HydrophobicContact CD1-CG 4.33Å; Y59-Y94 HydrophobicContact CD2-CD1 4.32Å; Y59-Y94 AromaticContact CE1-CD1 3.88Å; Y59-Y94 HydrophobicContact CE1-CD1 3.88Å; Y59-Y94 AromaticContact CE1-CE1 3.96Å; Y59-Y94 HydrophobicContact CE1-CE1 3.96Å; Y59-Y94 AromaticContact CG-CD1 3.5Å; Y59-Y94 HydrophobicContact CG-CD1 3.5Å; Y59-Y94 HydrophobicContact CG-CE1 4.22Å; Y59-Y94 HydrophobicContact CG-CG 4.23Å; E90-Y94 HydrophobicContact CG-CD2 3.95Å; E90-Y94 HydrophobicContact CG-CE1 4.5Å; E90-Y94 HydrophobicContact CG-CE2 3.26Å; E90-Y94 WeakPolarHBondContact O-CD2 3.35Å; E90-Y94 PolarHBondContact O-N 2.86Å; E90-Y94 VanDerWaalsContact OE1-CE2 3.23Å; E90-Y94 WeakPolarHBondContact OE1-CE2 3.32Å; E90-Y94 VanDerWaalsContact OE1-CZ 3.23Å; E90-Y94 PolarHBondContact OE1-OH 3.05Å; E91-Y94 PolarHBondContact O-N 2.95Å; Y94-G98 WeakPolarHBondContact O-CA 3.31Å; Y94-G98 PolarHBondContact O-N 3.14Å
95	V	88.3	Confident	87.3	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-49.7	178.7	179.5	0	0	0	0	111.3	L82 E91 F93 H99 V109	L82-V95 WeakPolarHBondContact O-CG2 3.2Å; E91-V95 VanDerWaalsContact O-CG2 3.27Å; E91-V95 WeakPolarHBondContact O-CG2 3.32Å; E91-V95 PolarHBondContact O-N 3.45Å; F93-V95 VanDerWaalsContact C-N 3.31Å; F93-V95 PolarHBondContact O-N 2.83Å; V95-H99 VanDerWaalsContact O-CB 3.25Å; V95-H99 WeakPolarHBondContact O-CB 3.49Å; V95-H99 PolarHBondContact O-N 3.36Å; V95-V109 HydrophobicContact CG1-CG1 4.09Å; V95-V109 HydrophobicContact CG1-CG2 4.11Å
96	S	90.5	Very high	86.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.2	-45.4	-178.3	58.8	0	0	0	0	112.7	A92 F93 K100 S137	A92-S96 WeakPolarHBondContact O-CB 3.43Å; A92-S96 PolarHBondContact O-N 2.94Å; A92-S96 PolarHBondContact O-OG 3.35Å; F93-S96 PolarHBondContact O-N 2.87Å; F93-S96 PolarHBondContact O-OG 2.94Å; S96-K100 PolarHBondContact O-N 2.67Å; S96-K100 VanDerWaalsContact O-N 3.14Å; S96-S137 VanDerWaalsContact OG-CA 3.29Å; S96-S137 WeakPolarHBondContact OG-CA 3.41Å; S96-S137 WeakPolarHBondContact OG-CB 3.49Å; S96-S137 PolarHBondContact OG-OG 3.13Å
97	A	91.3	Very high	86.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.9	-48	178.1	0	0	0	0	0	110.9	Y59 F93 H99 K100 L101 Y140	Y59-A97 HydrophobicContact CD2-CB 4.08Å; Y59-A97 HydrophobicContact CE2-CB 3.44Å; Y59-A97 VanDerWaalsContact CE2-CB 3.44Å; F93-A97 HydrophobicContact CD2-CB 4.38Å; F93-A97 HydrophobicContact CE2-CB 4.21Å; F93-A97 WeakPolarHBondContact O-CB 3.34Å; F93-A97 PolarHBondContact O-N 2.93Å; A97-H99 PolarHBondContact O-N 3.05Å; A97-K100 PolarHBondContact O-N 3.22Å; A97-L101 WeakPolarHBondContact O-CB 3.17Å; A97-L101 WeakPolarHBondContact O-CG 3.41Å; A97-L101 PolarHBondContact O-N 2.75Å; A97-Y140 HydrophobicContact CB-CD2 3.55Å; A97-Y140 HydrophobicContact CB-CE2 3.31Å; A97-Y140 HydrophobicContact CB-CG 4.34Å
98	G	89.2	Confident	85.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-44.4	178.6	0	0	0	0	0	112.4	Y94 K100 L101 I102	Y94-G98 WeakPolarHBondContact O-CA 3.31Å; Y94-G98 PolarHBondContact O-N 3.14Å; G98-K100 PolarHBondContact O-N 2.92Å; G98-L101 PolarHBondContact O-N 3.44Å; G98-I102 WeakPolarHBondContact O-CB 3.07Å; G98-I102 WeakPolarHBondContact O-CG1 3.48Å; G98-I102 PolarHBondContact O-N 3.4Å
99	H	86	Confident	85.4	Confident	51 Å²	51	43.6 Å²	43.6	24%	0.236	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-48.8	173.8	170.2	-122.5	0	0	0	112.3	V95 A97 L101 I102 G103 C107 V109	V95-H99 VanDerWaalsContact O-CB 3.25Å; V95-H99 WeakPolarHBondContact O-CB 3.49Å; V95-H99 PolarHBondContact O-N 3.36Å; A97-H99 PolarHBondContact O-N 3.05Å; H99-L101 VanDerWaalsContact C-N 3.28Å; H99-L101 PolarHBondContact O-N 2.85Å; H99-I102 PolarHBondContact O-N 2.79Å; H99-G103 PolarHBondContact O-N 3.32Å; H99-C107 HydrophobicContact CB-CB 4.4Å; H99-C107 WeakPolarHBondContact CD2-CB 3.14Å; H99-C107 PolarHBondContact NE2-O 3.16Å; H99-V109 HydrophobicContact CB-CG2 3.44Å; H99-V109 VanDerWaalsContact CB-CG2 3.44Å; H99-V109 VanDerWaalsContact CG-CG2 3.49Å; H99-V109 WeakPolarHBondContact ND1-CG2 3.42Å
100	K	88.6	Confident	84.9	Confident	118 Å²	118	45.1 Å²	45.1	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-59.9	-40.8	180	-175	72.2	175.6	-179.2	0	111.9	S96 A97 G98 Y140	S96-K100 PolarHBondContact O-N 2.67Å; S96-K100 VanDerWaalsContact O-N 3.14Å; A97-K100 PolarHBondContact O-N 3.22Å; G98-K100 PolarHBondContact O-N 2.92Å; K100-Y140 HydrophobicContact CB-CD1 3.76Å; K100-Y140 HydrophobicContact CB-CE1 4.36Å; K100-Y140 HydrophobicContact CB-CG 4.36Å; K100-Y140 HydrophobicContact CG-CD1 3.73Å; K100-Y140 HydrophobicContact CG-CE1 4.24Å
101	L	89.9	Confident	84.6	Confident	22 Å²	22	44.8 Å²	44.8	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-76.4	-34.6	-176.3	-64.4	170.9	0	0	0	112.9	Y59 I62 L63 H66 A97 G98 H99	Y59-L101 HydrophobicContact CE2-CD1 4.15Å; I62-L101 HydrophobicContact CG2-CB 3.66Å; I62-L101 HydrophobicContact CG2-CD1 4.29Å; L63-L101 HydrophobicContact CB-CD1 4.45Å; L63-L101 HydrophobicContact CD1-CD1 4.26Å; H66-L101 HydrophobicContact CB-CB 4.41Å; H66-L101 HydrophobicContact CB-CD2 4.21Å; H66-L101 VanDerWaalsContact CD2-CD2 3.44Å; H66-L101 WeakPolarHBondContact CD2-CD2 3.26Å; A97-L101 WeakPolarHBondContact O-CB 3.17Å; A97-L101 WeakPolarHBondContact O-CG 3.41Å; A97-L101 PolarHBondContact O-N 2.75Å; G98-L101 PolarHBondContact O-N 3.44Å; H99-L101 VanDerWaalsContact C-N 3.28Å; H99-L101 PolarHBondContact O-N 2.85Å
102	I	87.3	Confident	84.5	Confident	23 Å²	23	46.1 Å²	46.1	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-71	-45.1	174.9	-65.3	167	0	0	0	110.7	I62 V72 P75 A78 C79 L82 G98 H99 S104	I62-I102 HydrophobicContact CD1-CD1 3.66Å; I62-I102 HydrophobicContact CD1-CG1 3.91Å; I62-I102 HydrophobicContact CG1-CD1 4.46Å; I62-I102 HydrophobicContact CG1-CG1 4.23Å; I62-I102 HydrophobicContact CG2-CG1 4Å; V72-I102 HydrophobicContact CG2-CG1 4.39Å; P75-I102 HydrophobicContact CB-CG2 3.46Å; P75-I102 VanDerWaalsContact CB-CG2 3.46Å; A78-I102 HydrophobicContact CB-CD1 4.24Å; C79-I102 HydrophobicContact CB-CD1 4.18Å; L82-I102 HydrophobicContact CD1-CD1 3.93Å; G98-I102 WeakPolarHBondContact O-CB 3.07Å; G98-I102 WeakPolarHBondContact O-CG1 3.48Å; G98-I102 PolarHBondContact O-N 3.4Å; H99-I102 PolarHBondContact O-N 2.79Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 3.34Å
103	G	79.5	Confident	84.4	Confident	64 Å²	64	50.2 Å²	50.2	66%	0.66	29%	0.288	S	S	*	.			trans	70.3	19.5	-175.4	0	0	0	0	0	115.1	H99	H99-G103 PolarHBondContact O-N 3.32Å
104	S	77.2	Confident	84.3	Confident	14 Å²	14	50.1 Å²	50.1	10%	0.098	29%	0.287	C	S	.	.			trans	-78.9	131.4	175.6	173.6	0	0	0	0	111.3	D76 I102 K106 C107	D76-S104 PolarHBondContact OD1-OG 3.32Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 3.34Å; S104-K106 PolarHBondContact O-N 3.21Å; S104-K106 PolarHBondContact OG-N 2.74Å; S104-C107 PolarHBondContact O-N 3.21Å
105	A	72.4	Confident	84.4	Confident	104 Å²	104	53.1 Å²	53.1	86%	0.86	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-15.5	176.2	0	0	0	0	0	114.1	C107	A105-C107 VanDerWaalsContact C-N 3.32Å
106	K	73.7	Confident	84.5	Confident	153 Å²	153	59.8 Å²	59.8	67%	0.665	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.3	179.4	-67.5	-170.7	-173.1	160.9	0	113.3	D76 S104	D76-K106 HydrophobicContact CB-CD 4.28Å; D76-K106 WeakPolarHBondContact OD2-CD 3.47Å; D76-K106 VanDerWaalsContact OD2-CE 3.29Å; D76-K106 WeakPolarHBondContact OD2-CE 3.17Å; D76-K106 IonicContact OD2-NZ 2.69Å; D76-K106 PolarHBondContact OD2-NZ 3.43Å; S104-K106 PolarHBondContact O-N 3.21Å; S104-K106 PolarHBondContact OG-N 2.74Å
107	C	75.8	Confident	84.6	Confident	15 Å²	15	60.8 Å²	60.8	10%	0.101	34%	0.335	C	S	.	.			trans	-80.4	122.7	175.6	-102.3	0	0	0	0	110.2	C79 H99 S104 A105	C79-C107 WeakPolarHBondContact CA-SG 3.49Å; C79-C107 HydrophobicContact CB-CB 4.24Å; C79-C107 WeakPolarHBondContact CB-SG 3.45Å; C79-C107 WeakPolarHBondContact SG-CA 3.47Å; C79-C107 WeakPolarHBondContact SG-CB 3.44Å; C79-C107 PolarHBondContact SG-N 2.86Å; C79-C107 VanDerWaalsContact SG-N 3.38Å; C79-C107 CovalentContact SG-SG 2Å; C79-C107 PolarHBondContact SG-SG 2.89Å; H99-C107 HydrophobicContact CB-CB 4.4Å; H99-C107 WeakPolarHBondContact CD2-CB 3.14Å; H99-C107 PolarHBondContact NE2-O 3.16Å; S104-C107 PolarHBondContact O-N 3.21Å; A105-C107 VanDerWaalsContact C-N 3.32Å
108	K	75	Confident	84.5	Confident	177 Å²	177	61 Å²	61	77%	0.77	34%	0.337	S	S	*	.			trans	-109	113.9	167.8	-68.3	-176.3	-177.9	179	0	107.9
109	V	77.9	Confident	84.5	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.127	37%	0.369	C	S	.	.			trans	-86.6	125.4	170.9	-173.6	0	0	0	0	108.2	I86 V95 H99 S111 L141	I86-V109 HydrophobicContact CD1-CG1 4.46Å; V95-V109 HydrophobicContact CG1-CG1 4.09Å; V95-V109 HydrophobicContact CG1-CG2 4.11Å; H99-V109 HydrophobicContact CB-CG2 3.44Å; H99-V109 VanDerWaalsContact CB-CG2 3.44Å; H99-V109 VanDerWaalsContact CG-CG2 3.49Å; H99-V109 WeakPolarHBondContact ND1-CG2 3.42Å; V109-S111 PolarHBondContact O-N 2.75Å; V109-L141 HydrophobicContact CB-CD2 3.84Å; V109-L141 HydrophobicContact CG1-CD1 3.84Å; V109-L141 HydrophobicContact CG1-CD2 3.74Å; V109-L141 HydrophobicContact CG1-CG 4.4Å; V109-L141 HydrophobicContact CG2-CD2 4.24Å
110	P	82.3	Confident	84.7	Confident	38 Å²	38	71.9 Å²	71.9	25%	0.247	39%	0.385	C	S	.	.			trans	-66.2	79.2	174.3	-18.4	31.1	0	0	0	111.6	I86 S112 E113 V114	I86-P110 HydrophobicContact CD1-CB 4.43Å; I86-P110 HydrophobicContact CD1-CG 4.33Å; P110-S112 PolarHBondContact O-N 3.47Å; P110-E113 HydrophobicContact CB-CB 3.97Å; P110-E113 HydrophobicContact CB-CG 3.7Å; P110-E113 PolarHBondContact O-N 3.12Å; P110-V114 PolarHBondContact O-N 3.03Å
111	S	86.3	Confident	84.8	Confident	64 Å²	64	68.8 Å²	68.8	45%	0.448	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-32.6	-177.2	58.6	0	0	0	0	112.8	V109 V114 E115	V109-S111 PolarHBondContact O-N 2.75Å; S111-V114 PolarHBondContact O-N 2.91Å; S111-E115 WeakPolarHBondContact O-CB 3.31Å; S111-E115 PolarHBondContact O-N 2.76Å
112	S	88.4	Confident	84.9	Confident	82 Å²	82	68.9 Å²	68.9	57%	0.573	38%	0.375	S	S	*	.	H	α-helix	trans	-65	-35.9	175	53.2	0	0	0	0	113.1	P110 K116	P110-S112 PolarHBondContact O-N 3.47Å; S112-K116 WeakPolarHBondContact O-CB 3.45Å; S112-K116 PolarHBondContact O-N 2.89Å
113	E	89.7	Confident	84.9	Confident	86 Å²	86	71.2 Å²	71.2	40%	0.402	39%	0.39	S	S	.	.	H	α-helix	trans	-70.1	-42.8	176.7	-64	-178.8	-176.9	0	0	110.9	P110 E115 K116 L117	P110-E113 HydrophobicContact CB-CB 3.97Å; P110-E113 HydrophobicContact CB-CG 3.7Å; P110-E113 PolarHBondContact O-N 3.12Å; E113-E115 VanDerWaalsContact C-N 3.34Å; E113-E115 PolarHBondContact O-N 2.91Å; E113-K116 PolarHBondContact O-N 3.03Å; E113-L117 VanDerWaalsContact O-CB 3.29Å; E113-L117 WeakPolarHBondContact O-CB 3.04Å; E113-L117 PolarHBondContact O-N 3.43Å
114	V	90.9	Very high	85.2	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-41.6	175.2	-178.7	0	0	0	0	110.9	I86 A92 P110 S111 L117 S118 L141 I143	I86-V114 HydrophobicContact CD1-CG2 3.55Å; A92-V114 HydrophobicContact CB-CG2 4.12Å; P110-V114 PolarHBondContact O-N 3.03Å; S111-V114 PolarHBondContact O-N 2.91Å; V114-L117 PolarHBondContact O-N 2.84Å; V114-S118 WeakPolarHBondContact O-CB 3.47Å; V114-S118 PolarHBondContact O-N 2.87Å; V114-S118 PolarHBondContact O-OG 2.84Å; V114-L141 HydrophobicContact CB-CD1 3.92Å; V114-L141 HydrophobicContact CG1-CD1 4.08Å; V114-L141 HydrophobicContact CG2-CD1 3.74Å; V114-I143 HydrophobicContact CB-CD1 4.22Å; V114-I143 HydrophobicContact CG1-CD1 4.05Å
115	E	91.9	Very high	85.6	Confident	75 Å²	75	77.8 Å²	77.8	35%	0.35	41%	0.406	S	S	.	.	H	α-helix	trans	-63.6	-44.9	176.3	-166.8	-176.3	157.2	0	0	111.4	S111 E113 L117 S118 K119 I143	S111-E115 WeakPolarHBondContact O-CB 3.31Å; S111-E115 PolarHBondContact O-N 2.76Å; E113-E115 VanDerWaalsContact C-N 3.34Å; E113-E115 PolarHBondContact O-N 2.91Å; E115-L117 PolarHBondContact O-N 3.15Å; E115-S118 WeakPolarHBondContact CA-OG 3.28Å; E115-S118 PolarHBondContact O-N 3.38Å; E115-S118 PolarHBondContact O-OG 3.47Å; E115-K119 WeakPolarHBondContact O-CG 3.24Å; E115-K119 PolarHBondContact O-N 3.43Å; E115-K119 VanDerWaalsContact OE1-CE 3.29Å; E115-K119 WeakPolarHBondContact OE1-CE 3.48Å; E115-K119 IonicContact OE1-NZ 2.79Å; E115-K119 PolarHBondContact OE1-NZ 3.03Å; E115-I143 HydrophobicContact CB-CD1 4.24Å; E115-I143 HydrophobicContact CG-CG2 4.31Å
116	K	91.6	Very high	86.6	Confident	149 Å²	149	73.7 Å²	73.7	65%	0.648	37%	0.37	S	S	*	.	H	α-helix	trans	-59.1	-47	174.5	-175.8	-175.9	177.8	-174.3	0	111.4	S112 E113 S118 K119 Q120	S112-K116 WeakPolarHBondContact O-CB 3.45Å; S112-K116 PolarHBondContact O-N 2.89Å; E113-K116 PolarHBondContact O-N 3.03Å; K116-S118 VanDerWaalsContact C-N 3.33Å; K116-S118 PolarHBondContact O-N 2.96Å; K116-K119 PolarHBondContact O-N 3.17Å; K116-Q120 PolarHBondContact O-N 3.41Å
117	L	91.5	Very high	87.6	Confident	21 Å²	21	68.7 Å²	68.7	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-41.5	178.5	-170.8	68.2	0	0	0	111.4	I86 P89 A92 E113 V114 E115 Q120 L121 L134	I86-L117 HydrophobicContact CG2-CD2 4.22Å; P89-L117 HydrophobicContact CG-CD2 4.41Å; A92-L117 HydrophobicContact CB-CD2 4.25Å; E113-L117 VanDerWaalsContact O-CB 3.29Å; E113-L117 WeakPolarHBondContact O-CB 3.04Å; E113-L117 PolarHBondContact O-N 3.43Å; V114-L117 PolarHBondContact O-N 2.84Å; E115-L117 PolarHBondContact O-N 3.15Å; L117-Q120 PolarHBondContact O-N 3.49Å; L117-L121 HydrophobicContact CD1-CD1 3.46Å; L117-L121 VanDerWaalsContact CD1-CD1 3.46Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CG-CD1 3.87Å; L117-L121 HydrophobicContact CG-CG 4.47Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 PolarHBondContact O-N 3.14Å; L117-L134 HydrophobicContact CD2-CD2 3.88Å; L117-L134 HydrophobicContact CG-CD2 4.08Å
118	S	90.6	Very high	88.5	Confident	5 Å²	5	68.3 Å²	68.3	4%	0.035	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-43	176.8	73.8	0	0	0	0	112.2	V114 E115 K116 Q120 L122	V114-S118 WeakPolarHBondContact O-CB 3.47Å; V114-S118 PolarHBondContact O-N 2.87Å; V114-S118 PolarHBondContact O-OG 2.84Å; E115-S118 WeakPolarHBondContact CA-OG 3.28Å; E115-S118 PolarHBondContact O-N 3.38Å; E115-S118 PolarHBondContact O-OG 3.47Å; K116-S118 VanDerWaalsContact C-N 3.33Å; K116-S118 PolarHBondContact O-N 2.96Å; S118-Q120 VanDerWaalsContact C-N 3.28Å; S118-Q120 PolarHBondContact O-N 3.31Å; S118-L122 WeakPolarHBondContact O-CB 3.33Å; S118-L122 WeakPolarHBondContact O-CG 3.41Å; S118-L122 PolarHBondContact O-N 3.1Å
119	K	89	Confident	89.4	Confident	154 Å²	154	63.4 Å²	63.4	67%	0.67	33%	0.331	S	S	*	.	H	α-helix	trans	-65	-32.5	176.6	-71.8	174.4	-175.2	166.5	0	112.3	E115 K116	E115-K119 WeakPolarHBondContact O-CG 3.24Å; E115-K119 PolarHBondContact O-N 3.43Å; E115-K119 VanDerWaalsContact OE1-CE 3.29Å; E115-K119 WeakPolarHBondContact OE1-CE 3.48Å; E115-K119 IonicContact OE1-NZ 2.79Å; E115-K119 PolarHBondContact OE1-NZ 3.03Å; K116-K119 PolarHBondContact O-N 3.17Å
120	Q	89.3	Confident	90.3	Very high	125 Å²	125	65 Å²	65	58%	0.584	34%	0.339	S	S	*	.	H	α-helix	trans	-78.9	-39.5	179.7	-176.1	-178.9	-35.4	0	0	113.1	K116 L117 S118	K116-Q120 PolarHBondContact O-N 3.41Å; L117-Q120 PolarHBondContact O-N 3.49Å; S118-Q120 VanDerWaalsContact C-N 3.28Å; S118-Q120 PolarHBondContact O-N 3.31Å
121	L	91.7	Very high	91	Very high	53 Å²	53	63.2 Å²	63.2	28%	0.277	33%	0.327	S	S	.	.	H	α-helix	trans	-107.5	-15.1	-167.3	-66	-175.7	0	0	0	115.2	P89 L117 T123 I126 L134	P89-L121 HydrophobicContact CG-CD1 3.65Å; L117-L121 HydrophobicContact CD1-CD1 3.46Å; L117-L121 VanDerWaalsContact CD1-CD1 3.46Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CG-CD1 3.87Å; L117-L121 HydrophobicContact CG-CG 4.47Å; L117-L121 WeakPolarHBondContact O-CB 3.46Å; L117-L121 PolarHBondContact O-N 3.14Å; L121-T123 PolarHBondContact O-N 3.41Å; L121-I126 WeakPolarHBondContact O-CD1 3.46Å; L121-L134 HydrophobicContact CB-CD1 3.8Å
122	L	90.5	Very high	91.5	Very high	24 Å²	24	60.5 Å²	60.5	13%	0.126	31%	0.307	C	S	.	.			trans	-73.2	63.9	172.7	-69.3	174.3	0	0	0	110.4	S118 I126 L131 L134 M138 H149	S118-L122 WeakPolarHBondContact O-CB 3.33Å; S118-L122 WeakPolarHBondContact O-CG 3.41Å; S118-L122 PolarHBondContact O-N 3.1Å; L122-I126 HydrophobicContact CD2-CD1 4.46Å; L122-L131 HydrophobicContact CD2-CD1 3.64Å; L122-L134 HydrophobicContact CD2-CB 4.3Å; L122-L134 HydrophobicContact CD2-CD1 4.06Å; L122-L134 HydrophobicContact CG-CD1 4.22Å; L122-M138 HydrophobicContact CD1-CE 4.42Å; L122-M138 HydrophobicContact CD1-SD 3.88Å; L122-H149 PolarHBondContact O-CE1 2.94Å
123	T	88.6	Confident	91.9	Very high	71 Å²	71	57.8 Å²	57.8	44%	0.436	28%	0.284	S	S	.	.	S	Bend	trans	-107.9	170.9	171.9	65.1	0	0	0	0	109.2	L121 D125 I126	L121-T123 PolarHBondContact O-N 3.41Å; T123-D125 PolarHBondContact O-N 3.15Å; T123-I126 WeakPolarHBondContact O-CG2 3.21Å; T123-I126 PolarHBondContact O-N 3.28Å
124	E	84.2	Confident	92.2	Very high	81 Å²	81	53.7 Å²	53.7	38%	0.379	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-11.3	-174.7	-57.8	-177.1	145.8	0	0	114.5	K156	E124-K156 HydrophobicContact CB-CD 3.95Å; E124-K156 HydrophobicContact CG-CD 4.07Å; E124-K156 WeakPolarHBondContact OE1-CE 3.45Å; E124-K156 IonicContact OE1-NZ 3.91Å; E124-K156 PolarHBondContact OE1-NZ 3.47Å; E124-K156 IonicContact OE2-NZ 3.78Å; E124-K156 PolarHBondContact OE2-NZ 2.99Å
125	D	86.6	Confident	92.5	Very high	136 Å²	136	53.7 Å²	53.7	73%	0.727	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	3.3	179.8	-68	-46.4	0	0	0	113.6	T123 K160	T123-D125 PolarHBondContact O-N 3.15Å; D125-K160 IonicContact OD1-NZ 3.51Å
126	I	93.3	Very high	92.6	Very high	18 Å²	18	50.1 Å²	50.1	9%	0.092	25%	0.248	C	C	.	.			trans	-62.4	140.9	177.9	-165.8	175.7	0	0	0	111.5	L121 L122 T123 N130 L131 L134 I153	L121-I126 WeakPolarHBondContact O-CD1 3.46Å; L122-I126 HydrophobicContact CD2-CD1 4.46Å; T123-I126 WeakPolarHBondContact O-CG2 3.21Å; T123-I126 PolarHBondContact O-N 3.28Å; I126-N130 HydrophobicContact CD1-CB 3.91Å; I126-N130 HydrophobicContact CG1-CB 3.69Å; I126-L131 HydrophobicContact CD1-CB 4.2Å; I126-L131 HydrophobicContact CG2-CB 4.1Å; I126-L131 HydrophobicContact CG2-CD1 4.27Å; I126-L134 HydrophobicContact CD1-CD1 3.64Å; I126-I153 HydrophobicContact CG2-CG2 3.61Å
127	S	93.8	Very high	92.8	Very high	47 Å²	47	43 Å²	43	33%	0.329	22%	0.218	S	C	.	.			trans	-68.8	155	171.5	89.8	0	0	0	0	111.2	E129 N130 L131	S127-E129 VanDerWaalsContact C-N 3.29Å; S127-E129 WeakPolarHBondContact CB-OE2 3.04Å; S127-E129 PolarHBondContact O-N 3.13Å; S127-E129 PolarHBondContact OG-OE2 3.41Å; S127-N130 PolarHBondContact O-N 2.83Å; S127-N130 PolarHBondContact OG-N 3.32Å; S127-N130 PolarHBondContact OG-ND2 3.47Å; S127-L131 WeakPolarHBondContact O-CB 3.43Å; S127-L131 PolarHBondContact O-N 2.81Å
128	I	95.3	Very high	92.9	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-34.7	-177.8	-171.2	59.1	0	0	0	112.7	L131 F132 I157 T166 F169 V170 I173	I128-L131 HydrophobicContact CD1-CD2 4.24Å; I128-L131 PolarHBondContact O-N 2.66Å; I128-F132 WeakPolarHBondContact O-CB 3.07Å; I128-F132 PolarHBondContact O-N 3.49Å; I128-I157 HydrophobicContact CB-CD1 4.37Å; I128-I157 HydrophobicContact CB-CG2 4.11Å; I128-I157 HydrophobicContact CD1-CD1 4.1Å; I128-I157 HydrophobicContact CD1-CG2 4.33Å; I128-T166 HydrophobicContact CB-CG2 4.27Å; I128-T166 HydrophobicContact CG1-CG2 4.13Å; I128-T166 HydrophobicContact CG2-CG2 4.21Å; I128-F169 HydrophobicContact CD1-CB 4.1Å; I128-F169 HydrophobicContact CG1-CB 3.44Å; I128-F169 VanDerWaalsContact CG1-CB 3.44Å; I128-F169 HydrophobicContact CG1-CD2 4.3Å; I128-F169 HydrophobicContact CG1-CG 4.17Å; I128-F169 HydrophobicContact CG2-CD2 4.04Å; I128-V170 HydrophobicContact CD1-CG2 3.79Å; I128-I173 HydrophobicContact CD1-CD1 3.86Å
129	E	94.7	Very high	93.1	Very high	74 Å²	74	44.8 Å²	44.8	35%	0.346	22%	0.224	S	C	.	.	H	α-helix	trans	-64.8	-47.8	175.9	-58.1	80.3	-179.1	0	0	110.8	S127 L131 F132 Y133 F169	S127-E129 VanDerWaalsContact C-N 3.29Å; S127-E129 WeakPolarHBondContact CB-OE2 3.04Å; S127-E129 PolarHBondContact O-N 3.13Å; S127-E129 PolarHBondContact OG-OE2 3.41Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.05Å; E129-F132 WeakPolarHBondContact O-CB 3.42Å; E129-F132 PolarHBondContact O-N 3.03Å; E129-Y133 HydrophobicContact CB-CE2 4.1Å; E129-Y133 WeakPolarHBondContact O-CD2 3.3Å; E129-Y133 PolarHBondContact O-N 3.27Å; E129-F169 HydrophobicContact CB-CZ 4.46Å; E129-F169 HydrophobicContact CG-CD2 4.49Å; E129-F169 HydrophobicContact CG-CE2 3.71Å; E129-F169 HydrophobicContact CG-CZ 3.89Å
130	N	96	Very high	93.2	Very high	56 Å²	56	40.6 Å²	40.6	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-66.2	-36.4	178.8	-76.7	-28	0	0	0	111.6	P89 I126 S127 Y133 L134	P89-N130 HydrophobicContact CB-CB 4.17Å; P89-N130 HydrophobicContact CG-CB 4.09Å; I126-N130 HydrophobicContact CD1-CB 3.91Å; I126-N130 HydrophobicContact CG1-CB 3.69Å; S127-N130 PolarHBondContact O-N 2.83Å; S127-N130 PolarHBondContact OG-N 3.32Å; S127-N130 PolarHBondContact OG-ND2 3.47Å; N130-Y133 PolarHBondContact O-N 2.82Å; N130-L134 WeakPolarHBondContact O-CB 3.41Å; N130-L134 WeakPolarHBondContact O-CG 3.36Å; N130-L134 PolarHBondContact O-N 2.98Å
131	L	97.2	Very high	93.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-47.1	171.8	-176.8	63.7	0	0	0	111.1	L122 I126 S127 I128 E129 Y133 L134 V135 V150 I153 I154 I157 I173	L122-L131 HydrophobicContact CD2-CD1 3.64Å; I126-L131 HydrophobicContact CD1-CB 4.2Å; I126-L131 HydrophobicContact CG2-CB 4.1Å; I126-L131 HydrophobicContact CG2-CD1 4.27Å; S127-L131 WeakPolarHBondContact O-CB 3.43Å; S127-L131 PolarHBondContact O-N 2.81Å; I128-L131 HydrophobicContact CD1-CD2 4.24Å; I128-L131 PolarHBondContact O-N 2.66Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.05Å; L131-Y133 PolarHBondContact O-N 3.06Å; L131-L134 PolarHBondContact O-N 3.07Å; L131-V135 HydrophobicContact CD1-CG2 3.94Å; L131-V135 HydrophobicContact CG-CG2 4.35Å; L131-V135 WeakPolarHBondContact O-CB 3.19Å; L131-V135 VanDerWaalsContact O-CG2 3.28Å; L131-V135 WeakPolarHBondContact O-CG2 3.41Å; L131-V135 PolarHBondContact O-N 2.94Å; L131-V150 HydrophobicContact CD1-CG1 4.48Å; L131-I153 HydrophobicContact CD1-CD1 4.48Å; L131-I153 HydrophobicContact CD1-CG2 4.36Å; L131-I153 HydrophobicContact CD2-CB 4.45Å; L131-I153 HydrophobicContact CD2-CG2 3.83Å; L131-I154 HydrophobicContact CD2-CG1 3.97Å; L131-I157 HydrophobicContact CD2-CD1 3.95Å; L131-I173 HydrophobicContact CB-CD1 4.37Å; L131-I173 HydrophobicContact CD2-CD1 3.97Å; L131-I173 HydrophobicContact CG-CD1 3.92Å
132	F	97.3	Very high	93.2	Very high	6 Å²	6	40.1 Å²	40.1	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-58.8	-46.6	176.1	164.9	-104.4	0	0	0	112	F93 I128 E129 S136 F169 Q172 I173 F217	F93-F132 HydrophobicContact CE1-CE1 4.26Å; F93-F132 HydrophobicContact CE2-CE1 4.25Å; F93-F132 HydrophobicContact CE2-CZ 4.15Å; F93-F132 AromaticContact CZ-CE1 3.92Å; F93-F132 HydrophobicContact CZ-CE1 3.92Å; F93-F132 AromaticContact CZ-CZ 3.94Å; F93-F132 HydrophobicContact CZ-CZ 3.94Å; I128-F132 WeakPolarHBondContact O-CB 3.07Å; I128-F132 PolarHBondContact O-N 3.49Å; E129-F132 WeakPolarHBondContact O-CB 3.42Å; E129-F132 PolarHBondContact O-N 3.03Å; F132-S136 WeakPolarHBondContact CE2-OG 3.4Å; F132-S136 WeakPolarHBondContact O-CB 3.3Å; F132-S136 PolarHBondContact O-N 2.93Å; F132-S136 PolarHBondContact O-OG 2.78Å; F132-F169 HydrophobicContact CB-CD1 3.6Å; F132-F169 HydrophobicContact CB-CE1 4.14Å; F132-F169 HydrophobicContact CB-CG 4.38Å; F132-F169 AromaticContact CD1-CD1 3.74Å; F132-F169 HydrophobicContact CD1-CD1 3.74Å; F132-F169 AromaticContact CD1-CE1 3.53Å; F132-F169 HydrophobicContact CD1-CE1 3.53Å; F132-F169 HydrophobicContact CD2-CD1 4.1Å; F132-F169 HydrophobicContact CE1-CD1 4.47Å; F132-F169 HydrophobicContact CE1-CE1 4.09Å; F132-F169 AromaticContact CG-CD1 3.51Å; F132-F169 HydrophobicContact CG-CD1 3.51Å; F132-F169 AromaticContact CG-CE1 3.84Å; F132-F169 HydrophobicContact CG-CE1 3.84Å; F132-Q172 HydrophobicContact CD2-CB 4.4Å; F132-Q172 HydrophobicContact CD2-CG 4.05Å; F132-Q172 HydrophobicContact CE2-CB 4.24Å; F132-Q172 HydrophobicContact CE2-CG 3.44Å; F132-Q172 VanDerWaalsContact CE2-CG 3.44Å; F132-Q172 HydrophobicContact CZ-CG 4.32Å; F132-I173 HydrophobicContact CB-CD1 4.01Å; F132-I173 HydrophobicContact CB-CG1 4.04Å; F132-I173 HydrophobicContact CD2-CG1 4.15Å; F132-F217 HydrophobicContact CZ-CE2 4.32Å
133	Y	96.1	Very high	93.3	Very high	25 Å²	25	40.3 Å²	40.3	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-46.8	179.1	-66.2	-36.6	0	0	0	112.1	P89 E90 F93 E129 N130 L131 S137	P89-Y133 WeakPolarHBondContact O-CB 3.35Å; E90-Y133 HydrophobicContact CB-CD2 3.76Å; E90-Y133 HydrophobicContact CB-CE2 3.71Å; E90-Y133 HydrophobicContact CB-CG 4.47Å; E90-Y133 HydrophobicContact CG-CD2 4.33Å; E90-Y133 HydrophobicContact CG-CE2 3.87Å; F93-Y133 HydrophobicContact CB-CD1 3.81Å; F93-Y133 HydrophobicContact CB-CG 4.06Å; F93-Y133 AromaticContact CD1-CD1 3.43Å; F93-Y133 HydrophobicContact CD1-CD1 3.43Å; F93-Y133 VanDerWaalsContact CD1-CD1 3.43Å; F93-Y133 AromaticContact CD1-CE1 3.74Å; F93-Y133 HydrophobicContact CD1-CE1 3.74Å; F93-Y133 HydrophobicContact CD1-CG 4.45Å; F93-Y133 HydrophobicContact CD2-CD1 4.33Å; F93-Y133 HydrophobicContact CE1-CD1 4.03Å; F93-Y133 HydrophobicContact CE1-CE1 4.07Å; F93-Y133 AromaticContact CG-CD1 3.6Å; F93-Y133 HydrophobicContact CG-CD1 3.6Å; F93-Y133 HydrophobicContact CG-CE1 4.37Å; F93-Y133 HydrophobicContact CG-CG 4.33Å; E129-Y133 HydrophobicContact CB-CE2 4.1Å; E129-Y133 WeakPolarHBondContact O-CD2 3.3Å; E129-Y133 PolarHBondContact O-N 3.27Å; N130-Y133 PolarHBondContact O-N 2.82Å; L131-Y133 PolarHBondContact O-N 3.06Å; Y133-S137 WeakPolarHBondContact O-CB 3.26Å; Y133-S137 PolarHBondContact O-N 2.84Å; Y133-S137 PolarHBondContact O-OG 2.73Å
134	L	96	Very high	93.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-49.9	178.5	-72.4	179.2	0	0	0	112.2	P89 L117 L121 L122 I126 N130 L131 S136 S137 M138	P89-L134 HydrophobicContact CB-CD2 3.91Å; P89-L134 HydrophobicContact CB-CG 3.87Å; P89-L134 HydrophobicContact CG-CD1 4.28Å; P89-L134 HydrophobicContact CG-CD2 4Å; P89-L134 HydrophobicContact CG-CG 4Å; L117-L134 HydrophobicContact CD2-CD2 3.88Å; L117-L134 HydrophobicContact CG-CD2 4.08Å; L121-L134 HydrophobicContact CB-CD1 3.8Å; L122-L134 HydrophobicContact CD2-CB 4.3Å; L122-L134 HydrophobicContact CD2-CD1 4.06Å; L122-L134 HydrophobicContact CG-CD1 4.22Å; I126-L134 HydrophobicContact CD1-CD1 3.64Å; N130-L134 WeakPolarHBondContact O-CB 3.41Å; N130-L134 WeakPolarHBondContact O-CG 3.36Å; N130-L134 PolarHBondContact O-N 2.98Å; L131-L134 PolarHBondContact O-N 3.07Å; L134-S136 VanDerWaalsContact C-N 3.31Å; L134-S136 PolarHBondContact O-N 2.6Å; L134-S137 WeakPolarHBondContact O-CB 3.33Å; L134-S137 PolarHBondContact O-N 2.9Å; L134-S137 VanDerWaalsContact O-N 3.15Å; L134-M138 VanDerWaalsContact O-CG 3.29Å; L134-M138 WeakPolarHBondContact O-CG 3.22Å; L134-M138 PolarHBondContact O-N 3.18Å
135	V	96.6	Very high	93.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-41.9	-178.7	174.5	0	0	0	0	110.7	L131 S137 M138 K139 I145 V150 I173 L177	L131-V135 HydrophobicContact CD1-CG2 3.94Å; L131-V135 HydrophobicContact CG-CG2 4.35Å; L131-V135 WeakPolarHBondContact O-CB 3.19Å; L131-V135 VanDerWaalsContact O-CG2 3.28Å; L131-V135 WeakPolarHBondContact O-CG2 3.41Å; L131-V135 PolarHBondContact O-N 2.94Å; V135-S137 PolarHBondContact O-N 3.26Å; V135-M138 PolarHBondContact O-N 2.72Å; V135-K139 WeakPolarHBondContact O-CB 3.45Å; V135-K139 PolarHBondContact O-N 3.17Å; V135-I145 HydrophobicContact CG1-CD1 4.14Å; V135-V150 HydrophobicContact CG2-CG1 4.16Å; V135-V150 HydrophobicContact CG2-CG2 4Å; V135-I173 HydrophobicContact CB-CG2 4.44Å; V135-I173 HydrophobicContact CG1-CG2 4.08Å; V135-I173 HydrophobicContact CG2-CG2 4.44Å; V135-L177 HydrophobicContact CG1-CD2 3.97Å
136	S	95.7	Very high	94.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-40.7	175.4	-62.9	0	0	0	0	111.8	F93 F132 L134 K139 Y140 Q176	F93-S136 VanDerWaalsContact CD2-CB 3.47Å; F93-S136 VanDerWaalsContact CE2-CB 3.42Å; F132-S136 WeakPolarHBondContact CE2-OG 3.4Å; F132-S136 WeakPolarHBondContact O-CB 3.3Å; F132-S136 PolarHBondContact O-N 2.93Å; F132-S136 PolarHBondContact O-OG 2.78Å; L134-S136 VanDerWaalsContact C-N 3.31Å; L134-S136 PolarHBondContact O-N 2.6Å; S136-K139 WeakPolarHBondContact O-CB 3.35Å; S136-K139 PolarHBondContact O-N 2.84Å; S136-Y140 WeakPolarHBondContact O-CD2 3.39Å; S136-Y140 PolarHBondContact O-N 2.84Å; S136-Q176 PolarHBondContact OG-NE2 3.2Å; S136-Q176 PolarHBondContact OG-OE1 3.13Å; S136-Q176 VanDerWaalsContact OG-OE1 3.13Å
137	S	94.4	Very high	94.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-48.2	177.1	-56.5	0	0	0	0	111.9	A92 F93 S96 Y133 L134 V135 K139 Y140 L141	A92-S137 VanDerWaalsContact C-OG 3.22Å; A92-S137 PolarHBondContact O-OG 3.02Å; F93-S137 WeakPolarHBondContact CA-OG 3.25Å; F93-S137 PolarHBondContact N-OG 2.76Å; S96-S137 VanDerWaalsContact OG-CA 3.29Å; S96-S137 WeakPolarHBondContact OG-CA 3.41Å; S96-S137 WeakPolarHBondContact OG-CB 3.49Å; S96-S137 PolarHBondContact OG-OG 3.13Å; Y133-S137 WeakPolarHBondContact O-CB 3.26Å; Y133-S137 PolarHBondContact O-N 2.84Å; Y133-S137 PolarHBondContact O-OG 2.73Å; L134-S137 WeakPolarHBondContact O-CB 3.33Å; L134-S137 PolarHBondContact O-N 2.9Å; L134-S137 VanDerWaalsContact O-N 3.15Å; V135-S137 PolarHBondContact O-N 3.26Å; S137-K139 PolarHBondContact O-N 3.08Å; S137-Y140 PolarHBondContact O-N 2.82Å; S137-L141 WeakPolarHBondContact O-CG 3.28Å; S137-L141 PolarHBondContact O-N 2.87Å
138	M	94.7	Very high	93.9	Very high	7 Å²	7	45.4 Å²	45.4	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-41.3	175.7	-69.2	172.8	77	0	0	110.7	L122 L134 V135 L141 N142 I143 K144 I145	L122-M138 HydrophobicContact CD1-CE 4.42Å; L122-M138 HydrophobicContact CD1-SD 3.88Å; L134-M138 VanDerWaalsContact O-CG 3.29Å; L134-M138 WeakPolarHBondContact O-CG 3.22Å; L134-M138 PolarHBondContact O-N 3.18Å; V135-M138 PolarHBondContact O-N 2.72Å; M138-L141 CarbonylContact O-C 3.55Å; M138-L141 PolarHBondContact O-N 2.69Å; M138-N142 PolarHBondContact O-N 3.34Å; M138-I143 HydrophobicContact CB-CB 4Å; M138-I143 HydrophobicContact CB-CG2 4.49Å; M138-I143 HydrophobicContact CE-CB 4.46Å; M138-I143 HydrophobicContact CE-CG2 3.75Å; M138-I143 HydrophobicContact CG-CB 4.21Å; M138-I143 HydrophobicContact CG-CD1 4.46Å; M138-I143 HydrophobicContact CG-CG2 4.27Å; M138-I143 PolarHBondContact O-N 3.27Å; M138-K144 VanDerWaalsContact CE-O 3.22Å; M138-K144 WeakPolarHBondContact CE-O 3.44Å; M138-I145 HydrophobicContact CB-CD1 4.11Å; M138-I145 HydrophobicContact CB-CG1 3.79Å; M138-I145 HydrophobicContact CE-CB 4.47Å; M138-I145 HydrophobicContact CE-CG1 3.89Å; M138-I145 HydrophobicContact SD-CG1 4.28Å
139	K	94	Very high	93.8	Very high	57 Å²	57	48.5 Å²	48.5	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-47.4	176.6	-175	65.9	176	-160.2	0	112.3	V135 S136 S137 L141 N142 I145 Q176	V135-K139 WeakPolarHBondContact O-CB 3.45Å; V135-K139 PolarHBondContact O-N 3.17Å; S136-K139 WeakPolarHBondContact O-CB 3.35Å; S136-K139 PolarHBondContact O-N 2.84Å; S137-K139 PolarHBondContact O-N 3.08Å; K139-L141 VanDerWaalsContact C-N 3.28Å; K139-L141 PolarHBondContact O-N 2.88Å; K139-N142 PolarHBondContact O-N 2.85Å; K139-I145 HydrophobicContact CB-CD1 4.28Å; K139-Q176 WeakPolarHBondContact CE-O 3.48Å; K139-Q176 HydrophobicContact CG-CB 4.43Å; K139-Q176 PolarHBondContact NZ-O 2.75Å
140	Y	91	Very high	93.8	Very high	66 Å²	66	45.1 Å²	45.1	26%	0.259	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-31.7	179.9	-77.5	-57.3	0	0	0	113.2	F93 A97 K100 S136 S137	F93-Y140 HydrophobicContact CE2-CE2 4.04Å; A97-Y140 HydrophobicContact CB-CD2 3.55Å; A97-Y140 HydrophobicContact CB-CE2 3.31Å; A97-Y140 HydrophobicContact CB-CG 4.34Å; K100-Y140 HydrophobicContact CB-CD1 3.76Å; K100-Y140 HydrophobicContact CB-CE1 4.36Å; K100-Y140 HydrophobicContact CB-CG 4.36Å; K100-Y140 HydrophobicContact CG-CD1 3.73Å; K100-Y140 HydrophobicContact CG-CE1 4.24Å; S136-Y140 WeakPolarHBondContact O-CD2 3.39Å; S136-Y140 PolarHBondContact O-N 2.84Å; S137-Y140 PolarHBondContact O-N 2.82Å
141	L	90.9	Very high	93.7	Very high	33 Å²	33	43.8 Å²	43.8	17%	0.173	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	3	178.4	-60.9	178.3	0	0	0	114.2	V109 V114 S137 M138 K139 I143	V109-L141 HydrophobicContact CB-CD2 3.84Å; V109-L141 HydrophobicContact CG1-CD1 3.84Å; V109-L141 HydrophobicContact CG1-CD2 3.74Å; V109-L141 HydrophobicContact CG1-CG 4.4Å; V109-L141 HydrophobicContact CG2-CD2 4.24Å; V114-L141 HydrophobicContact CB-CD1 3.92Å; V114-L141 HydrophobicContact CG1-CD1 4.08Å; V114-L141 HydrophobicContact CG2-CD1 3.74Å; S137-L141 WeakPolarHBondContact O-CG 3.28Å; S137-L141 PolarHBondContact O-N 2.87Å; M138-L141 CarbonylContact O-C 3.55Å; M138-L141 PolarHBondContact O-N 2.69Å; K139-L141 VanDerWaalsContact C-N 3.28Å; K139-L141 PolarHBondContact O-N 2.88Å; L141-I143 HydrophobicContact CB-CD1 4.06Å; L141-I143 HydrophobicContact CB-CG1 3.99Å; L141-I143 HydrophobicContact CD1-CD1 4.21Å; L141-I143 PolarHBondContact O-N 3.28Å
142	N	90.6	Very high	93.4	Very high	134 Å²	134	46 Å²	46	72%	0.717	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	30.1	-175.1	-55.3	-56.9	0	0	0	114.3	M138 K139	M138-N142 PolarHBondContact O-N 3.34Å; K139-N142 PolarHBondContact O-N 2.85Å
143	I	92.1	Very high	93.3	Very high	28 Å²	28	45.8 Å²	45.8	14%	0.144	23%	0.23	C	C	.	.			trans	-73.2	138	171.9	-59.6	171.4	0	0	0	108.1	V114 E115 M138 L141 I145	V114-I143 HydrophobicContact CB-CD1 4.22Å; V114-I143 HydrophobicContact CG1-CD1 4.05Å; E115-I143 HydrophobicContact CB-CD1 4.24Å; E115-I143 HydrophobicContact CG-CG2 4.31Å; M138-I143 HydrophobicContact CB-CB 4Å; M138-I143 HydrophobicContact CB-CG2 4.49Å; M138-I143 HydrophobicContact CE-CB 4.46Å; M138-I143 HydrophobicContact CE-CG2 3.75Å; M138-I143 HydrophobicContact CG-CB 4.21Å; M138-I143 HydrophobicContact CG-CD1 4.46Å; M138-I143 HydrophobicContact CG-CG2 4.27Å; M138-I143 PolarHBondContact O-N 3.27Å; L141-I143 HydrophobicContact CB-CD1 4.06Å; L141-I143 HydrophobicContact CB-CG1 3.99Å; L141-I143 HydrophobicContact CD1-CD1 4.21Å; L141-I143 PolarHBondContact O-N 3.28Å; I143-I145 PolarHBondContact O-N 3.15Å
144	K	91.1	Very high	93.3	Very high	196 Å²	196	44.6 Å²	44.6	85%	0.852	23%	0.225	S	C	*	.			trans	-62.8	125.7	179	-175.7	177.8	178.3	-177.6	0	110.3	M138	M138-K144 VanDerWaalsContact CE-O 3.22Å; M138-K144 WeakPolarHBondContact CE-O 3.44Å
145	I	93	Very high	93.1	Very high	36 Å²	36	48.4 Å²	48.4	19%	0.185	25%	0.245	C	C	.	.			trans	-104.5	126.3	177.6	-59.3	157.1	0	0	0	108.5	V135 M138 K139 I143 A147 V150 L177	V135-I145 HydrophobicContact CG1-CD1 4.14Å; M138-I145 HydrophobicContact CB-CD1 4.11Å; M138-I145 HydrophobicContact CB-CG1 3.79Å; M138-I145 HydrophobicContact CE-CB 4.47Å; M138-I145 HydrophobicContact CE-CG1 3.89Å; M138-I145 HydrophobicContact SD-CG1 4.28Å; K139-I145 HydrophobicContact CB-CD1 4.28Å; I143-I145 PolarHBondContact O-N 3.15Å; I145-A147 PolarHBondContact O-N 3.35Å; I145-A147 VanDerWaalsContact O-N 3.17Å; I145-V150 HydrophobicContact CG2-CG2 3.83Å; I145-L177 HydrophobicContact CB-CD2 4.46Å; I145-L177 HydrophobicContact CG2-CD2 3.57Å
146	D	92.4	Very high	93	Very high	94 Å²	94	52.7 Å²	52.7	50%	0.503	26%	0.264	S	S	.	.			trans	-77.2	96.2	167.5	-175	-17.5	0	0	0	109.2	N148 H149 V150	D146-N148 VanDerWaalsContact C-N 3.26Å; D146-N148 PolarHBondContact O-N 3.24Å; D146-N148 PolarHBondContact OD1-N 2.92Å; D146-N148 VanDerWaalsContact OD1-N 3.08Å; D146-H149 HydrophobicContact CB-CB 3.94Å; D146-H149 PolarHBondContact O-N 2.65Å; D146-H149 PolarHBondContact OD1-N 2.83Å; D146-H149 VanDerWaalsContact OD1-N 3.11Å; D146-V150 WeakPolarHBondContact O-CG2 3.29Å; D146-V150 PolarHBondContact O-N 2.99Å
147	A	92.5	Very high	92.9	Very high	20 Å²	20	53.5 Å²	53.5	17%	0.165	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-29.6	-176.1	0	0	0	0	0	113	I145 L151 L177 L179	I145-A147 PolarHBondContact O-N 3.35Å; I145-A147 VanDerWaalsContact O-N 3.17Å; A147-L151 VanDerWaalsContact O-CB 3.31Å; A147-L151 WeakPolarHBondContact O-CB 3.46Å; A147-L151 PolarHBondContact O-N 2.67Å; A147-L177 HydrophobicContact CB-CB 4.43Å; A147-L177 HydrophobicContact CB-CD1 4.42Å; A147-L177 HydrophobicContact CB-CD2 4.49Å; A147-L179 HydrophobicContact CB-CD2 3.69Å
148	N	91.4	Very high	92.7	Very high	115 Å²	115	55.5 Å²	55.5	62%	0.615	28%	0.277	S	S	*	.	H	α-helix	trans	-71.2	-41.7	178	-69.5	-29.6	0	0	0	110.7	D146 L151 S152	D146-N148 VanDerWaalsContact C-N 3.26Å; D146-N148 PolarHBondContact O-N 3.24Å; D146-N148 PolarHBondContact OD1-N 2.92Å; D146-N148 VanDerWaalsContact OD1-N 3.08Å; N148-L151 PolarHBondContact O-N 3.48Å; N148-S152 PolarHBondContact O-N 3.46Å
149	H	92.6	Very high	92.5	Very high	72 Å²	72	59.4 Å²	59.4	33%	0.333	31%	0.31	S	S	.	.	H	α-helix	trans	-63.4	-46.1	175.3	-175	-153.3	0	0	0	111.6	L122 D146 L151 S152 I153	L122-H149 PolarHBondContact O-CE1 2.94Å; D146-H149 HydrophobicContact CB-CB 3.94Å; D146-H149 PolarHBondContact O-N 2.65Å; D146-H149 PolarHBondContact OD1-N 2.83Å; D146-H149 VanDerWaalsContact OD1-N 3.11Å; H149-L151 VanDerWaalsContact C-N 3.28Å; H149-L151 PolarHBondContact O-N 3.08Å; H149-S152 WeakPolarHBondContact O-CB 3.39Å; H149-S152 PolarHBondContact O-N 3.29Å; H149-S152 VanDerWaalsContact O-N 3.15Å; H149-I153 WeakPolarHBondContact O-CG1 3.44Å; H149-I153 PolarHBondContact O-N 2.76Å
150	V	94.8	Very high	92.4	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-40.2	175.9	175	0	0	0	0	111.3	L131 V135 I145 D146 S152 I153 I154 I173 L177	L131-V150 HydrophobicContact CD1-CG1 4.48Å; V135-V150 HydrophobicContact CG2-CG1 4.16Å; V135-V150 HydrophobicContact CG2-CG2 4Å; I145-V150 HydrophobicContact CG2-CG2 3.83Å; D146-V150 WeakPolarHBondContact O-CG2 3.29Å; D146-V150 PolarHBondContact O-N 2.99Å; V150-S152 PolarHBondContact O-N 3.48Å; V150-I153 PolarHBondContact O-N 2.97Å; V150-I154 HydrophobicContact CG1-CD1 3.94Å; V150-I154 HydrophobicContact CG1-CG1 4.42Å; V150-I154 WeakPolarHBondContact O-CG1 3.13Å; V150-I154 PolarHBondContact O-N 2.84Å; V150-I173 HydrophobicContact CG1-CG2 3.82Å; V150-L177 HydrophobicContact CB-CD1 4.24Å; V150-L177 HydrophobicContact CG1-CD1 3.87Å; V150-L177 HydrophobicContact CG1-CD2 4.41Å
151	L	92.5	Very high	92.3	Very high	28 Å²	28	64.3 Å²	64.3	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-64.4	-38.9	177	-170	63.4	0	0	0	112.4	A147 N148 H149 I154 N155 L174 H187	A147-L151 VanDerWaalsContact O-CB 3.31Å; A147-L151 WeakPolarHBondContact O-CB 3.46Å; A147-L151 PolarHBondContact O-N 2.67Å; N148-L151 PolarHBondContact O-N 3.48Å; H149-L151 VanDerWaalsContact C-N 3.28Å; H149-L151 PolarHBondContact O-N 3.08Å; L151-I154 PolarHBondContact O-N 2.91Å; L151-N155 PolarHBondContact O-N 2.84Å; L151-N155 PolarHBondContact O-ND2 3.01Å; L151-L174 HydrophobicContact CD1-CD2 4.1Å; L151-H187 WeakPolarHBondContact CD1-NE2 3.49Å
152	S	92.2	Very high	92.3	Very high	48 Å²	48	66.8 Å²	66.8	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-59.4	-47.6	173.4	-175.4	0	0	0	0	111.6	N148 H149 V150 N155 K156	N148-S152 PolarHBondContact O-N 3.46Å; H149-S152 WeakPolarHBondContact O-CB 3.39Å; H149-S152 PolarHBondContact O-N 3.29Å; H149-S152 VanDerWaalsContact O-N 3.15Å; V150-S152 PolarHBondContact O-N 3.48Å; S152-N155 PolarHBondContact O-N 3.17Å; S152-K156 PolarHBondContact O-N 3.45Å; S152-K156 VanDerWaalsContact O-N 3.14Å
153	I	95.5	Very high	92.3	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.3	-46.7	177.2	-62	170.7	0	0	0	110.4	I126 L131 H149 V150 N155 K156 I157	I126-I153 HydrophobicContact CG2-CG2 3.61Å; L131-I153 HydrophobicContact CD1-CD1 4.48Å; L131-I153 HydrophobicContact CD1-CG2 4.36Å; L131-I153 HydrophobicContact CD2-CB 4.45Å; L131-I153 HydrophobicContact CD2-CG2 3.83Å; H149-I153 WeakPolarHBondContact O-CG1 3.44Å; H149-I153 PolarHBondContact O-N 2.76Å; V150-I153 PolarHBondContact O-N 2.97Å; I153-N155 VanDerWaalsContact C-N 3.29Å; I153-N155 PolarHBondContact O-N 2.95Å; I153-K156 PolarHBondContact O-N 3.27Å; I153-K156 VanDerWaalsContact O-N 3.13Å; I153-I157 HydrophobicContact CG2-CD1 3.83Å; I153-I157 HydrophobicContact CG2-CG1 4.33Å; I153-I157 WeakPolarHBondContact O-CG1 3.31Å; I153-I157 PolarHBondContact O-N 2.7Å
154	I	95.1	Very high	92.2	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-55.2	-44.9	177.1	-76	170.7	0	0	0	111.2	L131 V150 L151 K156 I157 K158 V170 I173 L174	L131-I154 HydrophobicContact CD2-CG1 3.97Å; V150-I154 HydrophobicContact CG1-CD1 3.94Å; V150-I154 HydrophobicContact CG1-CG1 4.42Å; V150-I154 WeakPolarHBondContact O-CG1 3.13Å; V150-I154 PolarHBondContact O-N 2.84Å; L151-I154 PolarHBondContact O-N 2.91Å; I154-K156 VanDerWaalsContact C-N 3.34Å; I154-K156 PolarHBondContact O-N 2.68Å; I154-I157 PolarHBondContact O-N 3.25Å; I154-K158 HydrophobicContact CG2-CD 3.99Å; I154-K158 HydrophobicContact CG2-CG 4.33Å; I154-K158 WeakPolarHBondContact O-CB 3.09Å; I154-K158 WeakPolarHBondContact O-CG 3.44Å; I154-K158 PolarHBondContact O-N 3.1Å; I154-V170 HydrophobicContact CG2-CB 4.43Å; I154-V170 HydrophobicContact CG2-CG1 3.61Å; I154-V170 HydrophobicContact CG2-CG2 3.94Å; I154-I173 HydrophobicContact CD1-CB 4.42Å; I154-I173 HydrophobicContact CD1-CG2 3.9Å; I154-L174 HydrophobicContact CD1-CD2 3.98Å; I154-L174 HydrophobicContact CD1-CG 4.26Å
155	N	92.5	Very high	92.3	Very high	80 Å²	80	53.5 Å²	53.5	43%	0.428	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-37.3	-179.8	-71.8	-26.7	0	0	0	112.1	L151 S152 I153 A159	L151-N155 PolarHBondContact O-N 2.84Å; L151-N155 PolarHBondContact O-ND2 3.01Å; S152-N155 PolarHBondContact O-N 3.17Å; I153-N155 VanDerWaalsContact C-N 3.29Å; I153-N155 PolarHBondContact O-N 2.95Å; N155-A159 PolarHBondContact O-N 3.42Å; N155-A159 VanDerWaalsContact O-N 3.11Å
156	K	93.2	Very high	92.4	Very high	91 Å²	91	52 Å²	52	40%	0.396	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-40.9	174.4	-73.7	-173.8	168.3	180	0	112.9	E124 S152 I153 I154 A159	E124-K156 HydrophobicContact CB-CD 3.95Å; E124-K156 HydrophobicContact CG-CD 4.07Å; E124-K156 WeakPolarHBondContact OE1-CE 3.45Å; E124-K156 IonicContact OE1-NZ 3.91Å; E124-K156 PolarHBondContact OE1-NZ 3.47Å; E124-K156 IonicContact OE2-NZ 3.78Å; E124-K156 PolarHBondContact OE2-NZ 2.99Å; S152-K156 PolarHBondContact O-N 3.45Å; S152-K156 VanDerWaalsContact O-N 3.14Å; I153-K156 PolarHBondContact O-N 3.27Å; I153-K156 VanDerWaalsContact O-N 3.13Å; I154-K156 VanDerWaalsContact C-N 3.34Å; I154-K156 PolarHBondContact O-N 2.68Å; K156-A159 PolarHBondContact O-N 2.85Å
157	I	94.1	Very high	92.5	Very high	17 Å²	17	47.6 Å²	47.6	9%	0.087	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-48.8	174.8	-68.2	173	0	0	0	110.1	I128 L131 I153 I154 A159 K160 D161 T166	I128-I157 HydrophobicContact CB-CD1 4.37Å; I128-I157 HydrophobicContact CB-CG2 4.11Å; I128-I157 HydrophobicContact CD1-CD1 4.1Å; I128-I157 HydrophobicContact CD1-CG2 4.33Å; L131-I157 HydrophobicContact CD2-CD1 3.95Å; I153-I157 HydrophobicContact CG2-CD1 3.83Å; I153-I157 HydrophobicContact CG2-CG1 4.33Å; I153-I157 WeakPolarHBondContact O-CG1 3.31Å; I153-I157 PolarHBondContact O-N 2.7Å; I154-I157 PolarHBondContact O-N 3.25Å; I157-A159 PolarHBondContact O-N 2.99Å; I157-K160 PolarHBondContact O-N 2.84Å; I157-D161 PolarHBondContact O-N 3.38Å; I157-T166 HydrophobicContact CG2-CG2 3.79Å
158	K	91.5	Very high	92.7	Very high	42 Å²	42	46.7 Å²	46.7	18%	0.183	26%	0.256	C	S	.	.	H	α-helix	trans	-58.9	-30.5	178.4	-78.5	-177.8	59.8	-179.5	0	113.2	I154 K160 T162 L167 V170 N190	I154-K158 HydrophobicContact CG2-CD 3.99Å; I154-K158 HydrophobicContact CG2-CG 4.33Å; I154-K158 WeakPolarHBondContact O-CB 3.09Å; I154-K158 WeakPolarHBondContact O-CG 3.44Å; I154-K158 PolarHBondContact O-N 3.1Å; K158-K160 PolarHBondContact O-N 2.82Å; K158-T162 VanDerWaalsContact O-CG2 3.24Å; K158-T162 WeakPolarHBondContact O-CG2 3.29Å; K158-L167 HydrophobicContact CD-CD2 4.44Å; K158-L167 HydrophobicContact CG-CD2 4.26Å; K158-V170 HydrophobicContact CD-CG1 4.42Å; K158-V170 HydrophobicContact CG-CG2 4.31Å; K158-N190 WeakPolarHBondContact CE-OD1 3.39Å; K158-N190 PolarHBondContact NZ-ND2 2.97Å; K158-N190 PolarHBondContact NZ-OD1 2.64Å
159	A	90.6	Very high	93	Very high	89 Å²	89	41.5 Å²	41.5	74%	0.736	23%	0.228	S	C	*	.	H	α-helix	trans	-68.9	-23.5	175.6	0	0	0	0	0	112.9	N155 K156 I157	N155-A159 PolarHBondContact O-N 3.42Å; N155-A159 VanDerWaalsContact O-N 3.11Å; K156-A159 PolarHBondContact O-N 2.85Å; I157-A159 PolarHBondContact O-N 2.99Å
160	K	90.4	Very high	93.2	Very high	161 Å²	161	38 Å²	38	70%	0.7	21%	0.212	S	C	*	.	H	α-helix	trans	-97	-41	179.3	-65.2	177.2	-179.4	173.9	0	112.6	D125 I157 K158	D125-K160 IonicContact OD1-NZ 3.51Å; I157-K160 PolarHBondContact O-N 2.84Å; K158-K160 PolarHBondContact O-N 2.82Å
161	D	90.3	Very high	93.4	Very high	64 Å²	64	38 Å²	38	34%	0.342	21%	0.212	S	C	.	.			trans	-139.3	125.9	-176.8	-178.2	24	0	0	0	111.8	I157 S163 T166	I157-D161 PolarHBondContact O-N 3.38Å; D161-S163 WeakPolarHBondContact OD1-CB 3.39Å; D161-S163 PolarHBondContact OD1-N 3.12Å; D161-S163 PolarHBondContact OD1-OG 2.9Å; D161-S163 PolarHBondContact OD2-OG 2.78Å; D161-T166 HydrophobicContact CB-CG2 4.34Å; D161-T166 WeakPolarHBondContact O-CG2 3.42Å; D161-T166 WeakPolarHBondContact OD2-CB 3.35Å; D161-T166 PolarHBondContact OD2-OG1 3.33Å
162	T	90.2	Very high	93.6	Very high	85 Å²	85	36.9 Å²	36.9	52%	0.521	21%	0.206	S	C	.	.			trans	-117	18.2	177.1	53.5	0	0	0	0	112.1	K158 L167	K158-T162 VanDerWaalsContact O-CG2 3.24Å; K158-T162 WeakPolarHBondContact O-CG2 3.29Å; T162-L167 VanDerWaalsContact O-CD1 3.32Å; T162-L167 WeakPolarHBondContact O-CD1 3.5Å
163	S	90.9	Very high	93.8	Very high	33 Å²	33	34.6 Å²	34.6	23%	0.231	19%	0.19	C	C	.	.			trans	-56.9	151.2	178	72.4	0	0	0	0	112	D161 M165 T166 L167	D161-S163 WeakPolarHBondContact OD1-CB 3.39Å; D161-S163 PolarHBondContact OD1-N 3.12Å; D161-S163 PolarHBondContact OD1-OG 2.9Å; D161-S163 PolarHBondContact OD2-OG 2.78Å; S163-M165 PolarHBondContact O-N 3.1Å; S163-M165 VanDerWaalsContact O-N 3.13Å; S163-T166 PolarHBondContact O-N 2.87Å; S163-T166 WeakPolarHBondContact OG-CB 3.24Å; S163-T166 PolarHBondContact OG-N 2.78Å; S163-T166 PolarHBondContact OG-OG1 2.82Å; S163-T166 VanDerWaalsContact OG-OG1 3.13Å; S163-L167 PolarHBondContact O-N 3.02Å
164	P	89.9	Confident	93.9	Very high	27 Å²	27	34.7 Å²	34.7	18%	0.175	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-34.2	-176.8	-28.9	36.8	0	0	0	113.6	S168 V194 H197 Y208	P164-S168 VanDerWaalsContact O-CB 3.26Å; P164-S168 WeakPolarHBondContact O-CB 3.5Å; P164-S168 PolarHBondContact O-N 2.84Å; P164-S168 PolarHBondContact O-OG 3.08Å; P164-V194 HydrophobicContact CB-CG1 4.45Å; P164-H197 HydrophobicContact CG-CB 3.46Å; P164-H197 VanDerWaalsContact CG-CB 3.46Å; P164-Y208 HydrophobicContact CB-CD1 4.14Å; P164-Y208 HydrophobicContact CB-CE1 3.62Å; P164-Y208 HydrophobicContact CG-CD1 4.47Å; P164-Y208 HydrophobicContact CG-CE1 4.03Å
165	M	92.4	Very high	93.9	Very high	20 Å²	20	35.9 Å²	35.9	10%	0.099	20%	0.198	C	C	.	.	H	α-helix	trans	-68.3	-46.5	177.3	-166.3	69.7	-160.5	0	0	111.3	S163 S168 F169 Y213 T214 F217	S163-M165 PolarHBondContact O-N 3.1Å; S163-M165 VanDerWaalsContact O-N 3.13Å; M165-S168 WeakPolarHBondContact O-CB 3.44Å; M165-S168 PolarHBondContact O-N 3.02Å; M165-S168 VanDerWaalsContact O-N 3.16Å; M165-F169 HydrophobicContact CE-CD2 4.02Å; M165-F169 HydrophobicContact CE-CE1 4.15Å; M165-F169 HydrophobicContact CE-CE2 3.28Å; M165-F169 HydrophobicContact CE-CZ 3.36Å; M165-F169 HydrophobicContact CG-CD2 4.01Å; M165-F169 HydrophobicContact CG-CE2 3.69Å; M165-F169 VanDerWaalsContact O-CD2 3.25Å; M165-F169 WeakPolarHBondContact O-CD2 3.34Å; M165-F169 PolarHBondContact O-N 2.9Å; M165-F169 HydrophobicContact SD-CE2 4.32Å; M165-Y213 HydrophobicContact CE-CE1 4.21Å; M165-T214 HydrophobicContact SD-CG2 3.87Å; M165-F217 HydrophobicContact CE-CD1 3.36Å; M165-F217 HydrophobicContact CE-CE1 3.68Å; M165-F217 HydrophobicContact CE-CG 3.97Å; M165-F217 HydrophobicContact SD-CD1 4.14Å
166	T	95	Very high	93.9	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-46.7	177.7	-66.3	0	0	0	0	111	I128 I157 D161 S163 S168 F169 V170	I128-T166 HydrophobicContact CB-CG2 4.27Å; I128-T166 HydrophobicContact CG1-CG2 4.13Å; I128-T166 HydrophobicContact CG2-CG2 4.21Å; I157-T166 HydrophobicContact CG2-CG2 3.79Å; D161-T166 HydrophobicContact CB-CG2 4.34Å; D161-T166 WeakPolarHBondContact O-CG2 3.42Å; D161-T166 WeakPolarHBondContact OD2-CB 3.35Å; D161-T166 PolarHBondContact OD2-OG1 3.33Å; S163-T166 PolarHBondContact O-N 2.87Å; S163-T166 WeakPolarHBondContact OG-CB 3.24Å; S163-T166 PolarHBondContact OG-N 2.78Å; S163-T166 PolarHBondContact OG-OG1 2.82Å; S163-T166 VanDerWaalsContact OG-OG1 3.13Å; T166-S168 VanDerWaalsContact C-N 3.31Å; T166-S168 PolarHBondContact O-N 2.82Å; T166-F169 PolarHBondContact O-N 3.02Å; T166-V170 WeakPolarHBondContact O-CG2 3.45Å; T166-V170 PolarHBondContact O-N 3.37Å
167	L	96	Very high	93.8	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-36.1	175	-66.5	-177.7	0	0	0	112.3	K158 T162 S163 V170 L171 N190 N193 V194	K158-L167 HydrophobicContact CD-CD2 4.44Å; K158-L167 HydrophobicContact CG-CD2 4.26Å; T162-L167 VanDerWaalsContact O-CD1 3.32Å; T162-L167 WeakPolarHBondContact O-CD1 3.5Å; S163-L167 PolarHBondContact O-N 3.02Å; L167-V170 WeakPolarHBondContact O-CB 3.35Å; L167-V170 PolarHBondContact O-N 3.45Å; L167-L171 VanDerWaalsContact O-CG 3.31Å; L167-L171 WeakPolarHBondContact O-CG 3.34Å; L167-L171 PolarHBondContact O-N 3.05Å; L167-N190 HydrophobicContact CD2-CB 4.36Å; L167-N193 HydrophobicContact CD1-CB 3.79Å; L167-V194 HydrophobicContact CB-CG2 3.34Å; L167-V194 HydrophobicContact CD1-CG2 3.95Å; L167-V194 HydrophobicContact CG-CG2 4.3Å
168	S	96.4	Very high	93.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.8	-37.4	176.1	-62.5	0	0	0	0	113	P164 M165 T166 L171 Q172 V218 S221	P164-S168 VanDerWaalsContact O-CB 3.26Å; P164-S168 WeakPolarHBondContact O-CB 3.5Å; P164-S168 PolarHBondContact O-N 2.84Å; P164-S168 PolarHBondContact O-OG 3.08Å; M165-S168 WeakPolarHBondContact O-CB 3.44Å; M165-S168 PolarHBondContact O-N 3.02Å; M165-S168 VanDerWaalsContact O-N 3.16Å; T166-S168 VanDerWaalsContact C-N 3.31Å; T166-S168 PolarHBondContact O-N 2.82Å; S168-L171 PolarHBondContact O-N 2.83Å; S168-Q172 WeakPolarHBondContact O-CB 3.03Å; S168-Q172 PolarHBondContact O-N 3.41Å; S168-V218 WeakPolarHBondContact OG-CG2 3.45Å; S168-S221 VanDerWaalsContact O-CB 3.27Å; S168-S221 WeakPolarHBondContact O-CB 3.49Å; S168-S221 PolarHBondContact O-OG 2.81Å
169	F	97.7	Very high	93.3	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-42	170.7	-79.5	-63.4	0	0	0	111.3	I128 E129 F132 M165 T166 L171 Q172 I173 F217	I128-F169 HydrophobicContact CD1-CB 4.1Å; I128-F169 HydrophobicContact CG1-CB 3.44Å; I128-F169 VanDerWaalsContact CG1-CB 3.44Å; I128-F169 HydrophobicContact CG1-CD2 4.3Å; I128-F169 HydrophobicContact CG1-CG 4.17Å; I128-F169 HydrophobicContact CG2-CD2 4.04Å; E129-F169 HydrophobicContact CB-CZ 4.46Å; E129-F169 HydrophobicContact CG-CD2 4.49Å; E129-F169 HydrophobicContact CG-CE2 3.71Å; E129-F169 HydrophobicContact CG-CZ 3.89Å; F132-F169 HydrophobicContact CB-CD1 3.6Å; F132-F169 HydrophobicContact CB-CE1 4.14Å; F132-F169 HydrophobicContact CB-CG 4.38Å; F132-F169 AromaticContact CD1-CD1 3.74Å; F132-F169 HydrophobicContact CD1-CD1 3.74Å; F132-F169 AromaticContact CD1-CE1 3.53Å; F132-F169 HydrophobicContact CD1-CE1 3.53Å; F132-F169 HydrophobicContact CD2-CD1 4.1Å; F132-F169 HydrophobicContact CE1-CD1 4.47Å; F132-F169 HydrophobicContact CE1-CE1 4.09Å; F132-F169 AromaticContact CG-CD1 3.51Å; F132-F169 HydrophobicContact CG-CD1 3.51Å; F132-F169 AromaticContact CG-CE1 3.84Å; F132-F169 HydrophobicContact CG-CE1 3.84Å; M165-F169 HydrophobicContact CE-CD2 4.02Å; M165-F169 HydrophobicContact CE-CE1 4.15Å; M165-F169 HydrophobicContact CE-CE2 3.28Å; M165-F169 HydrophobicContact CE-CZ 3.36Å; M165-F169 HydrophobicContact CG-CD2 4.01Å; M165-F169 HydrophobicContact CG-CE2 3.69Å; M165-F169 VanDerWaalsContact O-CD2 3.25Å; M165-F169 WeakPolarHBondContact O-CD2 3.34Å; M165-F169 PolarHBondContact O-N 2.9Å; M165-F169 HydrophobicContact SD-CE2 4.32Å; T166-F169 PolarHBondContact O-N 3.02Å; F169-L171 PolarHBondContact O-N 2.73Å; F169-Q172 PolarHBondContact O-N 2.84Å; F169-I173 WeakPolarHBondContact O-CD1 3.38Å; F169-I173 VanDerWaalsContact O-CG1 3.26Å; F169-I173 WeakPolarHBondContact O-CG1 3.38Å; F169-I173 PolarHBondContact O-N 2.87Å; F169-F217 AromaticContact CD1-CE1 3.65Å; F169-F217 HydrophobicContact CD1-CE1 3.65Å; F169-F217 HydrophobicContact CD1-CE2 4.44Å; F169-F217 AromaticContact CD1-CZ 3.37Å; F169-F217 HydrophobicContact CD1-CZ 3.37Å; F169-F217 HydrophobicContact CD2-CE1 4.45Å; F169-F217 AromaticContact CE1-CE1 3.83Å; F169-F217 HydrophobicContact CE1-CE1 3.83Å; F169-F217 HydrophobicContact CE1-CE2 4.2Å; F169-F217 AromaticContact CE1-CZ 3.47Å; F169-F217 HydrophobicContact CE1-CZ 3.47Å; F169-F217 VanDerWaalsContact CE1-CZ 3.47Å; F169-F217 AromaticContact CG-CE1 3.98Å; F169-F217 HydrophobicContact CG-CE1 3.98Å; F169-F217 HydrophobicContact CG-CZ 4.15Å; F169-F217 HydrophobicContact CZ-CE1 4.32Å; F169-F217 HydrophobicContact CZ-CZ 4.34Å
170	V	97.1	Very high	93.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-56.9	-49.2	174.3	168.8	0	0	0	0	110.9	I128 I154 K158 T166 L167 Q172 I173 L174	I128-V170 HydrophobicContact CD1-CG2 3.79Å; I154-V170 HydrophobicContact CG2-CB 4.43Å; I154-V170 HydrophobicContact CG2-CG1 3.61Å; I154-V170 HydrophobicContact CG2-CG2 3.94Å; K158-V170 HydrophobicContact CD-CG1 4.42Å; K158-V170 HydrophobicContact CG-CG2 4.31Å; T166-V170 WeakPolarHBondContact O-CG2 3.45Å; T166-V170 PolarHBondContact O-N 3.37Å; L167-V170 WeakPolarHBondContact O-CB 3.35Å; L167-V170 PolarHBondContact O-N 3.45Å; V170-Q172 VanDerWaalsContact C-N 3.33Å; V170-Q172 PolarHBondContact O-N 2.91Å; V170-I173 PolarHBondContact O-N 3.41Å; V170-L174 HydrophobicContact CG1-CD1 3.69Å; V170-L174 HydrophobicContact CG1-CG 4.26Å; V170-L174 WeakPolarHBondContact O-CB 3.25Å; V170-L174 VanDerWaalsContact O-CG 3.23Å; V170-L174 WeakPolarHBondContact O-CG 3.48Å; V170-L174 PolarHBondContact O-N 2.99Å
171	L	97.1	Very high	92.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-45.2	177.6	-68.7	174	0	0	0	111.5	L167 S168 F169 L174 S175 N190 I191 I222 F225	L167-L171 VanDerWaalsContact O-CG 3.31Å; L167-L171 WeakPolarHBondContact O-CG 3.34Å; L167-L171 PolarHBondContact O-N 3.05Å; S168-L171 PolarHBondContact O-N 2.83Å; F169-L171 PolarHBondContact O-N 2.73Å; L171-L174 PolarHBondContact O-N 3.07Å; L171-S175 PolarHBondContact O-N 2.86Å; L171-N190 HydrophobicContact CD2-CB 4.13Å; L171-I191 HydrophobicContact CD1-CG1 4.11Å; L171-I191 HydrophobicContact CD2-CG1 3.99Å; L171-I222 HydrophobicContact CD1-CG1 4.12Å; L171-F225 HydrophobicContact CB-CB 4.03Å; L171-F225 HydrophobicContact CB-CD2 4.22Å; L171-F225 HydrophobicContact CB-CG 4.25Å; L171-F225 HydrophobicContact CD2-CB 4.14Å; L171-F225 HydrophobicContact CD2-CD1 3.79Å; L171-F225 HydrophobicContact CD2-CD2 3.51Å; L171-F225 HydrophobicContact CD2-CE1 4.01Å; L171-F225 HydrophobicContact CD2-CE2 3.72Å; L171-F225 HydrophobicContact CD2-CG 3.52Å; L171-F225 HydrophobicContact CD2-CZ 3.96Å; L171-F225 HydrophobicContact CG-CD2 4.47Å; L171-F225 HydrophobicContact CG-CG 4.44Å
172	Q	97	Very high	92.6	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-40.8	178.4	-170.8	68.6	84.7	0	0	112.3	F132 S168 F169 V170 S175 Q176 F217 D224	F132-Q172 HydrophobicContact CD2-CB 4.4Å; F132-Q172 HydrophobicContact CD2-CG 4.05Å; F132-Q172 HydrophobicContact CE2-CB 4.24Å; F132-Q172 HydrophobicContact CE2-CG 3.44Å; F132-Q172 VanDerWaalsContact CE2-CG 3.44Å; F132-Q172 HydrophobicContact CZ-CG 4.32Å; S168-Q172 WeakPolarHBondContact O-CB 3.03Å; S168-Q172 PolarHBondContact O-N 3.41Å; F169-Q172 PolarHBondContact O-N 2.84Å; V170-Q172 VanDerWaalsContact C-N 3.33Å; V170-Q172 PolarHBondContact O-N 2.91Å; Q172-S175 PolarHBondContact NE2-OG 2.9Å; Q172-S175 PolarHBondContact O-N 2.92Å; Q172-S175 PolarHBondContact O-OG 3.43Å; Q172-Q176 WeakPolarHBondContact O-CG 3.43Å; Q172-F217 HydrophobicContact CB-CZ 4.25Å; Q172-F217 HydrophobicContact CG-CZ 4.39Å; Q172-D224 PolarHBondContact NE2-OD2 2.84Å; Q172-D224 PolarHBondContact OE1-OD2 3.38Å
173	I	97.6	Very high	92.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-50	175.6	-69.1	160.5	0	0	0	110.2	I128 L131 F132 V135 V150 I154 F169 V170 S175 Q176 L177	I128-I173 HydrophobicContact CD1-CD1 3.86Å; L131-I173 HydrophobicContact CB-CD1 4.37Å; L131-I173 HydrophobicContact CD2-CD1 3.97Å; L131-I173 HydrophobicContact CG-CD1 3.92Å; F132-I173 HydrophobicContact CB-CD1 4.01Å; F132-I173 HydrophobicContact CB-CG1 4.04Å; F132-I173 HydrophobicContact CD2-CG1 4.15Å; V135-I173 HydrophobicContact CB-CG2 4.44Å; V135-I173 HydrophobicContact CG1-CG2 4.08Å; V135-I173 HydrophobicContact CG2-CG2 4.44Å; V150-I173 HydrophobicContact CG1-CG2 3.82Å; I154-I173 HydrophobicContact CD1-CB 4.42Å; I154-I173 HydrophobicContact CD1-CG2 3.9Å; F169-I173 WeakPolarHBondContact O-CD1 3.38Å; F169-I173 VanDerWaalsContact O-CG1 3.26Å; F169-I173 WeakPolarHBondContact O-CG1 3.38Å; F169-I173 PolarHBondContact O-N 2.87Å; V170-I173 PolarHBondContact O-N 3.41Å; I173-S175 PolarHBondContact O-N 2.62Å; I173-Q176 WeakPolarHBondContact O-CB 2.9Å; I173-Q176 PolarHBondContact O-N 2.89Å; I173-L177 HydrophobicContact CG2-CD1 4.28Å; I173-L177 HydrophobicContact CG2-CG 4.4Å; I173-L177 PolarHBondContact O-N 3.02Å
174	L	96.2	Very high	92.2	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-36.7	-178.4	-69.2	171.9	0	0	0	112	L151 I154 V170 L171 Q176 L177 L179 H187 F225	L151-L174 HydrophobicContact CD1-CD2 4.1Å; I154-L174 HydrophobicContact CD1-CD2 3.98Å; I154-L174 HydrophobicContact CD1-CG 4.26Å; V170-L174 HydrophobicContact CG1-CD1 3.69Å; V170-L174 HydrophobicContact CG1-CG 4.26Å; V170-L174 WeakPolarHBondContact O-CB 3.25Å; V170-L174 VanDerWaalsContact O-CG 3.23Å; V170-L174 WeakPolarHBondContact O-CG 3.48Å; V170-L174 PolarHBondContact O-N 2.99Å; L171-L174 PolarHBondContact O-N 3.07Å; L174-Q176 PolarHBondContact O-N 2.79Å; L174-Q176 VanDerWaalsContact O-N 3.17Å; L174-L177 HydrophobicContact CD2-CD1 4.29Å; L174-L177 PolarHBondContact O-N 3.3Å; L174-L179 HydrophobicContact CD2-CD1 3.94Å; L174-H187 HydrophobicContact CD1-CB 3.69Å; L174-H187 VanDerWaalsContact CD1-CG 3.42Å; L174-F225 HydrophobicContact CB-CD2 4.05Å; L174-F225 HydrophobicContact CB-CE2 4.01Å; L174-F225 HydrophobicContact CD1-CE2 3.88Å
175	S	94.8	Very high	92.1	Very high	25 Å²	25	35.3 Å²	35.3	18%	0.175	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-23.6	175.6	76.4	0	0	0	0	113.7	L171 Q172 I173	L171-S175 PolarHBondContact O-N 2.86Å; Q172-S175 PolarHBondContact NE2-OG 2.9Å; Q172-S175 PolarHBondContact O-N 2.92Å; Q172-S175 PolarHBondContact O-OG 3.43Å; I173-S175 PolarHBondContact O-N 2.62Å
176	Q	92.5	Very high	91.9	Very high	28 Å²	28	36.9 Å²	36.9	13%	0.131	21%	0.205	C	C	.	.	H	α-helix	trans	-93.7	-20.8	-176.9	-63	174.6	-7	0	0	113.7	S136 K139 Q172 I173 L174 R178	S136-Q176 PolarHBondContact OG-NE2 3.2Å; S136-Q176 PolarHBondContact OG-OE1 3.13Å; S136-Q176 VanDerWaalsContact OG-OE1 3.13Å; K139-Q176 WeakPolarHBondContact CE-O 3.48Å; K139-Q176 HydrophobicContact CG-CB 4.43Å; K139-Q176 PolarHBondContact NZ-O 2.75Å; Q172-Q176 WeakPolarHBondContact O-CG 3.43Å; I173-Q176 WeakPolarHBondContact O-CB 2.9Å; I173-Q176 PolarHBondContact O-N 2.89Å; L174-Q176 PolarHBondContact O-N 2.79Å; L174-Q176 VanDerWaalsContact O-N 3.17Å; Q176-R178 VanDerWaalsContact C-N 3.29Å; Q176-R178 PolarHBondContact O-N 2.92Å
177	L	92	Very high	91.7	Very high	19 Å²	19	37.3 Å²	37.3	10%	0.099	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-10.3	-172.7	-66.7	-178.8	0	0	0	114.3	V135 I145 A147 V150 I173 L174 L179	V135-L177 HydrophobicContact CG1-CD2 3.97Å; I145-L177 HydrophobicContact CB-CD2 4.46Å; I145-L177 HydrophobicContact CG2-CD2 3.57Å; A147-L177 HydrophobicContact CB-CB 4.43Å; A147-L177 HydrophobicContact CB-CD1 4.42Å; A147-L177 HydrophobicContact CB-CD2 4.49Å; V150-L177 HydrophobicContact CB-CD1 4.24Å; V150-L177 HydrophobicContact CG1-CD1 3.87Å; V150-L177 HydrophobicContact CG1-CD2 4.41Å; I173-L177 HydrophobicContact CG2-CD1 4.28Å; I173-L177 HydrophobicContact CG2-CG 4.4Å; I173-L177 PolarHBondContact O-N 3.02Å; L174-L177 HydrophobicContact CD2-CD1 4.29Å; L174-L177 PolarHBondContact O-N 3.3Å; L177-L179 HydrophobicContact CB-CD1 4.14Å; L177-L179 HydrophobicContact CB-CG 3.82Å; L177-L179 HydrophobicContact CD1-CD1 4.03Å; L177-L179 PolarHBondContact O-N 2.84Å
178	R	86.3	Confident	91.5	Very high	211 Å²	211	38.1 Å²	38.1	80%	0.796	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	40	-176.6	-59.4	-179.5	177.8	162.6	-0.8	112.6	Q176	Q176-R178 VanDerWaalsContact C-N 3.29Å; Q176-R178 PolarHBondContact O-N 2.92Å
179	L	88.3	Confident	91.2	Very high	27 Å²	27	41.1 Å²	41.1	14%	0.141	23%	0.232	C	C	.	.			trans	-69.4	158	176.3	-71.2	172.4	0	0	0	111	A147 L174 L177 N183 I184	A147-L179 HydrophobicContact CB-CD2 3.69Å; L174-L179 HydrophobicContact CD2-CD1 3.94Å; L177-L179 HydrophobicContact CB-CD1 4.14Å; L177-L179 HydrophobicContact CB-CG 3.82Å; L177-L179 HydrophobicContact CD1-CD1 4.03Å; L177-L179 PolarHBondContact O-N 2.84Å; L179-N183 HydrophobicContact CB-CB 4.19Å; L179-N183 HydrophobicContact CD2-CB 4.4Å; L179-I184 HydrophobicContact CB-CD1 3.82Å; L179-I184 HydrophobicContact CB-CG1 3.62Å; L179-I184 HydrophobicContact CD1-CG1 4.34Å
180	T	87.1	Confident	91	Very high	79 Å²	79	41 Å²	41	49%	0.485	23%	0.232	S	C	.	.			trans	-73	156.9	172.6	72.7	0	0	0	0	110.9	S182 N183 I184	T180-S182 PolarHBondContact O-N 3Å; T180-S182 PolarHBondContact OG1-OG 2.87Å; T180-N183 PolarHBondContact O-N 2.94Å; T180-N183 PolarHBondContact OG1-OD1 2.94Å; T180-I184 PolarHBondContact O-N 2.9Å
181	K	85.9	Confident	90.9	Very high	93 Å²	93	41 Å²	41	40%	0.404	23%	0.232	S	C	.	.	H	α-helix	trans	-55	-36.9	179.6	-168.9	-178.4	179.4	-163.9	0	113	N183 I184 S185 Y229 E231	K181-N183 VanDerWaalsContact C-N 3.3Å; K181-N183 PolarHBondContact O-N 3.13Å; K181-I184 PolarHBondContact O-N 2.96Å; K181-S185 WeakPolarHBondContact O-CB 3.47Å; K181-S185 PolarHBondContact O-N 3.23Å; K181-Y229 HydrophobicContact CD-CE2 4.3Å; K181-Y229 WeakPolarHBondContact CE-OH 3.12Å; K181-Y229 HydrophobicContact CG-CD2 3.96Å; K181-Y229 HydrophobicContact CG-CE2 3.56Å; K181-E231 WeakPolarHBondContact CE-OE2 3.47Å; K181-E231 IonicContact NZ-OE1 2.57Å; K181-E231 PolarHBondContact NZ-OE1 3.19Å; K181-E231 IonicContact NZ-OE2 3.07Å; K181-E231 PolarHBondContact NZ-OE2 2.8Å
182	S	84.9	Confident	90.6	Very high	95 Å²	95	42.8 Å²	42.8	66%	0.664	24%	0.242	S	C	*	.	H	α-helix	trans	-65.3	-30.1	177.4	47.9	0	0	0	0	113.5	T180 S185	T180-S182 PolarHBondContact O-N 3Å; T180-S182 PolarHBondContact OG1-OG 2.87Å; S182-S185 PolarHBondContact O-OG 3.36Å
183	N	85.2	Confident	90.4	Very high	69 Å²	69	45.6 Å²	45.6	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-80.7	-25.2	175.6	-65.4	108.6	0	0	0	112.4	L179 T180 K181	L179-N183 HydrophobicContact CB-CB 4.19Å; L179-N183 HydrophobicContact CD2-CB 4.4Å; T180-N183 PolarHBondContact O-N 2.94Å; T180-N183 PolarHBondContact OG1-OD1 2.94Å; K181-N183 VanDerWaalsContact C-N 3.3Å; K181-N183 PolarHBondContact O-N 3.13Å
184	I	86.6	Confident	90.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-91.7	-28.3	-177	-60.8	175.2	0	0	0	112.1	L179 T180 K181 G186 H187 F225 Y229	L179-I184 HydrophobicContact CB-CD1 3.82Å; L179-I184 HydrophobicContact CB-CG1 3.62Å; L179-I184 HydrophobicContact CD1-CG1 4.34Å; T180-I184 PolarHBondContact O-N 2.9Å; K181-I184 PolarHBondContact O-N 2.96Å; I184-G186 VanDerWaalsContact C-N 3.26Å; I184-G186 PolarHBondContact O-N 2.8Å; I184-G186 VanDerWaalsContact O-N 3.13Å; I184-H187 WeakPolarHBondContact O-CB 3.41Å; I184-H187 PolarHBondContact O-N 2.93Å; I184-F225 HydrophobicContact CG2-CD2 4.38Å; I184-F225 HydrophobicContact CG2-CE1 4.18Å; I184-F225 HydrophobicContact CG2-CE2 3.4Å; I184-F225 VanDerWaalsContact CG2-CE2 3.4Å; I184-F225 HydrophobicContact CG2-CZ 3.28Å; I184-Y229 HydrophobicContact CB-CD2 4.2Å; I184-Y229 HydrophobicContact CG2-CD2 3.82Å; I184-Y229 HydrophobicContact CG2-CG 4.42Å
185	S	88	Confident	90.2	Very high	55 Å²	55	45.7 Å²	45.7	39%	0.385	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-54.2	-37.5	-172	58.9	0	0	0	0	114.1	K181 S182 H187 V188	K181-S185 WeakPolarHBondContact O-CB 3.47Å; K181-S185 PolarHBondContact O-N 3.23Å; S182-S185 PolarHBondContact O-OG 3.36Å; S185-H187 PolarHBondContact O-N 2.82Å; S185-H187 VanDerWaalsContact O-N 3.11Å; S185-V188 WeakPolarHBondContact O-CG2 3.35Å; S185-V188 PolarHBondContact O-N 2.93Å
186	G	87.6	Confident	90	Very high	54 Å²	54	50.7 Å²	50.7	56%	0.557	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-65.2	-10.4	176.1	0	0	0	0	0	115	I184	I184-G186 VanDerWaalsContact C-N 3.26Å; I184-G186 PolarHBondContact O-N 2.8Å; I184-G186 VanDerWaalsContact O-N 3.13Å
187	H	91	Very high	90	Very high	13 Å²	13	55 Å²	55	6%	0.06	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-101.5	-4.1	178.7	-63.6	-87.2	0	0	0	113.6	L151 L174 I184 S185 S189 N190 F225	L151-H187 WeakPolarHBondContact CD1-NE2 3.49Å; L174-H187 HydrophobicContact CD1-CB 3.69Å; L174-H187 VanDerWaalsContact CD1-CG 3.42Å; I184-H187 WeakPolarHBondContact O-CB 3.41Å; I184-H187 PolarHBondContact O-N 2.93Å; S185-H187 PolarHBondContact O-N 2.82Å; S185-H187 VanDerWaalsContact O-N 3.11Å; H187-S189 VanDerWaalsContact C-N 3.26Å; H187-S189 PolarHBondContact O-N 3.27Å; H187-N190 PolarHBondContact ND1-ND2 3.31Å; H187-N190 WeakPolarHBondContact O-CB 3.2Å; H187-N190 PolarHBondContact O-N 2.85Å; H187-F225 HydrophobicContact CB-CE2 4.06Å; H187-F225 HydrophobicContact CB-CZ 3.86Å
188	V	91.8	Very high	90	Very high	19 Å²	19	54.8 Å²	54.8	12%	0.115	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-37.2	178.3	176.7	0	0	0	0	111.3	S185 N190 I191 F225 Y229 P233	S185-V188 WeakPolarHBondContact O-CG2 3.35Å; S185-V188 PolarHBondContact O-N 2.93Å; V188-N190 PolarHBondContact O-N 3.4Å; V188-N190 VanDerWaalsContact O-N 3.15Å; V188-I191 VanDerWaalsContact O-CB 3.3Å; V188-I191 WeakPolarHBondContact O-CB 3.19Å; V188-I191 WeakPolarHBondContact O-CG1 3.32Å; V188-I191 PolarHBondContact O-N 3.19Å; V188-F225 HydrophobicContact CG2-CE1 4.25Å; V188-Y229 HydrophobicContact CG2-CD1 3.91Å; V188-Y229 HydrophobicContact CG2-CD2 4.07Å; V188-Y229 HydrophobicContact CG2-CE1 3.61Å; V188-Y229 HydrophobicContact CG2-CE2 3.79Å; V188-Y229 HydrophobicContact CG2-CG 4.15Å; V188-P233 HydrophobicContact CG1-CG 3.6Å
189	S	90.8	Very high	90.4	Very high	62 Å²	62	46.6 Å²	46.6	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-20.7	175.7	58.2	0	0	0	0	113.8	H187 I191 D192 N193	H187-S189 VanDerWaalsContact C-N 3.26Å; H187-S189 PolarHBondContact O-N 3.27Å; S189-I191 PolarHBondContact O-N 2.71Å; S189-D192 PolarHBondContact O-N 3.19Å; S189-N193 PolarHBondContact O-N 2.82Å; S189-N193 VanDerWaalsContact O-N 3.09Å
190	N	93.2	Very high	90.4	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-30.1	172.9	-66.7	-18.1	0	0	0	111.3	K158 L167 L171 H187 V188 V194	K158-N190 WeakPolarHBondContact CE-OD1 3.39Å; K158-N190 PolarHBondContact NZ-ND2 2.97Å; K158-N190 PolarHBondContact NZ-OD1 2.64Å; L167-N190 HydrophobicContact CD2-CB 4.36Å; L171-N190 HydrophobicContact CD2-CB 4.13Å; H187-N190 PolarHBondContact ND1-ND2 3.31Å; H187-N190 WeakPolarHBondContact O-CB 3.2Å; H187-N190 PolarHBondContact O-N 2.85Å; V188-N190 PolarHBondContact O-N 3.4Å; V188-N190 VanDerWaalsContact O-N 3.15Å; N190-V194 WeakPolarHBondContact O-CB 3.45Å; N190-V194 WeakPolarHBondContact O-CG2 3.48Å; N190-V194 PolarHBondContact O-N 3.46Å
191	I	94.9	Very high	90.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-48.4	177.4	-55.1	175	0	0	0	109.6	L171 V188 S189 N193 V194 L195 I222 F225 L226 V236	L171-I191 HydrophobicContact CD1-CG1 4.11Å; L171-I191 HydrophobicContact CD2-CG1 3.99Å; V188-I191 VanDerWaalsContact O-CB 3.3Å; V188-I191 WeakPolarHBondContact O-CB 3.19Å; V188-I191 WeakPolarHBondContact O-CG1 3.32Å; V188-I191 PolarHBondContact O-N 3.19Å; S189-I191 PolarHBondContact O-N 2.71Å; I191-N193 VanDerWaalsContact C-N 3.34Å; I191-N193 PolarHBondContact O-N 2.85Å; I191-V194 PolarHBondContact O-N 3.08Å; I191-L195 HydrophobicContact CG2-CD1 3.68Å; I191-L195 HydrophobicContact CG2-CG 4.26Å; I191-L195 WeakPolarHBondContact O-CB 3.22Å; I191-L195 VanDerWaalsContact O-CG 3.26Å; I191-L195 WeakPolarHBondContact O-CG 3.28Å; I191-L195 PolarHBondContact O-N 3.04Å; I191-I222 HydrophobicContact CG2-CD1 4.24Å; I191-I222 HydrophobicContact CG2-CG1 4.16Å; I191-I222 HydrophobicContact CG2-CG2 3.84Å; I191-F225 HydrophobicContact CD1-CD1 3.6Å; I191-F225 HydrophobicContact CD1-CE1 3.77Å; I191-F225 HydrophobicContact CG1-CD1 4.11Å; I191-F225 HydrophobicContact CG1-CE1 4.24Å; I191-L226 HydrophobicContact CD1-CD2 3.53Å; I191-L226 HydrophobicContact CD1-CG 4.07Å; I191-V236 HydrophobicContact CB-CG2 4.43Å; I191-V236 HydrophobicContact CG2-CG1 4.1Å; I191-V236 HydrophobicContact CG2-CG2 3.61Å
192	D	91.7	Very high	89.5	Confident	39 Å²	39	49 Å²	49	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-46.5	178.3	-65.3	-50.6	0	0	0	110.6	S189 V194 L195 E196 S235	S189-D192 PolarHBondContact O-N 3.19Å; D192-V194 VanDerWaalsContact C-N 3.35Å; D192-V194 PolarHBondContact O-N 3.46Å; D192-L195 PolarHBondContact O-N 3.28Å; D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 VanDerWaalsContact O-CG 3.31Å; D192-E196 WeakPolarHBondContact O-CG 3.29Å; D192-E196 PolarHBondContact O-N 3.06Å; D192-S235 WeakPolarHBondContact OD1-CB 3.31Å; D192-S235 PolarHBondContact OD1-OG 3.19Å
193	N	91.6	Very high	89.2	Confident	64 Å²	64	50.6 Å²	50.6	34%	0.342	29%	0.293	S	S	.	.	H	α-helix	trans	-56.6	-46.7	175.6	-71.5	-15.7	0	0	0	112	L167 S189 I191 L195 E196 H197	L167-N193 HydrophobicContact CD1-CB 3.79Å; S189-N193 PolarHBondContact O-N 2.82Å; S189-N193 VanDerWaalsContact O-N 3.09Å; I191-N193 VanDerWaalsContact C-N 3.34Å; I191-N193 PolarHBondContact O-N 2.85Å; N193-L195 PolarHBondContact O-N 2.82Å; N193-E196 PolarHBondContact O-N 3.18Å; N193-H197 PolarHBondContact O-N 3.43Å; N193-H197 PolarHBondContact O-ND1 3.46Å
194	V	94.8	Very high	89.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-48.3	178.4	168.6	0	0	0	0	110.2	P164 L167 N190 I191 D192 E196 H197 Y208 V218 I222	P164-V194 HydrophobicContact CB-CG1 4.45Å; L167-V194 HydrophobicContact CB-CG2 3.34Å; L167-V194 HydrophobicContact CD1-CG2 3.95Å; L167-V194 HydrophobicContact CG-CG2 4.3Å; N190-V194 WeakPolarHBondContact O-CB 3.45Å; N190-V194 WeakPolarHBondContact O-CG2 3.48Å; N190-V194 PolarHBondContact O-N 3.46Å; I191-V194 PolarHBondContact O-N 3.08Å; D192-V194 VanDerWaalsContact C-N 3.35Å; D192-V194 PolarHBondContact O-N 3.46Å; V194-E196 PolarHBondContact O-N 2.82Å; V194-H197 PolarHBondContact O-N 2.97Å; V194-Y208 VanDerWaalsContact C-OH 3.24Å; V194-Y208 WeakPolarHBondContact CG1-OH 3.46Å; V194-Y208 PolarHBondContact O-OH 3.13Å; V194-V218 HydrophobicContact CG1-CG1 3.39Å; V194-I222 HydrophobicContact CG1-CD1 4.27Å
195	L	94.4	Very high	89.5	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-69.3	-28	-176.7	-69.7	173.3	0	0	0	113.8	I191 D192 N193 H197 A198 I222 V236 K239 L243	I191-L195 HydrophobicContact CG2-CD1 3.68Å; I191-L195 HydrophobicContact CG2-CG 4.26Å; I191-L195 WeakPolarHBondContact O-CB 3.22Å; I191-L195 VanDerWaalsContact O-CG 3.26Å; I191-L195 WeakPolarHBondContact O-CG 3.28Å; I191-L195 PolarHBondContact O-N 3.04Å; D192-L195 PolarHBondContact O-N 3.28Å; N193-L195 PolarHBondContact O-N 2.82Å; L195-H197 VanDerWaalsContact C-N 3.32Å; L195-A198 PolarHBondContact O-N 2.87Å; L195-I222 HydrophobicContact CD1-CD1 4.46Å; L195-I222 HydrophobicContact CD2-CD1 3.64Å; L195-I222 HydrophobicContact CG-CD1 3.93Å; L195-V236 HydrophobicContact CD1-CB 4.27Å; L195-V236 HydrophobicContact CD1-CG1 3.96Å; L195-V236 HydrophobicContact CD1-CG2 4.08Å; L195-K239 HydrophobicContact CB-CB 4.45Å; L195-K239 HydrophobicContact CB-CD 3.67Å; L195-K239 HydrophobicContact CD1-CB 4.04Å; L195-K239 HydrophobicContact CD1-CD 4.24Å; L195-K239 HydrophobicContact CD2-CB 4.06Å; L195-K239 HydrophobicContact CG-CB 4.43Å; L195-K239 HydrophobicContact CG-CD 4.44Å; L195-L243 HydrophobicContact CD2-CD1 3.55Å; L195-L243 HydrophobicContact CD2-CG 4.36Å
196	E	91.4	Very high	89.9	Confident	130 Å²	130	48.5 Å²	48.5	61%	0.607	27%	0.274	S	S	*	.	H	α-helix	trans	-72.2	-23.7	175.6	-76.9	179.8	173.8	0	0	113.6	D192 N193 V194 A198	D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 VanDerWaalsContact O-CG 3.31Å; D192-E196 WeakPolarHBondContact O-CG 3.29Å; D192-E196 PolarHBondContact O-N 3.06Å; N193-E196 PolarHBondContact O-N 3.18Å; V194-E196 PolarHBondContact O-N 2.82Å; E196-A198 VanDerWaalsContact C-N 3.33Å
197	H	91.6	Very high	90.2	Very high	118 Å²	118	47.9 Å²	47.9	55%	0.546	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	6.5	176.4	-69	85.1	0	0	0	113.3	P164 N193 V194 L195	P164-H197 HydrophobicContact CG-CB 3.46Å; P164-H197 VanDerWaalsContact CG-CB 3.46Å; N193-H197 PolarHBondContact O-N 3.43Å; N193-H197 PolarHBondContact O-ND1 3.46Å; V194-H197 PolarHBondContact O-N 2.97Å; L195-H197 VanDerWaalsContact C-N 3.32Å
198	A	93.9	Very high	90.4	Very high	16 Å²	16	47.9 Å²	47.9	13%	0.132	26%	0.256	C	S	.	.			trans	-79	138.6	174.4	0	0	0	0	0	110.5	L195 E196 L206 Y208	L195-A198 PolarHBondContact O-N 2.87Å; E196-A198 VanDerWaalsContact C-N 3.33Å; A198-L206 HydrophobicContact CB-CB 4.07Å; A198-L206 HydrophobicContact CB-CD1 4.4Å; A198-L206 HydrophobicContact CB-CD2 4.15Å; A198-L206 HydrophobicContact CB-CG 4.43Å; A198-Y208 HydrophobicContact CB-CE1 4.04Å; A198-Y208 HydrophobicContact CB-CE2 4.23Å
199	S	92.9	Very high	90.1	Very high	38 Å²	38	55 Å²	55	27%	0.266	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	147.6	172.1	-55.6	0	0	0	0	110.3	L206 F207	S199-L206 CarbonylContact O-C 3.58Å; S199-L206 VanDerWaalsContact O-CA 3.32Å; S199-L206 WeakPolarHBondContact O-CA 3.05Å; S199-F207 VanDerWaalsContact CB-CE1 3.45Å; S199-F207 PolarHBondContact N-O 2.79Å; S199-F207 VanDerWaalsContact O-CD1 3.25Å; S199-F207 WeakPolarHBondContact O-CD1 3.03Å; S199-F207 PolarHBondContact O-N 3.13Å
200	E	90.2	Very high	89.8	Confident	94 Å²	94	59.6 Å²	59.6	44%	0.439	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	142.7	-175.7	-174.1	155.6	-152.2	0	0	113	D203 R205 L206 K242	E200-D203 WeakPolarHBondContact OE1-CA 3.32Å; E200-R205 WeakPolarHBondContact CA-O 3.49Å; E200-L206 HydrophobicContact CB-CD2 3.75Å; E200-L206 HydrophobicContact CG-CD2 4.11Å; E200-K242 IonicContact OE1-NZ 2.73Å; E200-K242 PolarHBondContact OE1-NZ 3.2Å
201	I	80.9	Confident	89.6	Confident	65 Å²	65	60.6 Å²	60.6	33%	0.333	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.3	173	-53.4	177.9	0	0	0	109	D203 N204 R205 F207	I201-D203 PolarHBondContact O-N 3.34Å; I201-N204 PolarHBondContact O-N 3.48Å; I201-R205 HydrophobicContact CB-CB 4.27Å; I201-R205 PolarHBondContact N-O 3.3Å; I201-R205 PolarHBondContact O-N 2.84Å; I201-F207 HydrophobicContact CD1-CD1 3.71Å; I201-F207 HydrophobicContact CD1-CE1 3.45Å; I201-F207 VanDerWaalsContact CD1-CE1 3.45Å; I201-F207 HydrophobicContact CD1-CZ 4.04Å; I201-F207 HydrophobicContact CG1-CD1 3.74Å; I201-F207 HydrophobicContact CG1-CE1 3.33Å; I201-F207 HydrophobicContact CG1-CZ 4.24Å
202	S	71.4	Confident	89.5	Confident	92 Å²	92	61.9 Å²	61.9	64%	0.643	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	37	170.2	-54.6	0	0	0	0	114.5	N204	S202-N204 PolarHBondContact O-N 3.44Å
203	D	79.5	Confident	89.7	Confident	127 Å²	127	62.4 Å²	62.4	68%	0.679	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-3.1	178.6	-57.9	-31.6	0	0	0	117.4	E200 I201 K242	E200-D203 WeakPolarHBondContact OE1-CA 3.32Å; I201-D203 PolarHBondContact O-N 3.34Å; D203-K242 WeakPolarHBondContact O-CE 3.25Å; D203-K242 PolarHBondContact O-NZ 2.97Å
204	N	86.7	Confident	89.8	Confident	26 Å²	26	59.9 Å²	59.9	14%	0.139	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	0.7	-173.6	68.6	14.7	0	0	0	114.2	T26 I201 S202 K242 N245 P295	T26-N204 HydrophobicContact CG2-CB 3.7Å; I201-N204 PolarHBondContact O-N 3.48Å; S202-N204 PolarHBondContact O-N 3.44Å; N204-K242 WeakPolarHBondContact O-CA 3.47Å; N204-N245 VanDerWaalsContact O-CB 3.3Å; N204-N245 WeakPolarHBondContact O-CB 3.41Å; N204-N245 PolarHBondContact O-ND2 3.03Å; N204-P295 WeakPolarHBondContact ND2-CG 3.33Å
205	R	91.9	Very high	89.9	Confident	47 Å²	47	59.9 Å²	59.9	18%	0.177	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.7	-176.9	-71.7	156.6	-163.7	-175.3	1.4	111.2	E200 I201 K242 N245 S293	E200-R205 WeakPolarHBondContact CA-O 3.49Å; I201-R205 HydrophobicContact CB-CB 4.27Å; I201-R205 PolarHBondContact N-O 3.3Å; I201-R205 PolarHBondContact O-N 2.84Å; R205-K242 WeakPolarHBondContact CA-O 3.46Å; R205-N245 HydrophobicContact CG-CB 3.98Å; R205-S293 PolarHBondContact NH2-O 3.48Å
206	L	94.9	Very high	90.1	Very high	9 Å²	9	59.8 Å²	59.8	5%	0.047	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142.1	170.3	-72.7	178.3	0	0	0	109.5	A198 S199 E200 K239 K242 L243 Y246	A198-L206 HydrophobicContact CB-CB 4.07Å; A198-L206 HydrophobicContact CB-CD1 4.4Å; A198-L206 HydrophobicContact CB-CD2 4.15Å; A198-L206 HydrophobicContact CB-CG 4.43Å; S199-L206 CarbonylContact O-C 3.58Å; S199-L206 VanDerWaalsContact O-CA 3.32Å; S199-L206 WeakPolarHBondContact O-CA 3.05Å; E200-L206 HydrophobicContact CB-CD2 3.75Å; E200-L206 HydrophobicContact CG-CD2 4.11Å; L206-K239 HydrophobicContact CD1-CB 3.69Å; L206-K239 HydrophobicContact CD1-CD 4.36Å; L206-K239 HydrophobicContact CD1-CG 3.94Å; L206-K242 HydrophobicContact CB-CB 3.97Å; L206-K242 HydrophobicContact CD1-CB 4.01Å; L206-K242 HydrophobicContact CD1-CD 4.18Å; L206-K242 HydrophobicContact CG-CB 3.68Å; L206-K242 HydrophobicContact CG-CD 3.95Å; L206-K242 HydrophobicContact CG-CG 4.47Å; L206-K242 PolarHBondContact N-O 2.95Å; L206-K242 VanDerWaalsContact N-O 3.07Å; L206-L243 HydrophobicContact CB-CD2 3.96Å; L206-L243 HydrophobicContact CB-CG 4.21Å; L206-Y246 WeakPolarHBondContact O-CB 3.38Å
207	F	94.9	Very high	90.4	Very high	40 Å²	40	53.6 Å²	53.6	18%	0.175	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	168.7	-179.9	76.5	-73.5	0	0	0	111.9	S199 I201 T215 Y246	S199-F207 VanDerWaalsContact CB-CE1 3.45Å; S199-F207 PolarHBondContact N-O 2.79Å; S199-F207 VanDerWaalsContact O-CD1 3.25Å; S199-F207 WeakPolarHBondContact O-CD1 3.03Å; S199-F207 PolarHBondContact O-N 3.13Å; I201-F207 HydrophobicContact CD1-CD1 3.71Å; I201-F207 HydrophobicContact CD1-CE1 3.45Å; I201-F207 VanDerWaalsContact CD1-CE1 3.45Å; I201-F207 HydrophobicContact CD1-CZ 4.04Å; I201-F207 HydrophobicContact CG1-CD1 3.74Å; I201-F207 HydrophobicContact CG1-CE1 3.33Å; I201-F207 HydrophobicContact CG1-CZ 4.24Å; F207-T215 HydrophobicContact CB-CG2 4.34Å; F207-Y246 HydrophobicContact CB-CD1 3.74Å; F207-Y246 HydrophobicContact CB-CD2 3.6Å; F207-Y246 HydrophobicContact CB-CE1 3.78Å; F207-Y246 HydrophobicContact CB-CE2 3.65Å; F207-Y246 HydrophobicContact CB-CG 3.63Å; F207-Y246 HydrophobicContact CD2-CE2 4.29Å; F207-Y246 HydrophobicContact CG-CD2 4.17Å; F207-Y246 AromaticContact CG-CE2 3.97Å; F207-Y246 HydrophobicContact CG-CE2 3.97Å
208	Y	94.3	Very high	90.6	Very high	13 Å²	13	48 Å²	48	5%	0.051	25%	0.248	C	C	.	.			trans	-114.5	139.2	172.3	-63.6	-88.2	0	0	0	111	P164 V194 A198 K210 G211 T214 T215 V218 L243	P164-Y208 HydrophobicContact CB-CD1 4.14Å; P164-Y208 HydrophobicContact CB-CE1 3.62Å; P164-Y208 HydrophobicContact CG-CD1 4.47Å; P164-Y208 HydrophobicContact CG-CE1 4.03Å; V194-Y208 VanDerWaalsContact C-OH 3.24Å; V194-Y208 WeakPolarHBondContact CG1-OH 3.46Å; V194-Y208 PolarHBondContact O-OH 3.13Å; A198-Y208 HydrophobicContact CB-CE1 4.04Å; A198-Y208 HydrophobicContact CB-CE2 4.23Å; Y208-K210 PolarHBondContact O-N 2.69Å; Y208-K210 VanDerWaalsContact O-N 3.13Å; Y208-G211 PolarHBondContact O-N 2.97Å; Y208-T214 HydrophobicContact CG-CG2 4.33Å; Y208-T215 HydrophobicContact CD2-CG2 4.34Å; Y208-T215 PolarHBondContact N-OG1 2.78Å; Y208-V218 HydrophobicContact CD2-CB 4.36Å; Y208-V218 HydrophobicContact CD2-CG2 3.96Å; Y208-V218 HydrophobicContact CE2-CB 3.8Å; Y208-V218 HydrophobicContact CE2-CG1 3.58Å; Y208-V218 HydrophobicContact CE2-CG2 3.67Å; Y208-L243 HydrophobicContact CE2-CD2 4.06Å
209	E	86.3	Confident	90.8	Very high	170 Å²	170	47.2 Å²	47.2	79%	0.794	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26	-177.1	-62.5	-171.5	160	0	0	113.7	G211	E209-G211 PolarHBondContact O-N 3.07Å
210	K	84.6	Confident	91.1	Very high	158 Å²	158	47 Å²	47	69%	0.687	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	0.8	172.5	-67.3	-171.1	178	-177.1	0	113.6	Y208 T214	Y208-K210 PolarHBondContact O-N 2.69Å; Y208-K210 VanDerWaalsContact O-N 3.13Å; K210-T214 HydrophobicContact CB-CG2 4.07Å; K210-T214 VanDerWaalsContact CB-OG1 3.25Å; K210-T214 WeakPolarHBondContact CB-OG1 3.48Å; K210-T214 PolarHBondContact O-OG1 3.09Å
211	G	88.2	Confident	91.4	Very high	24 Å²	24	42.5 Å²	42.5	25%	0.247	22%	0.216	C	C	.	.			trans	99.9	-171.7	166.9	0	0	0	0	0	115.1	Y208 E209 Y213 T214 T215	Y208-G211 PolarHBondContact O-N 2.97Å; E209-G211 PolarHBondContact O-N 3.07Å; G211-Y213 PolarHBondContact O-N 2.85Å; G211-T214 PolarHBondContact O-N 3.02Å; G211-T215 PolarHBondContact O-N 2.91Å; G211-T215 VanDerWaalsContact O-N 3.16Å; G211-T215 PolarHBondContact O-OG1 3.46Å; G211-T215 VanDerWaalsContact O-OG1 3.05Å
212	L	93.9	Very high	92.2	Very high	26 Å²	26	39.4 Å²	39.4	14%	0.136	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-44.5	-172	-178.9	58	0	0	0	112.8	T214 T215 S216 Y246 L247 R250 T253 A258 L262	L212-T214 VanDerWaalsContact C-N 3.35Å; L212-T214 PolarHBondContact O-N 3.49Å; L212-T215 PolarHBondContact O-N 3.06Å; L212-S216 WeakPolarHBondContact O-CB 3.47Å; L212-S216 PolarHBondContact O-N 3.14Å; L212-S216 PolarHBondContact O-OG 2.99Å; L212-Y246 HydrophobicContact CD1-CE1 3.92Å; L212-L247 HydrophobicContact CD1-CD2 3.6Å; L212-R250 HydrophobicContact CD1-CB 3.77Å; L212-R250 HydrophobicContact CD1-CG 4.05Å; L212-R250 HydrophobicContact CD2-CB 3.72Å; L212-R250 HydrophobicContact CD2-CG 4.43Å; L212-R250 HydrophobicContact CG-CB 4.37Å; L212-T253 HydrophobicContact CD2-CG2 3.61Å; L212-A258 HydrophobicContact CB-CB 4.16Å; L212-A258 HydrophobicContact CD2-CB 3.9Å; L212-A258 HydrophobicContact CG-CB 4.03Å; L212-L262 HydrophobicContact CD1-CD1 4.23Å; L212-L262 HydrophobicContact CD2-CD1 4.17Å
213	Y	94.9	Very high	93.5	Very high	50 Å²	50	35 Å²	35	20%	0.196	17%	0.169	C	C	.	.	H	α-helix	trans	-54.5	-50.6	178.2	167.4	-100.1	0	0	0	111.9	M165 G211 T215 S216 F217 R257 Y261	M165-Y213 HydrophobicContact CE-CE1 4.21Å; G211-Y213 PolarHBondContact O-N 2.85Å; Y213-T215 VanDerWaalsContact C-N 3.33Å; Y213-T215 PolarHBondContact O-N 3.27Å; Y213-S216 PolarHBondContact O-N 2.85Å; Y213-F217 WeakPolarHBondContact O-CB 3.5Å; Y213-F217 PolarHBondContact O-N 3.47Å; Y213-R257 HydrophobicContact CD2-CG 3.47Å; Y213-R257 VanDerWaalsContact CD2-CG 3.47Å; Y213-R257 HydrophobicContact CE2-CG 3.79Å; Y213-R257 HydrophobicContact CG-CG 4.19Å; Y213-Y261 AromaticContact CD2-CD2 3.75Å; Y213-Y261 HydrophobicContact CD2-CD2 3.75Å; Y213-Y261 HydrophobicContact CD2-CE2 4.31Å; Y213-Y261 HydrophobicContact CD2-CG 4.14Å; Y213-Y261 AromaticContact CE2-CD2 3.36Å; Y213-Y261 HydrophobicContact CE2-CD2 3.36Å; Y213-Y261 AromaticContact CE2-CE2 3.47Å; Y213-Y261 HydrophobicContact CE2-CE2 3.47Å; Y213-Y261 VanDerWaalsContact CE2-CE2 3.47Å; Y213-Y261 AromaticContact CE2-CG 3.92Å; Y213-Y261 HydrophobicContact CE2-CG 3.92Å
214	T	94.3	Very high	94.3	Very high	12 Å²	12	30.7 Å²	30.7	7%	0.074	15%	0.146	C	C	.	.	H	α-helix	trans	-60.3	-45.3	-179.7	-55.8	0	0	0	0	110.8	M165 Y208 K210 G211 L212 F217 V218	M165-T214 HydrophobicContact SD-CG2 3.87Å; Y208-T214 HydrophobicContact CG-CG2 4.33Å; K210-T214 HydrophobicContact CB-CG2 4.07Å; K210-T214 VanDerWaalsContact CB-OG1 3.25Å; K210-T214 WeakPolarHBondContact CB-OG1 3.48Å; K210-T214 PolarHBondContact O-OG1 3.09Å; G211-T214 PolarHBondContact O-N 3.02Å; L212-T214 VanDerWaalsContact C-N 3.35Å; L212-T214 PolarHBondContact O-N 3.49Å; T214-F217 PolarHBondContact O-N 3Å; T214-V218 HydrophobicContact CG2-CG2 4.36Å; T214-V218 WeakPolarHBondContact O-CB 3.1Å; T214-V218 WeakPolarHBondContact O-CG2 3.33Å; T214-V218 PolarHBondContact O-N 3.32Å
215	T	96.9	Very high	94.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-42.4	179.8	-49.4	0	0	0	0	111.9	F207 Y208 G211 L212 Y213 A219 L243 Y246 L247	F207-T215 HydrophobicContact CB-CG2 4.34Å; Y208-T215 HydrophobicContact CD2-CG2 4.34Å; Y208-T215 PolarHBondContact N-OG1 2.78Å; G211-T215 PolarHBondContact O-N 2.91Å; G211-T215 VanDerWaalsContact O-N 3.16Å; G211-T215 PolarHBondContact O-OG1 3.46Å; G211-T215 VanDerWaalsContact O-OG1 3.05Å; L212-T215 PolarHBondContact O-N 3.06Å; Y213-T215 VanDerWaalsContact C-N 3.33Å; Y213-T215 PolarHBondContact O-N 3.27Å; T215-A219 WeakPolarHBondContact O-CB 3.35Å; T215-A219 PolarHBondContact O-N 2.96Å; T215-L243 HydrophobicContact CG2-CD2 3.81Å; T215-Y246 HydrophobicContact CG2-CD1 3.6Å; T215-Y246 HydrophobicContact CG2-CE1 3.97Å; T215-L247 HydrophobicContact CG2-CD2 4.04Å
216	S	97.9	Very high	94.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.7	-43.2	175.4	-60.1	0	0	0	0	112.1	L212 Y213 A219 K220 L247 L262	L212-S216 WeakPolarHBondContact O-CB 3.47Å; L212-S216 PolarHBondContact O-N 3.14Å; L212-S216 PolarHBondContact O-OG 2.99Å; Y213-S216 PolarHBondContact O-N 2.85Å; S216-A219 PolarHBondContact O-N 3.48Å; S216-K220 WeakPolarHBondContact O-CB 3.17Å; S216-K220 PolarHBondContact O-N 3.07Å; S216-L247 VanDerWaalsContact OG-CD2 3.29Å; S216-L247 WeakPolarHBondContact OG-CD2 3.48Å; S216-L262 WeakPolarHBondContact OG-CA 3.31Å; S216-L262 PolarHBondContact OG-N 3.24Å
217	F	97.2	Very high	94.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-48.8	177.9	-175	-100.4	0	0	0	111	F132 M165 F169 Q172 Y213 T214 A219 K220 S221 Y261	F132-F217 HydrophobicContact CZ-CE2 4.32Å; M165-F217 HydrophobicContact CE-CD1 3.36Å; M165-F217 HydrophobicContact CE-CE1 3.68Å; M165-F217 HydrophobicContact CE-CG 3.97Å; M165-F217 HydrophobicContact SD-CD1 4.14Å; F169-F217 AromaticContact CD1-CE1 3.65Å; F169-F217 HydrophobicContact CD1-CE1 3.65Å; F169-F217 HydrophobicContact CD1-CE2 4.44Å; F169-F217 AromaticContact CD1-CZ 3.37Å; F169-F217 HydrophobicContact CD1-CZ 3.37Å; F169-F217 HydrophobicContact CD2-CE1 4.45Å; F169-F217 AromaticContact CE1-CE1 3.83Å; F169-F217 HydrophobicContact CE1-CE1 3.83Å; F169-F217 HydrophobicContact CE1-CE2 4.2Å; F169-F217 AromaticContact CE1-CZ 3.47Å; F169-F217 HydrophobicContact CE1-CZ 3.47Å; F169-F217 VanDerWaalsContact CE1-CZ 3.47Å; F169-F217 AromaticContact CG-CE1 3.98Å; F169-F217 HydrophobicContact CG-CE1 3.98Å; F169-F217 HydrophobicContact CG-CZ 4.15Å; F169-F217 HydrophobicContact CZ-CE1 4.32Å; F169-F217 HydrophobicContact CZ-CZ 4.34Å; Q172-F217 HydrophobicContact CB-CZ 4.25Å; Q172-F217 HydrophobicContact CG-CZ 4.39Å; Y213-F217 WeakPolarHBondContact O-CB 3.5Å; Y213-F217 PolarHBondContact O-N 3.47Å; T214-F217 PolarHBondContact O-N 3Å; F217-A219 PolarHBondContact O-N 3.12Å; F217-K220 PolarHBondContact O-N 3.26Å; F217-S221 WeakPolarHBondContact O-CB 3.32Å; F217-S221 PolarHBondContact O-N 2.77Å; F217-S221 PolarHBondContact O-OG 2.72Å; F217-Y261 HydrophobicContact CB-CD1 4.48Å; F217-Y261 AromaticContact CD2-CD1 3.87Å; F217-Y261 HydrophobicContact CD2-CD1 3.87Å; F217-Y261 AromaticContact CD2-CE1 3.48Å; F217-Y261 HydrophobicContact CD2-CE1 3.48Å; F217-Y261 VanDerWaalsContact CD2-CE1 3.48Å; F217-Y261 AromaticContact CE2-CE1 3.99Å; F217-Y261 HydrophobicContact CE2-CE1 3.99Å
218	V	97.7	Very high	94.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.4	-50.8	176.3	171.8	0	0	0	0	111.1	S168 V194 Y208 T214 K220 S221 I222 L243	S168-V218 WeakPolarHBondContact OG-CG2 3.45Å; V194-V218 HydrophobicContact CG1-CG1 3.39Å; Y208-V218 HydrophobicContact CD2-CB 4.36Å; Y208-V218 HydrophobicContact CD2-CG2 3.96Å; Y208-V218 HydrophobicContact CE2-CB 3.8Å; Y208-V218 HydrophobicContact CE2-CG1 3.58Å; Y208-V218 HydrophobicContact CE2-CG2 3.67Å; T214-V218 HydrophobicContact CG2-CG2 4.36Å; T214-V218 WeakPolarHBondContact O-CB 3.1Å; T214-V218 WeakPolarHBondContact O-CG2 3.33Å; T214-V218 PolarHBondContact O-N 3.32Å; V218-K220 VanDerWaalsContact C-N 3.33Å; V218-K220 PolarHBondContact O-N 2.78Å; V218-S221 PolarHBondContact O-N 2.81Å; V218-I222 HydrophobicContact CG1-CD1 3.76Å; V218-I222 HydrophobicContact CG1-CG1 4.42Å; V218-I222 WeakPolarHBondContact O-CG1 3.46Å; V218-I222 PolarHBondContact O-N 2.82Å; V218-L243 HydrophobicContact CG1-CD1 4.44Å
219	A	98	Very high	94.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.4	-45.6	-179.5	0	0	0	0	0	111.7	T215 S216 F217 I222 V223 L243 F244 L247 A265	T215-A219 WeakPolarHBondContact O-CB 3.35Å; T215-A219 PolarHBondContact O-N 2.96Å; S216-A219 PolarHBondContact O-N 3.48Å; F217-A219 PolarHBondContact O-N 3.12Å; A219-I222 PolarHBondContact O-N 2.71Å; A219-V223 WeakPolarHBondContact O-CG2 2.96Å; A219-V223 PolarHBondContact O-N 3.46Å; A219-V223 VanDerWaalsContact O-N 3.14Å; A219-L243 HydrophobicContact CB-CB 4.39Å; A219-L243 HydrophobicContact CB-CD1 4.39Å; A219-F244 HydrophobicContact CB-CE2 4.1Å; A219-F244 HydrophobicContact CB-CZ 4.18Å; A219-L247 HydrophobicContact CB-CD1 3.99Å; A219-A265 HydrophobicContact CB-CB 4.41Å
220	K	97.9	Very high	94.9	Very high	34 Å²	34	24 Å²	24	15%	0.148	14%	0.137	C	C	.	.	H	α-helix	trans	-61.7	-47.6	175.6	-173.5	-175.1	173.5	-60.1	0	112	S216 F217 V218 I222 V223 D224 Y261 A264 A265	S216-K220 WeakPolarHBondContact O-CB 3.17Å; S216-K220 PolarHBondContact O-N 3.07Å; F217-K220 PolarHBondContact O-N 3.26Å; V218-K220 VanDerWaalsContact C-N 3.33Å; V218-K220 PolarHBondContact O-N 2.78Å; K220-I222 VanDerWaalsContact C-N 3.29Å; K220-I222 PolarHBondContact O-N 2.75Å; K220-V223 PolarHBondContact O-N 2.89Å; K220-D224 IonicContact NZ-OD2 2.67Å; K220-D224 PolarHBondContact NZ-OD2 3.19Å; K220-D224 WeakPolarHBondContact O-CB 3.48Å; K220-D224 PolarHBondContact O-N 2.79Å; K220-Y261 HydrophobicContact CD-CD1 4.35Å; K220-A264 HydrophobicContact CD-CB 3.96Å; K220-A265 HydrophobicContact CB-CB 3.95Å
221	S	97.8	Very high	95.1	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59.6	-40.2	-179.6	-65.6	0	0	0	0	112.2	S168 F217 V218 F225	S168-S221 VanDerWaalsContact O-CB 3.27Å; S168-S221 WeakPolarHBondContact O-CB 3.49Å; S168-S221 PolarHBondContact O-OG 2.81Å; F217-S221 WeakPolarHBondContact O-CB 3.32Å; F217-S221 PolarHBondContact O-N 2.77Å; F217-S221 PolarHBondContact O-OG 2.72Å; V218-S221 PolarHBondContact O-N 2.81Å; S221-F225 WeakPolarHBondContact O-CB 3.25Å; S221-F225 PolarHBondContact O-N 2.86Å
222	I	97.8	Very high	95.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.4	-49.9	176.8	-68.3	170.8	0	0	0	110.1	L171 I191 V194 L195 V218 A219 K220 D224 F225 L226 V236 L240 L243	L171-I222 HydrophobicContact CD1-CG1 4.12Å; I191-I222 HydrophobicContact CG2-CD1 4.24Å; I191-I222 HydrophobicContact CG2-CG1 4.16Å; I191-I222 HydrophobicContact CG2-CG2 3.84Å; V194-I222 HydrophobicContact CG1-CD1 4.27Å; L195-I222 HydrophobicContact CD1-CD1 4.46Å; L195-I222 HydrophobicContact CD2-CD1 3.64Å; L195-I222 HydrophobicContact CG-CD1 3.93Å; V218-I222 HydrophobicContact CG1-CD1 3.76Å; V218-I222 HydrophobicContact CG1-CG1 4.42Å; V218-I222 WeakPolarHBondContact O-CG1 3.46Å; V218-I222 PolarHBondContact O-N 2.82Å; A219-I222 PolarHBondContact O-N 2.71Å; K220-I222 VanDerWaalsContact C-N 3.29Å; K220-I222 PolarHBondContact O-N 2.75Å; I222-D224 PolarHBondContact O-N 2.64Å; I222-F225 PolarHBondContact O-N 2.98Å; I222-L226 HydrophobicContact CG2-CD1 3.82Å; I222-L226 HydrophobicContact CG2-CG 4.27Å; I222-L226 WeakPolarHBondContact O-CB 3.38Å; I222-L226 VanDerWaalsContact O-CG 3.24Å; I222-L226 WeakPolarHBondContact O-CG 3.43Å; I222-L226 PolarHBondContact O-N 3.29Å; I222-V236 HydrophobicContact CG2-CG1 4.11Å; I222-L240 HydrophobicContact CG2-CD1 4.21Å; I222-L243 HydrophobicContact CD1-CD1 4.16Å
223	V	97.7	Very high	95	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-46.2	-178.9	174.9	0	0	0	0	112	A219 K220 F225 L226 T227 L240 F244 S268 L269 L275	A219-V223 WeakPolarHBondContact O-CG2 2.96Å; A219-V223 PolarHBondContact O-N 3.46Å; A219-V223 VanDerWaalsContact O-N 3.14Å; K220-V223 PolarHBondContact O-N 2.89Å; V223-F225 VanDerWaalsContact C-N 3.32Å; V223-F225 PolarHBondContact O-N 3.45Å; V223-L226 PolarHBondContact O-N 2.92Å; V223-T227 WeakPolarHBondContact O-CB 3.29Å; V223-T227 PolarHBondContact O-N 3.03Å; V223-T227 PolarHBondContact O-OG1 3.44Å; V223-L240 HydrophobicContact CG2-CD1 4.08Å; V223-L240 HydrophobicContact CG2-CD2 4.2Å; V223-F244 HydrophobicContact CG2-CE2 3.99Å; V223-F244 HydrophobicContact CG2-CZ 4.22Å; V223-S268 WeakPolarHBondContact CB-OG 3.41Å; V223-S268 WeakPolarHBondContact CG1-O 3.4Å; V223-S268 WeakPolarHBondContact CG1-OG 3.39Å; V223-L269 HydrophobicContact CG2-CB 4.47Å; V223-L269 HydrophobicContact CG2-CD1 3.95Å; V223-L275 HydrophobicContact CG1-CD1 4.22Å; V223-L275 HydrophobicContact CG2-CD1 4.37Å
224	D	96.6	Very high	94.6	Very high	35 Å²	35	27.5 Å²	27.5	19%	0.187	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-41.8	178.6	-75.2	-5.9	0	0	0	111.3	Q172 K220 I222 T227 A228 S268	Q172-D224 PolarHBondContact NE2-OD2 2.84Å; Q172-D224 PolarHBondContact OE1-OD2 3.38Å; K220-D224 IonicContact NZ-OD2 2.67Å; K220-D224 PolarHBondContact NZ-OD2 3.19Å; K220-D224 WeakPolarHBondContact O-CB 3.48Å; K220-D224 PolarHBondContact O-N 2.79Å; I222-D224 PolarHBondContact O-N 2.64Å; D224-T227 PolarHBondContact O-N 3.47Å; D224-A228 PolarHBondContact O-N 2.75Å; D224-S268 WeakPolarHBondContact OD1-CB 3.44Å; D224-S268 PolarHBondContact OD1-OG 3.42Å
225	F	96.4	Very high	94.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-46.3	177.2	177.6	-88	0	0	0	112.1	L171 L174 I184 H187 V188 I191 S221 I222 V223 T227 A228 Y229	L171-F225 HydrophobicContact CB-CB 4.03Å; L171-F225 HydrophobicContact CB-CD2 4.22Å; L171-F225 HydrophobicContact CB-CG 4.25Å; L171-F225 HydrophobicContact CD2-CB 4.14Å; L171-F225 HydrophobicContact CD2-CD1 3.79Å; L171-F225 HydrophobicContact CD2-CD2 3.51Å; L171-F225 HydrophobicContact CD2-CE1 4.01Å; L171-F225 HydrophobicContact CD2-CE2 3.72Å; L171-F225 HydrophobicContact CD2-CG 3.52Å; L171-F225 HydrophobicContact CD2-CZ 3.96Å; L171-F225 HydrophobicContact CG-CD2 4.47Å; L171-F225 HydrophobicContact CG-CG 4.44Å; L174-F225 HydrophobicContact CB-CD2 4.05Å; L174-F225 HydrophobicContact CB-CE2 4.01Å; L174-F225 HydrophobicContact CD1-CE2 3.88Å; I184-F225 HydrophobicContact CG2-CD2 4.38Å; I184-F225 HydrophobicContact CG2-CE1 4.18Å; I184-F225 HydrophobicContact CG2-CE2 3.4Å; I184-F225 VanDerWaalsContact CG2-CE2 3.4Å; I184-F225 HydrophobicContact CG2-CZ 3.28Å; H187-F225 HydrophobicContact CB-CE2 4.06Å; H187-F225 HydrophobicContact CB-CZ 3.86Å; V188-F225 HydrophobicContact CG2-CE1 4.25Å; I191-F225 HydrophobicContact CD1-CD1 3.6Å; I191-F225 HydrophobicContact CD1-CE1 3.77Å; I191-F225 HydrophobicContact CG1-CD1 4.11Å; I191-F225 HydrophobicContact CG1-CE1 4.24Å; S221-F225 WeakPolarHBondContact O-CB 3.25Å; S221-F225 PolarHBondContact O-N 2.86Å; I222-F225 PolarHBondContact O-N 2.98Å; V223-F225 VanDerWaalsContact C-N 3.32Å; V223-F225 PolarHBondContact O-N 3.45Å; F225-T227 VanDerWaalsContact C-N 3.27Å; F225-T227 PolarHBondContact O-N 3.18Å; F225-A228 CarbonylContact O-C 3.39Å; F225-A228 PolarHBondContact O-N 3.42Å; F225-A228 VanDerWaalsContact O-N 3.15Å; F225-Y229 WeakPolarHBondContact O-CB 3.43Å; F225-Y229 PolarHBondContact O-N 3.47Å
226	L	95	Very high	93.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.5	-43.8	176.3	-71.6	173.3	0	0	0	110.6	I191 I222 V223 A228 Y229 G230 E231 V232 V236 L274	I191-L226 HydrophobicContact CD1-CD2 3.53Å; I191-L226 HydrophobicContact CD1-CG 4.07Å; I222-L226 HydrophobicContact CG2-CD1 3.82Å; I222-L226 HydrophobicContact CG2-CG 4.27Å; I222-L226 WeakPolarHBondContact O-CB 3.38Å; I222-L226 VanDerWaalsContact O-CG 3.24Å; I222-L226 WeakPolarHBondContact O-CG 3.43Å; I222-L226 PolarHBondContact O-N 3.29Å; V223-L226 PolarHBondContact O-N 2.92Å; L226-A228 VanDerWaalsContact C-N 3.32Å; L226-A228 PolarHBondContact O-N 2.81Å; L226-Y229 PolarHBondContact O-N 3.27Å; L226-Y229 VanDerWaalsContact O-N 3.12Å; L226-G230 PolarHBondContact O-N 2.85Å; L226-E231 WeakPolarHBondContact CD2-O 3.18Å; L226-V232 HydrophobicContact CD1-CG1 4.48Å; L226-V236 HydrophobicContact CD1-CG1 4.01Å; L226-L274 WeakPolarHBondContact O-CD1 2.94Å
227	T	93.5	Very high	93.5	Very high	47 Å²	47	30.2 Å²	30.2	29%	0.288	17%	0.171	S	C	.	.	H	α-helix	trans	-58.8	-42.1	176.2	-59.9	0	0	0	0	111.9	V223 D224 F225 S272 P273	V223-T227 WeakPolarHBondContact O-CB 3.29Å; V223-T227 PolarHBondContact O-N 3.03Å; V223-T227 PolarHBondContact O-OG1 3.44Å; D224-T227 PolarHBondContact O-N 3.47Å; F225-T227 VanDerWaalsContact C-N 3.27Å; F225-T227 PolarHBondContact O-N 3.18Å; T227-S272 WeakPolarHBondContact OG1-CB 3.44Å; T227-S272 PolarHBondContact OG1-OG 2.88Å; T227-P273 HydrophobicContact CG2-CG 4.16Å
228	A	92.5	Very high	93.2	Very high	46 Å²	46	31 Å²	31	38%	0.38	18%	0.175	S	C	.	.	H	α-helix	trans	-71.6	-32.1	175.2	0	0	0	0	0	113.2	D224 F225 L226	D224-A228 PolarHBondContact O-N 2.75Å; F225-A228 CarbonylContact O-C 3.39Å; F225-A228 PolarHBondContact O-N 3.42Å; F225-A228 VanDerWaalsContact O-N 3.15Å; L226-A228 VanDerWaalsContact C-N 3.32Å; L226-A228 PolarHBondContact O-N 2.81Å
229	Y	93.2	Very high	93	Very high	31 Å²	31	33.5 Å²	33.5	12%	0.122	19%	0.186	C	C	.	.	H	α-helix	trans	-76	-33.1	179.7	179.4	-118.1	0	0	0	113	K181 I184 V188 F225 L226 E231	K181-Y229 HydrophobicContact CD-CE2 4.3Å; K181-Y229 WeakPolarHBondContact CE-OH 3.12Å; K181-Y229 HydrophobicContact CG-CD2 3.96Å; K181-Y229 HydrophobicContact CG-CE2 3.56Å; I184-Y229 HydrophobicContact CB-CD2 4.2Å; I184-Y229 HydrophobicContact CG2-CD2 3.82Å; I184-Y229 HydrophobicContact CG2-CG 4.42Å; V188-Y229 HydrophobicContact CG2-CD1 3.91Å; V188-Y229 HydrophobicContact CG2-CD2 4.07Å; V188-Y229 HydrophobicContact CG2-CE1 3.61Å; V188-Y229 HydrophobicContact CG2-CE2 3.79Å; V188-Y229 HydrophobicContact CG2-CG 4.15Å; F225-Y229 WeakPolarHBondContact O-CB 3.43Å; F225-Y229 PolarHBondContact O-N 3.47Å; L226-Y229 PolarHBondContact O-N 3.27Å; L226-Y229 VanDerWaalsContact O-N 3.12Å; Y229-E231 HydrophobicContact CD1-CB 3.95Å; Y229-E231 WeakPolarHBondContact CD1-O 3.4Å; Y229-E231 HydrophobicContact CE1-CB 3.69Å
230	G	90.3	Very high	92.8	Very high	40 Å²	40	33.5 Å²	33.5	41%	0.412	19%	0.186	S	C	.	.			trans	93.2	-3.5	175.9	0	0	0	0	0	115.4	L226 L274	L226-G230 PolarHBondContact O-N 2.85Å; G230-L274 VanDerWaalsContact C-CD1 3.49Å; G230-L274 WeakPolarHBondContact O-CD2 3.37Å
231	E	90.1	Very high	92.7	Very high	96 Å²	96	32 Å²	32	45%	0.449	18%	0.179	S	C	.	.			trans	-140.2	154.5	-178.2	-76.7	175.5	-177.9	0	0	112	K181 L226 Y229	K181-E231 WeakPolarHBondContact CE-OE2 3.47Å; K181-E231 IonicContact NZ-OE1 2.57Å; K181-E231 PolarHBondContact NZ-OE1 3.19Å; K181-E231 IonicContact NZ-OE2 3.07Å; K181-E231 PolarHBondContact NZ-OE2 2.8Å; L226-E231 WeakPolarHBondContact CD2-O 3.18Å; Y229-E231 HydrophobicContact CD1-CB 3.95Å; Y229-E231 WeakPolarHBondContact CD1-O 3.4Å; Y229-E231 HydrophobicContact CE1-CB 3.69Å
232	V	89.9	Confident	92.5	Very high	29 Å²	29	32.6 Å²	32.6	18%	0.176	18%	0.182	C	C	.	.			trans	-119.3	110.3	-179	-175.2	0	0	0	0	109.1	L226 E237 L274 L275	L226-V232 HydrophobicContact CD1-CG1 4.48Å; V232-E237 HydrophobicContact CG1-CG 4.05Å; V232-L274 HydrophobicContact CG2-CB 4.39Å; V232-L275 HydrophobicContact CB-CD2 4.45Å; V232-L275 HydrophobicContact CG1-CD2 4.16Å; V232-L275 HydrophobicContact CG2-CD2 3.54Å; V232-L275 HydrophobicContact CG2-CG 4.42Å
233	P	89.5	Confident	92.4	Very high	31 Å²	31	32.6 Å²	32.6	20%	0.201	18%	0.182	C	C	.	.			trans	-64.3	140.6	173.9	-19	31	0	0	0	111.4	V188 S235 V236	V188-P233 HydrophobicContact CG1-CG 3.6Å; P233-S235 PolarHBondContact O-N 3.16Å; P233-V236 HydrophobicContact CB-CG2 4.08Å; P233-V236 HydrophobicContact CG-CG2 4.19Å; P233-V236 WeakPolarHBondContact O-CB 3.49Å; P233-V236 PolarHBondContact O-N 3.19Å
234	K	85.6	Confident	92.4	Very high	176 Å²	176	32.7 Å²	32.7	77%	0.765	18%	0.182	S	C	*	.	H	α-helix	trans	-57.2	-33.6	179.6	-70.7	-174.1	177.8	-175.7	0	113.2	V236 E237	K234-V236 PolarHBondContact O-N 3.47Å; K234-E237 PolarHBondContact O-N 3.28Å
235	S	85	Confident	92.3	Very high	57 Å²	57	31 Å²	31	40%	0.399	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-24.3	178.6	54.7	0	0	0	0	113.5	D192 P233	D192-S235 WeakPolarHBondContact OD1-CB 3.31Å; D192-S235 PolarHBondContact OD1-OG 3.19Å; P233-S235 PolarHBondContact O-N 3.16Å
236	V	90.8	Very high	92.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-88.2	-32.1	-173.4	179.3	0	0	0	0	111.9	I191 L195 I222 L226 P233 K234 N238 K239 L240	I191-V236 HydrophobicContact CB-CG2 4.43Å; I191-V236 HydrophobicContact CG2-CG1 4.1Å; I191-V236 HydrophobicContact CG2-CG2 3.61Å; L195-V236 HydrophobicContact CD1-CB 4.27Å; L195-V236 HydrophobicContact CD1-CG1 3.96Å; L195-V236 HydrophobicContact CD1-CG2 4.08Å; I222-V236 HydrophobicContact CG2-CG1 4.11Å; L226-V236 HydrophobicContact CD1-CG1 4.01Å; P233-V236 HydrophobicContact CB-CG2 4.08Å; P233-V236 HydrophobicContact CG-CG2 4.19Å; P233-V236 WeakPolarHBondContact O-CB 3.49Å; P233-V236 PolarHBondContact O-N 3.19Å; K234-V236 PolarHBondContact O-N 3.47Å; V236-N238 PolarHBondContact O-N 3.01Å; V236-K239 PolarHBondContact O-N 3.02Å; V236-L240 HydrophobicContact CG1-CB 4.23Å; V236-L240 WeakPolarHBondContact O-CB 3.41Å; V236-L240 PolarHBondContact O-N 3.13Å
237	E	90.1	Very high	92.2	Very high	13 Å²	13	31.9 Å²	31.9	6%	0.061	18%	0.177	C	C	.	.	H	α-helix	trans	-52.1	-56.1	-170.9	-63.3	176.8	-147.3	0	0	112.1	V232 K234 L240 V241 K395 L397	V232-E237 HydrophobicContact CG1-CG 4.05Å; K234-E237 PolarHBondContact O-N 3.28Å; E237-L240 PolarHBondContact O-N 3.36Å; E237-V241 WeakPolarHBondContact O-CG2 3.49Å; E237-V241 PolarHBondContact O-N 3.35Å; E237-K395 WeakPolarHBondContact OE1-CE 3.42Å; E237-K395 IonicContact OE1-NZ 3.42Å; E237-K395 PolarHBondContact OE1-NZ 2.59Å; E237-K395 WeakPolarHBondContact OE2-CE 3.34Å; E237-K395 IonicContact OE2-NZ 2.76Å; E237-K395 PolarHBondContact OE2-NZ 2.86Å; E237-L397 HydrophobicContact CB-CD2 4.05Å; E237-L397 HydrophobicContact CG-CD2 4.2Å
238	N	91.2	Very high	92.2	Very high	16 Å²	16	30.8 Å²	30.8	9%	0.086	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-48.8	-177.8	-166.7	17.9	0	0	0	112.1	N25 T26 V236 L240 V241 K242	N25-N238 WeakPolarHBondContact OD1-CB 3.3Å; T26-N238 VanDerWaalsContact CB-OD1 3.27Å; T26-N238 WeakPolarHBondContact CB-OD1 3.4Å; T26-N238 PolarHBondContact N-OD1 3.06Å; T26-N238 PolarHBondContact OG1-OD1 3.5Å; V236-N238 PolarHBondContact O-N 3.01Å; N238-L240 VanDerWaalsContact C-N 3.29Å; N238-L240 PolarHBondContact O-N 3.39Å; N238-V241 PolarHBondContact O-N 2.67Å; N238-K242 WeakPolarHBondContact O-CG 3.38Å; N238-K242 PolarHBondContact O-N 3.21Å; N238-K242 VanDerWaalsContact O-N 3.09Å
239	K	93.3	Very high	92.2	Very high	53 Å²	53	30.1 Å²	30.1	23%	0.23	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-33.7	-176.8	-63.6	-170.9	-174.7	177.4	0	111.9	L195 L206 V236 K242 L243	L195-K239 HydrophobicContact CB-CB 4.45Å; L195-K239 HydrophobicContact CB-CD 3.67Å; L195-K239 HydrophobicContact CD1-CB 4.04Å; L195-K239 HydrophobicContact CD1-CD 4.24Å; L195-K239 HydrophobicContact CD2-CB 4.06Å; L195-K239 HydrophobicContact CG-CB 4.43Å; L195-K239 HydrophobicContact CG-CD 4.44Å; L206-K239 HydrophobicContact CD1-CB 3.69Å; L206-K239 HydrophobicContact CD1-CD 4.36Å; L206-K239 HydrophobicContact CD1-CG 3.94Å; V236-K239 PolarHBondContact O-N 3.02Å; K239-K242 PolarHBondContact O-N 3.06Å; K239-L243 PolarHBondContact O-N 2.88Å
240	L	95.5	Very high	92.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.5	-44.3	175.1	-173.3	60.7	0	0	0	111.2	I222 V223 V236 E237 N238 K242 L243 F244 L269 L275 L397	I222-L240 HydrophobicContact CG2-CD1 4.21Å; V223-L240 HydrophobicContact CG2-CD1 4.08Å; V223-L240 HydrophobicContact CG2-CD2 4.2Å; V236-L240 HydrophobicContact CG1-CB 4.23Å; V236-L240 WeakPolarHBondContact O-CB 3.41Å; V236-L240 PolarHBondContact O-N 3.13Å; E237-L240 PolarHBondContact O-N 3.36Å; N238-L240 VanDerWaalsContact C-N 3.29Å; N238-L240 PolarHBondContact O-N 3.39Å; L240-K242 VanDerWaalsContact C-N 3.3Å; L240-K242 PolarHBondContact O-N 3.13Å; L240-L243 WeakPolarHBondContact O-CB 3.32Å; L240-L243 PolarHBondContact O-N 2.89Å; L240-F244 HydrophobicContact CD1-CD2 4.01Å; L240-F244 HydrophobicContact CD1-CE2 3.73Å; L240-F244 HydrophobicContact CG-CD2 4.18Å; L240-F244 HydrophobicContact CG-CE2 4.19Å; L240-F244 WeakPolarHBondContact O-CD2 3.46Å; L240-F244 PolarHBondContact O-N 3.48Å; L240-F244 VanDerWaalsContact O-N 3.14Å; L240-L269 HydrophobicContact CD2-CD1 4.43Å; L240-L275 HydrophobicContact CD2-CD1 3.99Å; L240-L397 HydrophobicContact CD2-CD1 3.97Å
241	V	94.8	Very high	92.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-58.6	-44.2	173.8	177.5	0	0	0	0	110.7	T26 F28 E237 N238 L243 F244 N245 L397	T26-V241 HydrophobicContact CG2-CG1 4.33Å; T26-V241 VanDerWaalsContact O-CG1 3.31Å; T26-V241 WeakPolarHBondContact O-CG1 3.31Å; F28-V241 HydrophobicContact CD1-CG1 3.77Å; F28-V241 HydrophobicContact CD2-CG1 4.36Å; F28-V241 HydrophobicContact CE1-CB 4.23Å; F28-V241 HydrophobicContact CE1-CG1 3.84Å; F28-V241 HydrophobicContact CE1-CG2 4.19Å; F28-V241 HydrophobicContact CE2-CG1 4.43Å; F28-V241 HydrophobicContact CE2-CG2 4.02Å; F28-V241 HydrophobicContact CG-CG1 4.05Å; F28-V241 HydrophobicContact CZ-CB 4.32Å; F28-V241 HydrophobicContact CZ-CG1 4.19Å; F28-V241 HydrophobicContact CZ-CG2 3.78Å; E237-V241 WeakPolarHBondContact O-CG2 3.49Å; E237-V241 PolarHBondContact O-N 3.35Å; N238-V241 PolarHBondContact O-N 2.67Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 2.98Å; V241-F244 PolarHBondContact O-N 3.33Å; V241-N245 PolarHBondContact O-N 3.29Å; V241-L397 HydrophobicContact CG2-CB 4.29Å
242	K	94.4	Very high	92.2	Very high	14 Å²	14	33.6 Å²	33.6	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-60.3	-38.7	177.1	-65.1	-174.6	-178	-165.1	0	113.2	T26 E200 D203 N204 R205 L206 N238 K239 L240 N245 Y246	T26-K242 HydrophobicContact CG2-CG 4.12Å; T26-K242 WeakPolarHBondContact OG1-CE 3.28Å; T26-K242 WeakPolarHBondContact OG1-CG 3.49Å; E200-K242 IonicContact OE1-NZ 2.73Å; E200-K242 PolarHBondContact OE1-NZ 3.2Å; D203-K242 WeakPolarHBondContact O-CE 3.25Å; D203-K242 PolarHBondContact O-NZ 2.97Å; N204-K242 WeakPolarHBondContact O-CA 3.47Å; R205-K242 WeakPolarHBondContact CA-O 3.46Å; L206-K242 HydrophobicContact CB-CB 3.97Å; L206-K242 HydrophobicContact CD1-CB 4.01Å; L206-K242 HydrophobicContact CD1-CD 4.18Å; L206-K242 HydrophobicContact CG-CB 3.68Å; L206-K242 HydrophobicContact CG-CD 3.95Å; L206-K242 HydrophobicContact CG-CG 4.47Å; L206-K242 PolarHBondContact N-O 2.95Å; L206-K242 VanDerWaalsContact N-O 3.07Å; N238-K242 WeakPolarHBondContact O-CG 3.38Å; N238-K242 PolarHBondContact O-N 3.21Å; N238-K242 VanDerWaalsContact O-N 3.09Å; K239-K242 PolarHBondContact O-N 3.06Å; L240-K242 VanDerWaalsContact C-N 3.3Å; L240-K242 PolarHBondContact O-N 3.13Å; K242-N245 PolarHBondContact O-N 3.21Å; K242-Y246 PolarHBondContact O-N 3.02Å
243	L	96.1	Very high	92.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-48.9	173.8	-76	173.1	0	0	0	111.1	L195 L206 Y208 T215 V218 A219 I222 K239 L240 V241 N245 Y246 L247	L195-L243 HydrophobicContact CD2-CD1 3.55Å; L195-L243 HydrophobicContact CD2-CG 4.36Å; L206-L243 HydrophobicContact CB-CD2 3.96Å; L206-L243 HydrophobicContact CB-CG 4.21Å; Y208-L243 HydrophobicContact CE2-CD2 4.06Å; T215-L243 HydrophobicContact CG2-CD2 3.81Å; V218-L243 HydrophobicContact CG1-CD1 4.44Å; A219-L243 HydrophobicContact CB-CB 4.39Å; A219-L243 HydrophobicContact CB-CD1 4.39Å; I222-L243 HydrophobicContact CD1-CD1 4.16Å; K239-L243 PolarHBondContact O-N 2.88Å; L240-L243 WeakPolarHBondContact O-CB 3.32Å; L240-L243 PolarHBondContact O-N 2.89Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 2.98Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 3.45Å; L243-Y246 WeakPolarHBondContact O-CB 3.31Å; L243-Y246 PolarHBondContact O-N 3.23Å; L243-Y246 VanDerWaalsContact O-N 3.16Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.32Å
244	F	96.6	Very high	92.5	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-67.6	-30.9	-179.6	-85.5	-79.5	0	0	0	113.3	F28 A219 V223 L240 V241 L247 Y248 A265 F266 L269	F28-F244 HydrophobicContact CD1-CB 4.35Å; F28-F244 HydrophobicContact CE1-CB 3.72Å; F28-F244 HydrophobicContact CE1-CG 4.45Å; A219-F244 HydrophobicContact CB-CE2 4.1Å; A219-F244 HydrophobicContact CB-CZ 4.18Å; V223-F244 HydrophobicContact CG2-CE2 3.99Å; V223-F244 HydrophobicContact CG2-CZ 4.22Å; L240-F244 HydrophobicContact CD1-CD2 4.01Å; L240-F244 HydrophobicContact CD1-CE2 3.73Å; L240-F244 HydrophobicContact CG-CD2 4.18Å; L240-F244 HydrophobicContact CG-CE2 4.19Å; L240-F244 WeakPolarHBondContact O-CD2 3.46Å; L240-F244 PolarHBondContact O-N 3.48Å; L240-F244 VanDerWaalsContact O-N 3.14Å; V241-F244 PolarHBondContact O-N 3.33Å; F244-L247 HydrophobicContact CD1-CD1 4.12Å; F244-L247 HydrophobicContact CE1-CD1 4.19Å; F244-L247 PolarHBondContact O-N 3.34Å; F244-Y248 WeakPolarHBondContact O-CB 3.5Å; F244-Y248 PolarHBondContact O-N 3.05Å; F244-A265 HydrophobicContact CE1-CB 4.11Å; F244-A265 HydrophobicContact CZ-CB 4.24Å; F244-A265 WeakPolarHBondContact CZ-O 3.48Å; F244-F266 AromaticContact CD1-CD1 3.96Å; F244-F266 HydrophobicContact CD1-CD1 3.96Å; F244-F266 HydrophobicContact CD1-CD2 4.27Å; F244-F266 AromaticContact CD1-CE1 3.85Å; F244-F266 HydrophobicContact CD1-CE1 3.85Å; F244-F266 HydrophobicContact CD1-CE2 4.18Å; F244-F266 HydrophobicContact CD1-CG 4.17Å; F244-F266 AromaticContact CD1-CZ 3.96Å; F244-F266 HydrophobicContact CD1-CZ 3.96Å; F244-F266 HydrophobicContact CE1-CD1 4.24Å; F244-F266 HydrophobicContact CE1-CD2 4.31Å; F244-F266 HydrophobicContact CE1-CG 4.11Å; F244-L269 HydrophobicContact CD1-CD2 3.84Å; F244-L269 HydrophobicContact CD2-CD2 3.82Å; F244-L269 HydrophobicContact CE1-CB 4Å; F244-L269 HydrophobicContact CE1-CD2 3.81Å; F244-L269 HydrophobicContact CE1-CG 4.5Å; F244-L269 HydrophobicContact CE2-CB 4.2Å; F244-L269 HydrophobicContact CE2-CD1 4.07Å; F244-L269 HydrophobicContact CE2-CD2 3.78Å; F244-L269 HydrophobicContact CE2-CG 4.23Å; F244-L269 HydrophobicContact CG-CD2 3.86Å; F244-L269 HydrophobicContact CZ-CB 3.64Å; F244-L269 HydrophobicContact CZ-CD1 4.37Å; F244-L269 HydrophobicContact CZ-CD2 3.78Å; F244-L269 HydrophobicContact CZ-CG 4.13Å
245	N	94.4	Very high	92.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-45.6	169.8	-78.1	-16.4	0	0	0	111.5	T26 L27 F28 I29 N204 R205 V241 K242 L243 L247 Y248 T249	T26-N245 WeakPolarHBondContact CG2-ND2 3.36Å; L27-N245 PolarHBondContact O-ND2 3.2Å; L27-N245 PolarHBondContact O-OD1 3.01Å; F28-N245 VanDerWaalsContact CA-OD1 3.32Å; F28-N245 WeakPolarHBondContact CA-OD1 3.48Å; I29-N245 HydrophobicContact CD1-CB 4.15Å; I29-N245 WeakPolarHBondContact CD1-O 3.33Å; I29-N245 HydrophobicContact CG1-CB 4.2Å; I29-N245 HydrophobicContact CG2-CB 4.43Å; I29-N245 PolarHBondContact N-OD1 2.77Å; N204-N245 VanDerWaalsContact O-CB 3.3Å; N204-N245 WeakPolarHBondContact O-CB 3.41Å; N204-N245 PolarHBondContact O-ND2 3.03Å; R205-N245 HydrophobicContact CG-CB 3.98Å; V241-N245 PolarHBondContact O-N 3.29Å; K242-N245 PolarHBondContact O-N 3.21Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 3.45Å; N245-L247 VanDerWaalsContact C-N 3.35Å; N245-L247 PolarHBondContact O-N 3.09Å; N245-Y248 PolarHBondContact O-N 2.73Å; N245-T249 WeakPolarHBondContact O-CG2 3.18Å; N245-T249 PolarHBondContact O-N 3.13Å
246	Y	94.4	Very high	93.3	Very high	17 Å²	17	29 Å²	29	7%	0.067	15%	0.146	C	C	.	.	H	α-helix	trans	-59.8	-46.3	174.1	173.1	-98.3	0	0	0	111.4	L206 F207 L212 T215 K242 L243 Y248 T249 R250	L206-Y246 WeakPolarHBondContact O-CB 3.38Å; F207-Y246 HydrophobicContact CB-CD1 3.74Å; F207-Y246 HydrophobicContact CB-CD2 3.6Å; F207-Y246 HydrophobicContact CB-CE1 3.78Å; F207-Y246 HydrophobicContact CB-CE2 3.65Å; F207-Y246 HydrophobicContact CB-CG 3.63Å; F207-Y246 HydrophobicContact CD2-CE2 4.29Å; F207-Y246 HydrophobicContact CG-CD2 4.17Å; F207-Y246 AromaticContact CG-CE2 3.97Å; F207-Y246 HydrophobicContact CG-CE2 3.97Å; L212-Y246 HydrophobicContact CD1-CE1 3.92Å; T215-Y246 HydrophobicContact CG2-CD1 3.6Å; T215-Y246 HydrophobicContact CG2-CE1 3.97Å; K242-Y246 PolarHBondContact O-N 3.02Å; L243-Y246 WeakPolarHBondContact O-CB 3.31Å; L243-Y246 PolarHBondContact O-N 3.23Å; L243-Y246 VanDerWaalsContact O-N 3.16Å; Y246-Y248 VanDerWaalsContact C-N 3.3Å; Y246-Y248 PolarHBondContact O-N 2.85Å; Y246-T249 PolarHBondContact O-N 3.04Å; Y246-T249 PolarHBondContact O-OG1 2.74Å; Y246-R250 HydrophobicContact CE1-CG 4.47Å; Y246-R250 HydrophobicContact CE2-CG 4.49Å
247	L	95.9	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-41.6	177.4	-60.6	-174.1	0	0	0	112.2	L212 T215 S216 A219 L243 F244 N245 T249 R250 R251 L262 A265 F266	L212-L247 HydrophobicContact CD1-CD2 3.6Å; T215-L247 HydrophobicContact CG2-CD2 4.04Å; S216-L247 VanDerWaalsContact OG-CD2 3.29Å; S216-L247 WeakPolarHBondContact OG-CD2 3.48Å; A219-L247 HydrophobicContact CB-CD1 3.99Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.32Å; F244-L247 HydrophobicContact CD1-CD1 4.12Å; F244-L247 HydrophobicContact CE1-CD1 4.19Å; F244-L247 PolarHBondContact O-N 3.34Å; N245-L247 VanDerWaalsContact C-N 3.35Å; N245-L247 PolarHBondContact O-N 3.09Å; L247-T249 VanDerWaalsContact C-N 3.34Å; L247-T249 PolarHBondContact O-N 3.12Å; L247-R250 CarbonylContact O-C 3.51Å; L247-R250 PolarHBondContact O-N 3.14Å; L247-R251 PolarHBondContact O-N 2.78Å; L247-L262 HydrophobicContact CB-CG 4.34Å; L247-L262 WeakPolarHBondContact O-CD1 3.26Å; L247-A265 HydrophobicContact CD1-CB 4Å; L247-F266 HydrophobicContact CB-CE2 3.69Å; L247-F266 HydrophobicContact CB-CZ 4.18Å; L247-F266 HydrophobicContact CD1-CE2 4.49Å
248	Y	93.7	Very high	93.8	Very high	24 Å²	24	34.1 Å²	34.1	9%	0.094	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-40.7	178	-179.7	-95.7	0	0	0	112.8	I29 S31 I32 F244 N245 Y246 R250 R251	I29-Y248 HydrophobicContact CD1-CD1 3.61Å; I29-Y248 HydrophobicContact CD1-CE1 4.44Å; I29-Y248 HydrophobicContact CD1-CG 4.37Å; I29-Y248 HydrophobicContact CG1-CD1 3.48Å; I29-Y248 VanDerWaalsContact CG1-CD1 3.48Å; I29-Y248 HydrophobicContact CG1-CE1 4.15Å; I29-Y248 HydrophobicContact CG1-CG 4.07Å; S31-Y248 WeakPolarHBondContact O-CE2 3.34Å; I32-Y248 HydrophobicContact CD1-CD2 4.06Å; I32-Y248 HydrophobicContact CD1-CE2 4.49Å; F244-Y248 WeakPolarHBondContact O-CB 3.5Å; F244-Y248 PolarHBondContact O-N 3.05Å; N245-Y248 PolarHBondContact O-N 2.73Å; Y246-Y248 VanDerWaalsContact C-N 3.3Å; Y246-Y248 PolarHBondContact O-N 2.85Å; Y248-R250 PolarHBondContact O-N 3.11Å; Y248-R250 VanDerWaalsContact O-N 3.13Å; Y248-R251 VanDerWaalsContact CE1-NH1 3.34Å; Y248-R251 WeakPolarHBondContact O-CB 3.08Å; Y248-R251 WeakPolarHBondContact O-CD 3.33Å; Y248-R251 VanDerWaalsContact O-CG 3.28Å; Y248-R251 WeakPolarHBondContact O-CG 3.43Å; Y248-R251 PolarHBondContact O-N 3.32Å; Y248-R251 PolarHBondContact O-NH1 3.49Å; Y248-R251 VanDerWaalsContact O-NH1 3.07Å
249	T	91.5	Very high	94	Very high	33 Å²	33	33.3 Å²	33.3	20%	0.202	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-20.3	176.1	68.7	0	0	0	0	113.3	I29 N245 Y246 L247	I29-T249 HydrophobicContact CD1-CG2 3.66Å; N245-T249 WeakPolarHBondContact O-CG2 3.18Å; N245-T249 PolarHBondContact O-N 3.13Å; Y246-T249 PolarHBondContact O-N 3.04Å; Y246-T249 PolarHBondContact O-OG1 2.74Å; L247-T249 VanDerWaalsContact C-N 3.34Å; L247-T249 PolarHBondContact O-N 3.12Å
250	R	92.2	Very high	94.2	Very high	131 Å²	131	30.8 Å²	30.8	49%	0.494	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	11.6	-177.8	-57.5	-56.2	-172.6	166.2	-0	113.1	L212 Y246 L247 Y248 Q252 T253 L262	L212-R250 HydrophobicContact CD1-CB 3.77Å; L212-R250 HydrophobicContact CD1-CG 4.05Å; L212-R250 HydrophobicContact CD2-CB 3.72Å; L212-R250 HydrophobicContact CD2-CG 4.43Å; L212-R250 HydrophobicContact CG-CB 4.37Å; Y246-R250 HydrophobicContact CE1-CG 4.47Å; Y246-R250 HydrophobicContact CE2-CG 4.49Å; L247-R250 CarbonylContact O-C 3.51Å; L247-R250 PolarHBondContact O-N 3.14Å; Y248-R250 PolarHBondContact O-N 3.11Å; Y248-R250 VanDerWaalsContact O-N 3.13Å; R250-Q252 PolarHBondContact O-N 3.31Å; R250-T253 WeakPolarHBondContact O-CB 3.37Å; R250-T253 VanDerWaalsContact O-CG2 3.25Å; R250-T253 WeakPolarHBondContact O-CG2 3.45Å; R250-T253 PolarHBondContact O-N 3.38Å; R250-L262 HydrophobicContact CB-CD1 4.47Å
251	R	92.2	Very high	94.4	Very high	13 Å²	13	31.1 Å²	31.1	5%	0.049	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.8	-176.5	71.4	-167.6	-177.5	-78.8	-1.3	115.2	I32 D36 F40 L247 Y248 T253 G291 S293	I32-R251 HydrophobicContact CD1-CB 4.07Å; D36-R251 VanDerWaalsContact CG-CD 3.48Å; D36-R251 VanDerWaalsContact OD1-CD 3.26Å; D36-R251 WeakPolarHBondContact OD1-CD 3.35Å; D36-R251 WeakPolarHBondContact OD1-CG 3.45Å; D36-R251 IonicContact OD1-NE 3.47Å; D36-R251 PolarHBondContact OD1-NE 2.71Å; D36-R251 IonicContact OD2-NE 2.74Å; D36-R251 PolarHBondContact OD2-NE 3.41Å; F40-R251 WeakPolarHBondContact CE1-O 3.32Å; F40-R251 HydrophobicContact CE2-CB 4.46Å; F40-R251 HydrophobicContact CZ-CB 4.03Å; F40-R251 WeakPolarHBondContact CZ-O 3.35Å; L247-R251 PolarHBondContact O-N 2.78Å; Y248-R251 VanDerWaalsContact CE1-NH1 3.34Å; Y248-R251 WeakPolarHBondContact O-CB 3.08Å; Y248-R251 WeakPolarHBondContact O-CD 3.33Å; Y248-R251 VanDerWaalsContact O-CG 3.28Å; Y248-R251 WeakPolarHBondContact O-CG 3.43Å; Y248-R251 PolarHBondContact O-N 3.32Å; Y248-R251 PolarHBondContact O-NH1 3.49Å; Y248-R251 VanDerWaalsContact O-NH1 3.07Å; R251-T253 VanDerWaalsContact C-N 3.31Å; R251-T253 PolarHBondContact O-N 3.41Å; R251-G291 PolarHBondContact NH2-O 2.91Å; R251-S293 PolarHBondContact NH1-OG 2.78Å
252	Q	90.2	Very high	94.5	Very high	96 Å²	96	31.1 Å²	31.1	45%	0.449	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	13.6	177	-63.7	-67	-31.6	0	0	113.2	D36 H39 R250	D36-Q252 PolarHBondContact OD1-NE2 3.4Å; H39-Q252 PolarHBondContact NE2-O 3.45Å; R250-Q252 PolarHBondContact O-N 3.31Å
253	T	93.1	Very high	94.7	Very high	28 Å²	28	30.4 Å²	30.4	17%	0.172	15%	0.149	C	C	.	.			trans	-60.4	139.7	176.7	175.5	0	0	0	0	112.2	H39 F40 L212 R250 R251 N255 S259 L262	H39-T253 PolarHBondContact NE2-O 3.19Å; F40-T253 HydrophobicContact CE1-CG2 4.32Å; L212-T253 HydrophobicContact CD2-CG2 3.61Å; R250-T253 WeakPolarHBondContact O-CB 3.37Å; R250-T253 VanDerWaalsContact O-CG2 3.25Å; R250-T253 WeakPolarHBondContact O-CG2 3.45Å; R250-T253 PolarHBondContact O-N 3.38Å; R251-T253 VanDerWaalsContact C-N 3.31Å; R251-T253 PolarHBondContact O-N 3.41Å; T253-N255 PolarHBondContact OG1-N 3.14Å; T253-S259 WeakPolarHBondContact CG2-OG 3.42Å; T253-S259 PolarHBondContact O-OG 3.44Å; T253-L262 HydrophobicContact CG2-CD1 4.21Å
254	A	91.5	Very high	94.8	Very high	56 Å²	56	30.6 Å²	30.6	46%	0.463	15%	0.15	S	C	.	.			trans	-100.9	-4.9	173.9	0	0	0	0	0	113.4	V43 V256	V43-A254 WeakPolarHBondContact CG1-O 3.13Å; A254-V256 PolarHBondContact O-N 2.79Å
255	N	93.3	Very high	94.8	Very high	95 Å²	95	30.6 Å²	30.6	51%	0.508	15%	0.15	S	C	.	.			trans	-73.4	111.6	177.1	-178.9	-67.5	0	0	0	110.3	T253 R257 A258 S259	T253-N255 PolarHBondContact OG1-N 3.14Å; N255-R257 PolarHBondContact O-N 3.46Å; N255-R257 PolarHBondContact OD1-N 2.9Å; N255-A258 HydrophobicContact CB-CB 4.12Å; N255-A258 PolarHBondContact O-N 2.86Å; N255-A258 VanDerWaalsContact O-N 3.16Å; N255-A258 PolarHBondContact OD1-N 3.21Å; N255-S259 WeakPolarHBondContact O-CB 3.47Å; N255-S259 PolarHBondContact O-N 3.47Å; N255-S259 PolarHBondContact O-OG 3.49Å
256	V	94.1	Very high	95	Very high	18 Å²	18	30.5 Å²	30.5	11%	0.109	15%	0.15	C	C	.	.	H	α-helix	trans	-51.3	-50	-174.5	-178.5	0	0	0	0	113	V43 F44 Q47 H60 A61 A254 A258 S259 A260	V43-V256 HydrophobicContact CG1-CG2 4.12Å; F44-V256 HydrophobicContact CD1-CG1 4.25Å; Q47-V256 HydrophobicContact CB-CG1 4.33Å; Q47-V256 HydrophobicContact CB-CG2 3.86Å; Q47-V256 HydrophobicContact CG-CG1 4.02Å; Q47-V256 HydrophobicContact CG-CG2 3.92Å; H60-V256 HydrophobicContact CB-CG1 4.04Å; A61-V256 HydrophobicContact CB-CG1 4.2Å; A254-V256 PolarHBondContact O-N 2.79Å; V256-A258 PolarHBondContact O-N 3.3Å; V256-S259 PolarHBondContact O-N 3.19Å; V256-A260 VanDerWaalsContact O-CB 3.29Å; V256-A260 WeakPolarHBondContact O-CB 3.45Å; V256-A260 PolarHBondContact O-N 3.3Å
257	R	94.4	Very high	95.1	Very high	113 Å²	113	31.5 Å²	31.5	43%	0.426	15%	0.154	S	C	.	.	H	α-helix	trans	-61.8	-47.2	-178.2	172.3	179.8	-63	167	-0.3	111.2	S56 Y213 N255 Y261	S56-R257 PolarHBondContact OG-NH2 3.05Å; Y213-R257 HydrophobicContact CD2-CG 3.47Å; Y213-R257 VanDerWaalsContact CD2-CG 3.47Å; Y213-R257 HydrophobicContact CE2-CG 3.79Å; Y213-R257 HydrophobicContact CG-CG 4.19Å; N255-R257 PolarHBondContact O-N 3.46Å; N255-R257 PolarHBondContact OD1-N 2.9Å; R257-Y261 PolarHBondContact O-N 3.09Å
258	A	96.1	Very high	95.2	Very high	6 Å²	6	32 Å²	32	5%	0.05	16%	0.158	C	C	.	.	H	α-helix	trans	-68.8	-41.3	-179.6	0	0	0	0	0	111.9	L212 N255 V256 L262	L212-A258 HydrophobicContact CB-CB 4.16Å; L212-A258 HydrophobicContact CD2-CB 3.9Å; L212-A258 HydrophobicContact CG-CB 4.03Å; N255-A258 HydrophobicContact CB-CB 4.12Å; N255-A258 PolarHBondContact O-N 2.86Å; N255-A258 VanDerWaalsContact O-N 3.16Å; N255-A258 PolarHBondContact OD1-N 3.21Å; V256-A258 PolarHBondContact O-N 3.3Å; A258-L262 VanDerWaalsContact O-CB 3.25Å; A258-L262 WeakPolarHBondContact O-CB 3.27Å; A258-L262 PolarHBondContact O-N 3.22Å
259	S	97	Very high	95.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-44.5	175.8	-60.8	0	0	0	0	111.3	T253 N255 V256 Y261 L262 V263	T253-S259 WeakPolarHBondContact CG2-OG 3.42Å; T253-S259 PolarHBondContact O-OG 3.44Å; N255-S259 WeakPolarHBondContact O-CB 3.47Å; N255-S259 PolarHBondContact O-N 3.47Å; N255-S259 PolarHBondContact O-OG 3.49Å; V256-S259 PolarHBondContact O-N 3.19Å; S259-Y261 PolarHBondContact O-N 3.37Å; S259-L262 PolarHBondContact O-N 3.37Å; S259-V263 WeakPolarHBondContact O-CB 3.43Å; S259-V263 VanDerWaalsContact O-CG2 3.26Å; S259-V263 WeakPolarHBondContact O-CG2 2.98Å; S259-V263 PolarHBondContact O-N 3.26Å
260	A	97.8	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.2	-49.3	-180	0	0	0	0	0	112.2	F44 H60 L63 V256 V263 A264	F44-A260 HydrophobicContact CE1-CB 4.03Å; F44-A260 HydrophobicContact CZ-CB 4.35Å; H60-A260 HydrophobicContact CB-CB 3.98Å; H60-A260 WeakPolarHBondContact O-CB 3.42Å; L63-A260 HydrophobicContact CD2-CB 4.34Å; V256-A260 VanDerWaalsContact O-CB 3.29Å; V256-A260 WeakPolarHBondContact O-CB 3.45Å; V256-A260 PolarHBondContact O-N 3.3Å; A260-V263 PolarHBondContact O-N 3.5Å; A260-A264 VanDerWaalsContact O-CB 3.3Å; A260-A264 WeakPolarHBondContact O-CB 3.4Å; A260-A264 PolarHBondContact O-N 3.13Å
261	Y	97.7	Very high	95.4	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-72.8	-31.3	178.9	-85.8	-85.6	0	0	0	113.3	H60 L63 Y213 F217 K220 R257 S259 A264 A265	H60-Y261 AromaticContact CD2-CD2 3.88Å; H60-Y261 AromaticContact CD2-CE2 3.59Å; H60-Y261 AromaticContact NE2-CE2 3.54Å; L63-Y261 HydrophobicContact CD2-CD2 4.2Å; L63-Y261 HydrophobicContact CD2-CE1 4.37Å; L63-Y261 HydrophobicContact CD2-CE2 3.96Å; Y213-Y261 AromaticContact CD2-CD2 3.75Å; Y213-Y261 HydrophobicContact CD2-CD2 3.75Å; Y213-Y261 HydrophobicContact CD2-CE2 4.31Å; Y213-Y261 HydrophobicContact CD2-CG 4.14Å; Y213-Y261 AromaticContact CE2-CD2 3.36Å; Y213-Y261 HydrophobicContact CE2-CD2 3.36Å; Y213-Y261 AromaticContact CE2-CE2 3.47Å; Y213-Y261 HydrophobicContact CE2-CE2 3.47Å; Y213-Y261 VanDerWaalsContact CE2-CE2 3.47Å; Y213-Y261 AromaticContact CE2-CG 3.92Å; Y213-Y261 HydrophobicContact CE2-CG 3.92Å; F217-Y261 HydrophobicContact CB-CD1 4.48Å; F217-Y261 AromaticContact CD2-CD1 3.87Å; F217-Y261 HydrophobicContact CD2-CD1 3.87Å; F217-Y261 AromaticContact CD2-CE1 3.48Å; F217-Y261 HydrophobicContact CD2-CE1 3.48Å; F217-Y261 VanDerWaalsContact CD2-CE1 3.48Å; F217-Y261 AromaticContact CE2-CE1 3.99Å; F217-Y261 HydrophobicContact CE2-CE1 3.99Å; K220-Y261 HydrophobicContact CD-CD1 4.35Å; R257-Y261 PolarHBondContact O-N 3.09Å; S259-Y261 PolarHBondContact O-N 3.37Å; Y261-A264 PolarHBondContact O-N 3.21Å; Y261-A265 WeakPolarHBondContact O-CB 3.37Å; Y261-A265 PolarHBondContact O-N 3.41Å
262	L	98.1	Very high	95.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.5	-53.5	172	-178.6	164.1	0	0	0	109.7	F40 L212 S216 L247 R250 T253 A258 S259 A264 A265 F266	F40-L262 HydrophobicContact CE1-CD2 4.13Å; F40-L262 HydrophobicContact CE2-CD2 4.09Å; F40-L262 HydrophobicContact CZ-CD1 4.36Å; F40-L262 HydrophobicContact CZ-CD2 3.44Å; F40-L262 VanDerWaalsContact CZ-CD2 3.44Å; L212-L262 HydrophobicContact CD1-CD1 4.23Å; L212-L262 HydrophobicContact CD2-CD1 4.17Å; S216-L262 WeakPolarHBondContact OG-CA 3.31Å; S216-L262 PolarHBondContact OG-N 3.24Å; L247-L262 HydrophobicContact CB-CG 4.34Å; L247-L262 WeakPolarHBondContact O-CD1 3.26Å; R250-L262 HydrophobicContact CB-CD1 4.47Å; T253-L262 HydrophobicContact CG2-CD1 4.21Å; A258-L262 VanDerWaalsContact O-CB 3.25Å; A258-L262 WeakPolarHBondContact O-CB 3.27Å; A258-L262 PolarHBondContact O-N 3.22Å; S259-L262 PolarHBondContact O-N 3.37Å; L262-A264 VanDerWaalsContact C-N 3.33Å; L262-A264 PolarHBondContact O-N 3Å; L262-A265 WeakPolarHBondContact O-CB 3.1Å; L262-A265 PolarHBondContact O-N 3.35Å; L262-A265 VanDerWaalsContact O-N 3.17Å; L262-F266 HydrophobicContact CD2-CD2 3.72Å; L262-F266 HydrophobicContact CD2-CE2 3.77Å; L262-F266 HydrophobicContact CG-CD2 4.36Å; L262-F266 HydrophobicContact CG-CE2 4.23Å; L262-F266 WeakPolarHBondContact O-CD2 3.3Å; L262-F266 PolarHBondContact O-N 3.14Å; L262-F266 VanDerWaalsContact O-N 3.1Å
263	V	98	Very high	95.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-44.5	177.8	172.8	0	0	0	0	110.6	F40 F44 L68 S259 A260 A265 F266 K267 W315	F40-V263 HydrophobicContact CB-CG2 4.08Å; F40-V263 HydrophobicContact CD1-CG2 3.8Å; F40-V263 HydrophobicContact CD2-CG2 3.56Å; F40-V263 HydrophobicContact CE1-CG2 4.05Å; F40-V263 HydrophobicContact CE2-CG2 3.83Å; F40-V263 HydrophobicContact CG-CG2 3.54Å; F40-V263 HydrophobicContact CZ-CG2 4.06Å; F44-V263 HydrophobicContact CE2-CG2 4.28Å; F44-V263 HydrophobicContact CZ-CG2 4.22Å; L68-V263 HydrophobicContact CD2-CG1 3.77Å; L68-V263 HydrophobicContact CG-CG1 3.79Å; S259-V263 WeakPolarHBondContact O-CB 3.43Å; S259-V263 VanDerWaalsContact O-CG2 3.26Å; S259-V263 WeakPolarHBondContact O-CG2 2.98Å; S259-V263 PolarHBondContact O-N 3.26Å; A260-V263 PolarHBondContact O-N 3.5Å; V263-A265 VanDerWaalsContact C-N 3.31Å; V263-A265 PolarHBondContact O-N 2.84Å; V263-F266 PolarHBondContact O-N 2.63Å; V263-K267 WeakPolarHBondContact O-CB 3.4Å; V263-K267 PolarHBondContact O-N 3.07Å; V263-W315 HydrophobicContact CG1-CH2 3.77Å; V263-W315 HydrophobicContact CG1-CZ2 4.48Å
264	A	97.8	Very high	95.4	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.033	15%	0.154	C	C	.	.	H	α-helix	trans	-62.8	-34.9	177.4	0	0	0	0	0	113.1	L63 K220 A260 Y261 L262 K267 S268	L63-A264 HydrophobicContact CD1-CB 4.47Å; L63-A264 HydrophobicContact CG-CB 4.49Å; K220-A264 HydrophobicContact CD-CB 3.96Å; A260-A264 VanDerWaalsContact O-CB 3.3Å; A260-A264 WeakPolarHBondContact O-CB 3.4Å; A260-A264 PolarHBondContact O-N 3.13Å; Y261-A264 PolarHBondContact O-N 3.21Å; L262-A264 VanDerWaalsContact C-N 3.33Å; L262-A264 PolarHBondContact O-N 3Å; A264-K267 PolarHBondContact O-N 2.94Å; A264-S268 WeakPolarHBondContact O-CB 3.44Å; A264-S268 PolarHBondContact O-N 2.58Å
265	A	98.4	Very high	95.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-47.2	175.2	0	0	0	0	0	111.5	A219 K220 F244 L247 Y261 L262 V263 K267 S268 L269	A219-A265 HydrophobicContact CB-CB 4.41Å; K220-A265 HydrophobicContact CB-CB 3.95Å; F244-A265 HydrophobicContact CE1-CB 4.11Å; F244-A265 HydrophobicContact CZ-CB 4.24Å; F244-A265 WeakPolarHBondContact CZ-O 3.48Å; L247-A265 HydrophobicContact CD1-CB 4Å; Y261-A265 WeakPolarHBondContact O-CB 3.37Å; Y261-A265 PolarHBondContact O-N 3.41Å; L262-A265 WeakPolarHBondContact O-CB 3.1Å; L262-A265 PolarHBondContact O-N 3.35Å; L262-A265 VanDerWaalsContact O-N 3.17Å; V263-A265 VanDerWaalsContact C-N 3.31Å; V263-A265 PolarHBondContact O-N 2.84Å; A265-K267 VanDerWaalsContact C-N 3.3Å; A265-K267 PolarHBondContact O-N 3.3Å; A265-S268 PolarHBondContact O-N 2.67Å; A265-L269 PolarHBondContact O-N 2.84Å
266	F	97.7	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64	-36.9	175.6	-83.4	-87.3	0	0	0	112.1	I32 F244 L247 L262 V263 L269 T270 I314 W315	I32-F266 HydrophobicContact CD1-CD1 4.44Å; I32-F266 HydrophobicContact CD1-CD2 4.36Å; I32-F266 HydrophobicContact CD1-CE1 4.12Å; I32-F266 HydrophobicContact CD1-CE2 4.03Å; I32-F266 HydrophobicContact CD1-CZ 3.91Å; I32-F266 HydrophobicContact CG1-CD1 3.75Å; I32-F266 HydrophobicContact CG1-CD2 4.3Å; I32-F266 HydrophobicContact CG1-CE1 3.8Å; I32-F266 HydrophobicContact CG1-CE2 4.34Å; I32-F266 HydrophobicContact CG1-CG 4.02Å; I32-F266 HydrophobicContact CG1-CZ 4.11Å; F244-F266 AromaticContact CD1-CD1 3.96Å; F244-F266 HydrophobicContact CD1-CD1 3.96Å; F244-F266 HydrophobicContact CD1-CD2 4.27Å; F244-F266 AromaticContact CD1-CE1 3.85Å; F244-F266 HydrophobicContact CD1-CE1 3.85Å; F244-F266 HydrophobicContact CD1-CE2 4.18Å; F244-F266 HydrophobicContact CD1-CG 4.17Å; F244-F266 AromaticContact CD1-CZ 3.96Å; F244-F266 HydrophobicContact CD1-CZ 3.96Å; F244-F266 HydrophobicContact CE1-CD1 4.24Å; F244-F266 HydrophobicContact CE1-CD2 4.31Å; F244-F266 HydrophobicContact CE1-CG 4.11Å; L247-F266 HydrophobicContact CB-CE2 3.69Å; L247-F266 HydrophobicContact CB-CZ 4.18Å; L247-F266 HydrophobicContact CD1-CE2 4.49Å; L262-F266 HydrophobicContact CD2-CD2 3.72Å; L262-F266 HydrophobicContact CD2-CE2 3.77Å; L262-F266 HydrophobicContact CG-CD2 4.36Å; L262-F266 HydrophobicContact CG-CE2 4.23Å; L262-F266 WeakPolarHBondContact O-CD2 3.3Å; L262-F266 PolarHBondContact O-N 3.14Å; L262-F266 VanDerWaalsContact O-N 3.1Å; V263-F266 PolarHBondContact O-N 2.63Å; F266-L269 PolarHBondContact O-N 3.42Å; F266-T270 WeakPolarHBondContact O-CB 3.37Å; F266-T270 PolarHBondContact O-N 2.98Å; F266-T270 PolarHBondContact O-OG1 2.98Å; F266-I314 HydrophobicContact CD1-CD1 4.02Å; F266-I314 HydrophobicContact CD1-CG1 4.17Å; F266-I314 HydrophobicContact CD1-CG2 4.38Å; F266-I314 HydrophobicContact CE1-CD1 3.58Å; F266-I314 HydrophobicContact CE1-CG1 3.85Å; F266-W315 HydrophobicContact CB-CE3 3.57Å; F266-W315 HydrophobicContact CB-CH2 4.35Å; F266-W315 HydrophobicContact CB-CZ3 3.37Å; F266-W315 HydrophobicContact CG-CE3 4.31Å; F266-W315 HydrophobicContact CG-CZ3 4.17Å
267	K	96.8	Very high	95.5	Very high	38 Å²	38	20.4 Å²	20.4	17%	0.165	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175	-172.4	58.9	159.7	81.2	0	111.6	S67 S69 V263 A264 A265 L269 T270 D271	S67-K267 WeakPolarHBondContact O-CD 3.25Å; S67-K267 WeakPolarHBondContact O-CE 3.45Å; S67-K267 WeakPolarHBondContact O-CG 3.47Å; S69-K267 WeakPolarHBondContact OG-CE 3.4Å; V263-K267 WeakPolarHBondContact O-CB 3.4Å; V263-K267 PolarHBondContact O-N 3.07Å; A264-K267 PolarHBondContact O-N 2.94Å; A265-K267 VanDerWaalsContact C-N 3.3Å; A265-K267 PolarHBondContact O-N 3.3Å; K267-L269 VanDerWaalsContact C-N 3.32Å; K267-L269 PolarHBondContact O-N 3.13Å; K267-T270 WeakPolarHBondContact O-CB 3.39Å; K267-T270 PolarHBondContact O-N 3.42Å; K267-T270 VanDerWaalsContact O-N 3.13Å; K267-D271 IonicContact NZ-OD1 3.85Å; K267-D271 PolarHBondContact NZ-OD1 3.44Å; K267-D271 IonicContact NZ-OD2 2.61Å; K267-D271 PolarHBondContact NZ-OD2 3.06Å; K267-D271 WeakPolarHBondContact O-CB 3.5Å; K267-D271 VanDerWaalsContact O-CG 3.27Å; K267-D271 PolarHBondContact O-N 2.89Å
268	S	96.7	Very high	95.4	Very high	11 Å²	11	15 Å²	15	8%	0.077	9%	0.086	C	C	.	.	H	α-helix	trans	-57.5	-43.8	174.6	169.9	0	0	0	0	111.8	V223 D224 A264 A265 T270 D271 S272	V223-S268 WeakPolarHBondContact CB-OG 3.41Å; V223-S268 WeakPolarHBondContact CG1-O 3.4Å; V223-S268 WeakPolarHBondContact CG1-OG 3.39Å; D224-S268 WeakPolarHBondContact OD1-CB 3.44Å; D224-S268 PolarHBondContact OD1-OG 3.42Å; A264-S268 WeakPolarHBondContact O-CB 3.44Å; A264-S268 PolarHBondContact O-N 2.58Å; A265-S268 PolarHBondContact O-N 2.67Å; S268-T270 VanDerWaalsContact C-N 3.32Å; S268-T270 PolarHBondContact O-N 3.41Å; S268-D271 PolarHBondContact O-N 3.33Å; S268-S272 PolarHBondContact O-N 2.89Å; S268-S272 VanDerWaalsContact O-N 3.13Å
269	L	96.3	Very high	95.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62	-39.6	175.5	-173.3	67.2	0	0	0	112.6	F28 V223 L240 F244 A265 F266 K267 L275 P277 I314 L397	F28-L269 HydrophobicContact CZ-CD2 4.28Å; V223-L269 HydrophobicContact CG2-CB 4.47Å; V223-L269 HydrophobicContact CG2-CD1 3.95Å; L240-L269 HydrophobicContact CD2-CD1 4.43Å; F244-L269 HydrophobicContact CD1-CD2 3.84Å; F244-L269 HydrophobicContact CD2-CD2 3.82Å; F244-L269 HydrophobicContact CE1-CB 4Å; F244-L269 HydrophobicContact CE1-CD2 3.81Å; F244-L269 HydrophobicContact CE1-CG 4.5Å; F244-L269 HydrophobicContact CE2-CB 4.2Å; F244-L269 HydrophobicContact CE2-CD1 4.07Å; F244-L269 HydrophobicContact CE2-CD2 3.78Å; F244-L269 HydrophobicContact CE2-CG 4.23Å; F244-L269 HydrophobicContact CG-CD2 3.86Å; F244-L269 HydrophobicContact CZ-CB 3.64Å; F244-L269 HydrophobicContact CZ-CD1 4.37Å; F244-L269 HydrophobicContact CZ-CD2 3.78Å; F244-L269 HydrophobicContact CZ-CG 4.13Å; A265-L269 PolarHBondContact O-N 2.84Å; F266-L269 PolarHBondContact O-N 3.42Å; K267-L269 VanDerWaalsContact C-N 3.32Å; K267-L269 PolarHBondContact O-N 3.13Å; L269-L275 HydrophobicContact CD1-CB 4.35Å; L269-L275 HydrophobicContact CD1-CD1 3.78Å; L269-P277 HydrophobicContact CD2-CB 3.75Å; L269-P277 HydrophobicContact CD2-CG 4.05Å; L269-P277 HydrophobicContact CG-CB 4.04Å; L269-P277 HydrophobicContact CG-CG 3.92Å; L269-I314 HydrophobicContact CD2-CD1 4.1Å; L269-I314 HydrophobicContact CD2-CG2 4.31Å; L269-L397 HydrophobicContact CD1-CD1 3.99Å
270	T	93.9	Very high	94.8	Very high	34 Å²	34	15 Å²	15	21%	0.209	9%	0.085	C	C	.	.	H	α-helix	trans	-71.6	-39.1	179.7	-58.5	0	0	0	0	112.6	F266 K267 S268 S272 H313 W315	F266-T270 WeakPolarHBondContact O-CB 3.37Å; F266-T270 PolarHBondContact O-N 2.98Å; F266-T270 PolarHBondContact O-OG1 2.98Å; K267-T270 WeakPolarHBondContact O-CB 3.39Å; K267-T270 PolarHBondContact O-N 3.42Å; K267-T270 VanDerWaalsContact O-N 3.13Å; S268-T270 VanDerWaalsContact C-N 3.32Å; S268-T270 PolarHBondContact O-N 3.41Å; T270-S272 VanDerWaalsContact C-N 3.3Å; T270-H313 WeakPolarHBondContact CG2-CE1 3.28Å; T270-H313 PolarHBondContact OG1-CE1 2.94Å; T270-W315 HydrophobicContact CG2-CB 4.05Å; T270-W315 HydrophobicContact CG2-CG 4.17Å; T270-W315 VanDerWaalsContact OG1-CB 3.25Å; T270-W315 WeakPolarHBondContact OG1-CB 3.15Å
271	D	93.2	Very high	94.2	Very high	92 Å²	92	15.9 Å²	15.9	49%	0.492	9%	0.089	S	C	.	.	H	α-helix	trans	-82.1	-10.8	-176.6	-69.4	-11.9	0	0	0	112.9	K267 S268 P273	K267-D271 IonicContact NZ-OD1 3.85Å; K267-D271 PolarHBondContact NZ-OD1 3.44Å; K267-D271 IonicContact NZ-OD2 2.61Å; K267-D271 PolarHBondContact NZ-OD2 3.06Å; K267-D271 WeakPolarHBondContact O-CB 3.5Å; K267-D271 VanDerWaalsContact O-CG 3.27Å; K267-D271 PolarHBondContact O-N 2.89Å; S268-D271 PolarHBondContact O-N 3.33Å; D271-P273 WeakPolarHBondContact O-CD 3.43Å
272	S	93.5	Very high	93.5	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.014	9%	0.09	C	C	.	.			trans	-64.5	121.2	-178.4	-174.4	0	0	0	0	110.7	T227 S268 T270 L274 L275	T227-S272 WeakPolarHBondContact OG1-CB 3.44Å; T227-S272 PolarHBondContact OG1-OG 2.88Å; S268-S272 PolarHBondContact O-N 2.89Å; S268-S272 VanDerWaalsContact O-N 3.13Å; T270-S272 VanDerWaalsContact C-N 3.3Å; S272-L274 PolarHBondContact O-N 3.48Å; S272-L274 PolarHBondContact OG-N 3.45Å; S272-L275 PolarHBondContact O-N 2.91Å
273	P	91.3	Very high	92.2	Very high	80 Å²	80	17 Å²	17	52%	0.519	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-6.5	173.9	32	-36.4	0	0	0	112.7	T227 D271 Q394	T227-P273 HydrophobicContact CG2-CG 4.16Å; D271-P273 WeakPolarHBondContact O-CD 3.43Å; P273-Q394 WeakPolarHBondContact O-CG 3.45Å
274	L	90.9	Very high	90.7	Very high	27 Å²	27	21 Å²	21	14%	0.141	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-24.2	-179.8	-62.5	-179.8	0	0	0	113.3	L226 G230 V232 S272 K395	L226-L274 WeakPolarHBondContact O-CD1 2.94Å; G230-L274 VanDerWaalsContact C-CD1 3.49Å; G230-L274 WeakPolarHBondContact O-CD2 3.37Å; V232-L274 HydrophobicContact CG2-CB 4.39Å; S272-L274 PolarHBondContact O-N 3.48Å; S272-L274 PolarHBondContact OG-N 3.45Å; L274-K395 WeakPolarHBondContact O-CB 3.24Å; L274-K395 PolarHBondContact O-N 3.17Å
275	L	92.6	Very high	88.7	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.4	-170.8	-60.9	175.7	0	0	0	110	V223 V232 L240 L269 S272 K395 L397	V223-L275 HydrophobicContact CG1-CD1 4.22Å; V223-L275 HydrophobicContact CG2-CD1 4.37Å; V232-L275 HydrophobicContact CB-CD2 4.45Å; V232-L275 HydrophobicContact CG1-CD2 4.16Å; V232-L275 HydrophobicContact CG2-CD2 3.54Å; V232-L275 HydrophobicContact CG2-CG 4.42Å; L240-L275 HydrophobicContact CD2-CD1 3.99Å; L269-L275 HydrophobicContact CD1-CB 4.35Å; L269-L275 HydrophobicContact CD1-CD1 3.78Å; S272-L275 PolarHBondContact O-N 2.91Å; L275-K395 HydrophobicContact CD2-CB 4.41Å; L275-L397 HydrophobicContact CB-CD1 4.11Å; L275-L397 HydrophobicContact CD1-CD1 4.06Å; L275-L397 HydrophobicContact CD2-CD1 3.78Å; L275-L397 HydrophobicContact CD2-CD2 4.35Å; L275-L397 HydrophobicContact CD2-CG 4.06Å; L275-L397 HydrophobicContact CG-CD1 4.2Å
276	L	92.4	Very high	86.4	Confident	14 Å²	14	32.8 Å²	32.8	7%	0.073	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	98.6	170.2	-175.3	60.6	0	0	0	109.1	V278 F320 F325 Q394 K395 L396 L397	L276-V278 HydrophobicContact CD2-CG2 4.38Å; L276-V278 HydrophobicContact CG-CG2 3.96Å; L276-V278 PolarHBondContact O-N 3.42Å; L276-F320 HydrophobicContact CD1-CE1 4.36Å; L276-F320 HydrophobicContact CD1-CZ 4.01Å; L276-F325 HydrophobicContact CD2-CE1 4.33Å; L276-F325 HydrophobicContact CD2-CZ 4.16Å; L276-Q394 HydrophobicContact CB-CB 4.27Å; L276-K395 PolarHBondContact N-O 2.9Å; L276-L396 HydrophobicContact CB-CD2 4.08Å; L276-L396 HydrophobicContact CD2-CD2 3.68Å; L276-L396 HydrophobicContact CG-CD2 4.21Å; L276-L397 PolarHBondContact O-N 3.39Å
277	P	94.1	Very high	84	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	114.3	180	33.9	-37.8	0	0	0	111.6	F28 L269 I314	F28-P277 HydrophobicContact CE2-CB 3.75Å; F28-P277 HydrophobicContact CZ-CB 3.88Å; L269-P277 HydrophobicContact CD2-CB 3.75Å; L269-P277 HydrophobicContact CD2-CG 4.05Å; L269-P277 HydrophobicContact CG-CB 4.04Å; L269-P277 HydrophobicContact CG-CG 3.92Å; P277-I314 HydrophobicContact CB-CB 4.01Å; P277-I314 HydrophobicContact CB-CD1 4.44Å; P277-I314 HydrophobicContact CB-CG2 3.72Å; P277-I314 HydrophobicContact CG-CB 4.15Å; P277-I314 HydrophobicContact CG-CG2 3.41Å; P277-I314 VanDerWaalsContact CG-CG2 3.41Å; P277-I314 PolarHBondContact O-N 3.32Å
278	V	92.4	Very high	81.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.2	-175.4	-174.4	0	0	0	0	111.1	F28 L276 L311 F320 F325 L397 I399	F28-V278 WeakPolarHBondContact CD2-O 3.07Å; L276-V278 HydrophobicContact CD2-CG2 4.38Å; L276-V278 HydrophobicContact CG-CG2 3.96Å; L276-V278 PolarHBondContact O-N 3.42Å; V278-L311 HydrophobicContact CG1-CB 3.92Å; V278-L311 HydrophobicContact CG1-CD1 4.26Å; V278-L311 HydrophobicContact CG1-CD2 4.09Å; V278-L311 HydrophobicContact CG1-CG 4.32Å; V278-F320 HydrophobicContact CB-CE2 4.43Å; V278-F320 HydrophobicContact CG1-CD2 4.24Å; V278-F320 HydrophobicContact CG1-CE2 4.02Å; V278-F320 HydrophobicContact CG2-CE2 3.94Å; V278-F320 HydrophobicContact CG2-CZ 4.36Å; V278-F325 HydrophobicContact CG2-CE1 4.03Å; V278-F325 HydrophobicContact CG2-CZ 4.02Å; V278-L397 PolarHBondContact N-O 2.86Å; V278-I399 HydrophobicContact CB-CD1 3.72Å; V278-I399 HydrophobicContact CB-CG1 4.13Å; V278-I399 HydrophobicContact CB-CG2 3.89Å; V278-I399 HydrophobicContact CG1-CD1 3.89Å; V278-I399 HydrophobicContact CG1-CG2 3.91Å; V278-I399 HydrophobicContact CG2-CD1 3.82Å; V278-I399 HydrophobicContact CG2-CG1 4.49Å
279	V	91.5	Very high	79.2	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.9	176.3	-172.9	0	0	0	0	109	F28 E281 L311 K312 I314	F28-V279 HydrophobicContact CB-CB 4.46Å; F28-V279 HydrophobicContact CB-CG1 4.48Å; F28-V279 HydrophobicContact CB-CG2 3.83Å; F28-V279 HydrophobicContact CG-CG2 4.46Å; V279-E281 HydrophobicContact CG1-CG 4.37Å; V279-L311 WeakPolarHBondContact O-CA 3.47Å; V279-K312 PolarHBondContact N-O 3.21Å; V279-K312 PolarHBondContact O-N 3.47Å; V279-I314 HydrophobicContact CG2-CB 4.15Å; V279-I314 HydrophobicContact CG2-CG1 4.09Å
280	I	89.2	Confident	77	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.8	172.8	-53.3	-176.4	0	0	0	108.6	L27 P296 L309 L311 I399 V402 I404	L27-I280 HydrophobicContact CD2-CD1 3.72Å; L27-I280 HydrophobicContact CD2-CG1 4.27Å; I280-P296 WeakPolarHBondContact O-CB 3.25Å; I280-P296 WeakPolarHBondContact O-CG 3.41Å; I280-L309 HydrophobicContact CG2-CB 4.19Å; I280-L309 HydrophobicContact CG2-CD1 4.5Å; I280-L309 HydrophobicContact CG2-CD2 4.41Å; I280-L311 HydrophobicContact CB-CD2 4.48Å; I280-L311 HydrophobicContact CG1-CD2 3.88Å; I280-I399 HydrophobicContact CD1-CG2 3.89Å; I280-I399 HydrophobicContact CG1-CG2 3.68Å; I280-V402 HydrophobicContact CD1-CG2 4.25Å; I280-I404 HydrophobicContact CD1-CD1 3.63Å; I280-I404 HydrophobicContact CD1-CG1 4.23Å; I280-I404 HydrophobicContact CG2-CD1 4.37Å
281	E	86.2	Confident	74.9	Confident	18 Å²	18	52.8 Å²	52.8	8%	0.084	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	156.6	175.1	-69.9	179.8	174.8	0	0	110.4	V279 L309 R310 K312 Y319	V279-E281 HydrophobicContact CG1-CG 4.37Å; E281-L309 CarbonylContact O-C 3.49Å; E281-L309 WeakPolarHBondContact O-CA 3.41Å; E281-R310 PolarHBondContact N-O 3.12Å; E281-R310 PolarHBondContact O-N 3.23Å; E281-K312 WeakPolarHBondContact OE1-CD 3.35Å; E281-K312 IonicContact OE1-NZ 3.19Å; E281-Y319 WeakPolarHBondContact OE2-CE1 3.21Å; E281-Y319 PolarHBondContact OE2-OH 3.29Å
282	S	82.2	Confident	72.9	Confident	8 Å²	8	55 Å²	55	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	137.8	170.4	-171.2	0	0	0	0	109.9	V284	S282-V284 PolarHBondContact O-N 3.36Å; S282-V284 PolarHBondContact OG-N 3.13Å; S282-V284 PolarHBondContact OG-O 3.1Å
283	S	70.6	Confident	71.1	Confident	22 Å²	22	56.4 Å²	56.4	15%	0.154	31%	0.307	C	S	.	.	S	Bend	trans	-71.3	-23.2	170.6	67.8	0	0	0	0	112.5	K285 S308	S283-K285 PolarHBondContact O-N 3.17Å; S283-S308 WeakPolarHBondContact CB-O 3.31Å; S283-S308 WeakPolarHBondContact CB-OG 3.5Å; S283-S308 PolarHBondContact N-O 3.25Å; S283-S308 VanDerWaalsContact OG-C 3.28Å; S283-S308 WeakPolarHBondContact OG-CB 3.03Å; S283-S308 PolarHBondContact OG-O 3.16Å; S283-S308 PolarHBondContact OG-OG 3.28Å
284	V	68.1	Low	69.5	Low	84 Å²	84	57.1 Å²	57.1	51%	0.509	31%	0.305	S	S	.	.	S	Bend	trans	-75.8	122	173.9	-176.7	0	0	0	0	106.6	S282 S286	S282-V284 PolarHBondContact O-N 3.36Å; S282-V284 PolarHBondContact OG-N 3.13Å; S282-V284 PolarHBondContact OG-O 3.1Å; V284-S286 PolarHBondContact O-N 3.26Å
285	K	55.4	Low	68	Low	197 Å²	197	57.5 Å²	57.5	86%	0.857	31%	0.309	S	S	*	.			trans	-64	79.7	173.5	-67.6	-177.4	-180	179.1	0	109.4	S283	S283-K285 PolarHBondContact O-N 3.17Å
286	S	50.6	Low	66.7	Low	55 Å²	55	58.1 Å²	58.1	39%	0.385	31%	0.314	S	S	.	.			trans	-71.4	167.5	156.6	65.8	0	0	0	0	107.3	V284 E288	V284-S286 PolarHBondContact O-N 3.26Å; S286-E288 PolarHBondContact O-N 2.87Å
287	N	47.4	Very low	65.6	Low	128 Å²	128	61 Å²	61	68%	0.684	33%	0.328	S	S	*	.	S	Bend	trans	-68.8	42.2	-171.7	-65.6	-44.8	0	0	0	114.5	N289 L290	N287-N289 PolarHBondContact O-N 3.39Å; N287-L290 HydrophobicContact CB-CD1 3.4Å; N287-L290 HydrophobicContact CB-CG 3.88Å; N287-L290 VanDerWaalsContact O-CB 3.32Å; N287-L290 WeakPolarHBondContact O-CB 3.1Å; N287-L290 VanDerWaalsContact O-CG 3.29Å; N287-L290 WeakPolarHBondContact O-CG 3.41Å; N287-L290 PolarHBondContact O-N 2.98Å
288	E	47.3	Very low	65	Low	87 Å²	87	61 Å²	61	41%	0.407	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-55.4	-21.5	176.5	-67.9	-177	170.3	0	0	112.4	S286 L290 G291	S286-E288 PolarHBondContact O-N 2.87Å; E288-L290 PolarHBondContact O-N 3.44Å; E288-L290 VanDerWaalsContact O-N 3.08Å; E288-G291 PolarHBondContact O-N 3.41Å
289	N	45	Very low	64.5	Low	147 Å²	147	63.3 Å²	63.3	79%	0.786	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-63.9	-7.1	170.2	-78.7	-20.5	0	0	0	115.1	N287 G291	N287-N289 PolarHBondContact O-N 3.39Å; N289-G291 VanDerWaalsContact C-N 3.26Å; N289-G291 PolarHBondContact O-N 3.19Å
290	L	48.6	Very low	64.3	Low	104 Å²	104	63.4 Å²	63.4	55%	0.545	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-78.8	-6.6	178	-66.7	170.4	0	0	0	113.4	N287 E288 F292	N287-L290 HydrophobicContact CB-CD1 3.4Å; N287-L290 HydrophobicContact CB-CG 3.88Å; N287-L290 VanDerWaalsContact O-CB 3.32Å; N287-L290 WeakPolarHBondContact O-CB 3.1Å; N287-L290 VanDerWaalsContact O-CG 3.29Å; N287-L290 WeakPolarHBondContact O-CG 3.41Å; N287-L290 PolarHBondContact O-N 2.98Å; E288-L290 PolarHBondContact O-N 3.44Å; E288-L290 VanDerWaalsContact O-N 3.08Å; L290-F292 HydrophobicContact CB-CD2 3.45Å; L290-F292 VanDerWaalsContact CB-CD2 3.45Å; L290-F292 HydrophobicContact CB-CE2 3.34Å; L290-F292 HydrophobicContact CB-CG 4.32Å; L290-F292 HydrophobicContact CB-CZ 4.08Å; L290-F292 HydrophobicContact CD1-CD2 4.15Å; L290-F292 HydrophobicContact CD1-CE2 3.48Å; L290-F292 VanDerWaalsContact CD1-CE2 3.48Å; L290-F292 HydrophobicContact CD1-CZ 4.38Å; L290-F292 HydrophobicContact CG-CD2 4.43Å; L290-F292 HydrophobicContact CG-CE2 3.97Å; L290-F292 PolarHBondContact O-N 3.2Å
291	G	49.9	Very low	64	Low	37 Å²	37	64.4 Å²	64.4	38%	0.381	35%	0.35	S	S	.	.			trans	71	14.1	174.8	0	0	0	0	0	114.5	R251 E288 N289	R251-G291 PolarHBondContact NH2-O 2.91Å; E288-G291 PolarHBondContact O-N 3.41Å; N289-G291 VanDerWaalsContact C-N 3.26Å; N289-G291 PolarHBondContact O-N 3.19Å
292	F	52.5	Low	63.8	Low	139 Å²	139	64.5 Å²	64.5	61%	0.61	35%	0.351	S	S	*	.			trans	-66	139.1	176.3	-63.4	-55.9	0	0	0	111.4	L290 I294	L290-F292 HydrophobicContact CB-CD2 3.45Å; L290-F292 VanDerWaalsContact CB-CD2 3.45Å; L290-F292 HydrophobicContact CB-CE2 3.34Å; L290-F292 HydrophobicContact CB-CG 4.32Å; L290-F292 HydrophobicContact CB-CZ 4.08Å; L290-F292 HydrophobicContact CD1-CD2 4.15Å; L290-F292 HydrophobicContact CD1-CE2 3.48Å; L290-F292 VanDerWaalsContact CD1-CE2 3.48Å; L290-F292 HydrophobicContact CD1-CZ 4.38Å; L290-F292 HydrophobicContact CG-CD2 4.43Å; L290-F292 HydrophobicContact CG-CE2 3.97Å; L290-F292 PolarHBondContact O-N 3.2Å; F292-I294 VanDerWaalsContact C-N 3.33Å; F292-I294 HydrophobicContact CB-CD1 3.93Å; F292-I294 HydrophobicContact CB-CG1 4.1Å; F292-I294 HydrophobicContact CG-CD1 4.4Å; F292-I294 PolarHBondContact O-N 2.96Å
293	S	54.7	Low	63.6	Low	31 Å²	31	67 Å²	67	22%	0.217	37%	0.366	C	S	.	.			trans	-98.7	57.8	179.1	-48.8	0	0	0	0	110	R205 R251	R205-S293 PolarHBondContact NH2-O 3.48Å; R251-S293 PolarHBondContact NH1-OG 2.78Å
294	I	57.7	Low	64.2	Low	95 Å²	95	72.2 Å²	72.2	49%	0.487	39%	0.387	S	S	.	.			trans	-108.7	142.2	-179.1	-57.8	170.1	0	0	0	106.7	F292 I297	F292-I294 VanDerWaalsContact C-N 3.33Å; F292-I294 HydrophobicContact CB-CD1 3.93Å; F292-I294 HydrophobicContact CB-CG1 4.1Å; F292-I294 HydrophobicContact CG-CD1 4.4Å; F292-I294 PolarHBondContact O-N 2.96Å; I294-I297 HydrophobicContact CG2-CD1 4.23Å
295	P	59.8	Low	65	Low	35 Å²	35	69.3 Å²	69.3	23%	0.227	37%	0.37	C	S	.	.			trans	-49.5	148	170.7	-24.7	33.3	0	0	0	111.3	I29 N204 I297	I29-P295 HydrophobicContact CG2-CB 4.22Å; I29-P295 HydrophobicContact CG2-CG 3.93Å; N204-P295 WeakPolarHBondContact ND2-CG 3.33Å; P295-I297 PolarHBondContact O-N 3.49Å
296	P	65.6	Low	66.5	Low	15 Å²	15	64 Å²	64	10%	0.097	35%	0.35	C	S	.	.			trans	-59.1	116.4	176.5	25.9	-34	0	0	0	108.7	L27 I280	L27-P296 HydrophobicContact CD1-CG 4.35Å; I280-P296 WeakPolarHBondContact O-CB 3.25Å; I280-P296 WeakPolarHBondContact O-CG 3.41Å
297	I	69.8	Low	68.4	Low	73 Å²	73	61.4 Å²	61.4	37%	0.374	33%	0.332	S	S	.	.			trans	-99.2	114.4	170.7	-66.8	172.6	0	0	0	106.3	I294 P295 P405 Y407	I294-I297 HydrophobicContact CG2-CD1 4.23Å; P295-I297 PolarHBondContact O-N 3.49Å; I297-P405 HydrophobicContact CG1-CB 4.24Å; I297-Y407 HydrophobicContact CD1-CE2 4.1Å; I297-Y407 HydrophobicContact CG2-CD2 3.19Å; I297-Y407 HydrophobicContact CG2-CE2 3.75Å; I297-Y407 HydrophobicContact CG2-CG 4.09Å
298	L	81.8	Confident	70.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	142.8	176	-56.2	-172.3	0	0	0	109.2	L307 I404 P405 L406 Y407	L298-L307 HydrophobicContact CB-CD1 3.87Å; L298-L307 HydrophobicContact CD1-CD1 3.55Å; L298-L307 HydrophobicContact CD1-CD2 4.16Å; L298-L307 HydrophobicContact CD1-CG 4.3Å; L298-L307 HydrophobicContact CG-CD1 4.3Å; L298-I404 HydrophobicContact CD1-CG2 3.55Å; L298-I404 HydrophobicContact CG-CG2 3.78Å; L298-P405 PolarHBondContact N-O 3.47Å; L298-L406 HydrophobicContact CB-CD1 4.23Å; L298-L406 CarbonylContact O-C 3.53Å; L298-L406 WeakPolarHBondContact O-CA 3.43Å; L298-Y407 PolarHBondContact O-N 3.37Å
299	S	81.7	Confident	72.3	Confident	48 Å²	48	52 Å²	52	34%	0.336	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.2	174.7	58.3	0	0	0	0	110.9	Y407	S299-Y407 CarbonylContact C-O 3.56Å; S299-Y407 VanDerWaalsContact CA-O 3.25Å; S299-Y407 WeakPolarHBondContact CA-O 3.32Å
300	I	85.7	Confident	74.5	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.2	179.4	-66.8	176	0	0	0	109.6	P305 L307 L366 L406 Y407 M408 I409	I300-P305 HydrophobicContact CG2-CB 3.84Å; I300-L307 HydrophobicContact CD1-CB 3.59Å; I300-L307 HydrophobicContact CD1-CD1 3.73Å; I300-L307 HydrophobicContact CD1-CD2 4.36Å; I300-L307 HydrophobicContact CD1-CG 4.07Å; I300-L307 HydrophobicContact CG1-CB 4.24Å; I300-L307 HydrophobicContact CG1-CD1 3.85Å; I300-L366 HydrophobicContact CD1-CD1 3.26Å; I300-L366 HydrophobicContact CD1-CG 4.17Å; I300-L406 HydrophobicContact CB-CD1 4.03Å; I300-L406 HydrophobicContact CD1-CD1 3.26Å; I300-L406 HydrophobicContact CD1-CD2 3.87Å; I300-L406 HydrophobicContact CD1-CG 4.2Å; I300-L406 HydrophobicContact CG1-CD1 3.47Å; I300-L406 VanDerWaalsContact CG1-CD1 3.47Å; I300-Y407 PolarHBondContact N-O 3.15Å; I300-M408 WeakPolarHBondContact O-CA 3.45Å; I300-I409 VanDerWaalsContact O-CG1 3.28Å; I300-I409 WeakPolarHBondContact O-CG1 3.47Å; I300-I409 PolarHBondContact O-N 3.32Å
301	D	84.4	Confident	76.5	Confident	25 Å²	25	42.7 Å²	42.7	13%	0.134	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	124.7	174.2	-167.5	-39.7	0	0	0	110.5	T303 H304 P305 K540	D301-T303 PolarHBondContact O-N 3.44Å; D301-T303 PolarHBondContact OD1-N 2.88Å; D301-T303 PolarHBondContact OD1-OG1 2.97Å; D301-H304 CarbonylContact O-C 3.57Å; D301-H304 PolarHBondContact O-N 3.33Å; D301-H304 VanDerWaalsContact O-N 3.16Å; D301-P305 VanDerWaalsContact O-CA 3.25Å; D301-P305 WeakPolarHBondContact O-CA 3.48Å; D301-P305 VanDerWaalsContact O-N 3.16Å; D301-K540 IonicContact OD2-NZ 3.2Å; D301-K540 PolarHBondContact OD2-NZ 2.92Å
302	Q	80.7	Confident	78.4	Confident	21 Å²	21	41.5 Å²	41.5	10%	0.098	22%	0.217	C	C	.	.	S	Bend	trans	-56.3	-33.8	179	-171	-170.1	12.2	0	0	112.6	T372 M408 I409 T410 D466 N468	Q302-T372 PolarHBondContact NE2-O 2.83Å; Q302-M408 HydrophobicContact CG-CE 4.36Å; Q302-I409 PolarHBondContact N-O 2.89Å; Q302-T410 PolarHBondContact OE1-OG1 3.47Å; Q302-D466 PolarHBondContact NE2-OD2 3.42Å; Q302-D466 PolarHBondContact OE1-OD2 2.82Å; Q302-N468 PolarHBondContact NE2-ND2 3.34Å
303	T	79	Confident	80.3	Confident	61 Å²	61	36 Å²	36	37%	0.374	19%	0.193	S	C	.	.	S	Bend	trans	-80.2	-27.6	-178.6	62.6	0	0	0	0	113	D301	D301-T303 PolarHBondContact O-N 3.44Å; D301-T303 PolarHBondContact OD1-N 2.88Å; D301-T303 PolarHBondContact OD1-OG1 2.97Å
304	H	83.2	Confident	82.1	Confident	130 Å²	130	34.5 Å²	34.5	60%	0.602	18%	0.183	S	C	*	.	S	Bend	trans	-135.7	77.5	180	-62	90.5	0	0	0	108.6	D301 I306	D301-H304 CarbonylContact O-C 3.57Å; D301-H304 PolarHBondContact O-N 3.33Å; D301-H304 VanDerWaalsContact O-N 3.16Å; H304-I306 PolarHBondContact O-N 2.96Å
305	P	84.6	Confident	83.7	Confident	23 Å²	23	30.7 Å²	30.7	15%	0.149	16%	0.163	C	C	.	.			trans	-77.7	58.7	-167	31.8	-37.6	0	0	0	113	I300 D301 T365 L366 L368	I300-P305 HydrophobicContact CG2-CB 3.84Å; D301-P305 VanDerWaalsContact O-CA 3.25Å; D301-P305 WeakPolarHBondContact O-CA 3.48Å; D301-P305 VanDerWaalsContact O-N 3.16Å; P305-T365 WeakPolarHBondContact O-CA 3.19Å; P305-L366 HydrophobicContact CB-CB 4.33Å; P305-L366 VanDerWaalsContact CG-O 3.26Å; P305-L366 WeakPolarHBondContact CG-O 3.43Å; P305-L366 PolarHBondContact O-N 2.71Å; P305-L368 HydrophobicContact CB-CD1 3.81Å; P305-L368 HydrophobicContact CG-CD1 4.46Å
306	I	87.2	Confident	84.9	Confident	85 Å²	85	31 Å²	31	44%	0.436	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	110.6	179.3	-56.4	175.6	0	0	0	108.1	H304	H304-I306 PolarHBondContact O-N 2.96Å
307	L	88.9	Confident	85.7	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.7	168.3	-173.4	54.1	0	0	0	109.5	L298 I300 F353 Q363 L364 L379	L298-L307 HydrophobicContact CB-CD1 3.87Å; L298-L307 HydrophobicContact CD1-CD1 3.55Å; L298-L307 HydrophobicContact CD1-CD2 4.16Å; L298-L307 HydrophobicContact CD1-CG 4.3Å; L298-L307 HydrophobicContact CG-CD1 4.3Å; I300-L307 HydrophobicContact CD1-CB 3.59Å; I300-L307 HydrophobicContact CD1-CD1 3.73Å; I300-L307 HydrophobicContact CD1-CD2 4.36Å; I300-L307 HydrophobicContact CD1-CG 4.07Å; I300-L307 HydrophobicContact CG1-CB 4.24Å; I300-L307 HydrophobicContact CG1-CD1 3.85Å; L307-F353 HydrophobicContact CD2-CE1 4.06Å; L307-F353 HydrophobicContact CD2-CZ 4.11Å; L307-F353 HydrophobicContact CG-CE1 4.35Å; L307-Q363 CarbonylContact O-C 3.57Å; L307-Q363 VanDerWaalsContact O-CA 3.24Å; L307-Q363 WeakPolarHBondContact O-CA 3.49Å; L307-L364 PolarHBondContact N-O 2.82Å; L307-L364 PolarHBondContact O-N 3.13Å; L307-L379 HydrophobicContact CD2-CD2 3.39Å
308	S	88.4	Confident	86.6	Confident	18 Å²	18	34.6 Å²	34.6	13%	0.126	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	112.2	175.4	-176.9	0	0	0	0	109.9	S283 L362 Q363	S283-S308 WeakPolarHBondContact CB-O 3.31Å; S283-S308 WeakPolarHBondContact CB-OG 3.5Å; S283-S308 PolarHBondContact N-O 3.25Å; S283-S308 VanDerWaalsContact OG-C 3.28Å; S283-S308 WeakPolarHBondContact OG-CB 3.03Å; S283-S308 PolarHBondContact OG-O 3.16Å; S283-S308 PolarHBondContact OG-OG 3.28Å; S308-L362 WeakPolarHBondContact CA-O 3.49Å; S308-Q363 WeakPolarHBondContact OG-CG 3.44Å
309	L	90.1	Very high	86.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	161.5	-174.5	65.2	84.2	0	0	0	112.1	I280 E281 L311 I327 F353 A361 L362	I280-L309 HydrophobicContact CG2-CB 4.19Å; I280-L309 HydrophobicContact CG2-CD1 4.5Å; I280-L309 HydrophobicContact CG2-CD2 4.41Å; E281-L309 CarbonylContact O-C 3.49Å; E281-L309 WeakPolarHBondContact O-CA 3.41Å; L309-L311 HydrophobicContact CD1-CD2 4Å; L309-L311 HydrophobicContact CD1-CG 4.34Å; L309-I327 HydrophobicContact CD1-CD1 4.09Å; L309-F353 HydrophobicContact CD2-CD1 4.04Å; L309-F353 HydrophobicContact CD2-CE1 3.37Å; L309-F353 HydrophobicContact CD2-CZ 3.67Å; L309-F353 HydrophobicContact CG-CD1 4.33Å; L309-F353 HydrophobicContact CG-CE1 4.05Å; L309-A361 CarbonylContact O-C 3.42Å; L309-A361 WeakPolarHBondContact O-CA 3.38Å; L309-L362 HydrophobicContact CD1-CB 3.73Å; L309-L362 HydrophobicContact CD1-CD1 3.86Å; L309-L362 HydrophobicContact CD1-CG 4.43Å; L309-L362 HydrophobicContact CG-CB 4.08Å; L309-L362 PolarHBondContact N-O 3.45Å; L309-L362 PolarHBondContact O-N 3.35Å
310	R	90.2	Very high	87.3	Confident	50 Å²	50	37.3 Å²	37.3	19%	0.189	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152	172.2	-64	-172.2	166.2	135.1	0.5	110.2	E281 Y319 N359 N360 A361	E281-R310 PolarHBondContact N-O 3.12Å; E281-R310 PolarHBondContact O-N 3.23Å; R310-Y319 HydrophobicContact CB-CD1 3.64Å; R310-Y319 HydrophobicContact CB-CE1 3.72Å; R310-Y319 HydrophobicContact CB-CG 4.49Å; R310-Y319 HydrophobicContact CG-CD1 4.43Å; R310-Y319 HydrophobicContact CG-CE1 4.46Å; R310-N359 PolarHBondContact NE-O 3.39Å; R310-N359 PolarHBondContact NH2-O 3.05Å; R310-N359 VanDerWaalsContact NH2-O 3.08Å; R310-N360 WeakPolarHBondContact CG-O 3.14Å; R310-A361 HydrophobicContact CG-CB 4.41Å
311	L	91.1	Very high	87.5	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135	177.2	-61.2	-173.6	0	0	0	110.5	V278 V279 I280 L309 Y319 F320 F325 I327 L362	V278-L311 HydrophobicContact CG1-CB 3.92Å; V278-L311 HydrophobicContact CG1-CD1 4.26Å; V278-L311 HydrophobicContact CG1-CD2 4.09Å; V278-L311 HydrophobicContact CG1-CG 4.32Å; V279-L311 WeakPolarHBondContact O-CA 3.47Å; I280-L311 HydrophobicContact CB-CD2 4.48Å; I280-L311 HydrophobicContact CG1-CD2 3.88Å; L309-L311 HydrophobicContact CD1-CD2 4Å; L309-L311 HydrophobicContact CD1-CG 4.34Å; L311-Y319 CarbonylContact O-C 3.56Å; L311-Y319 WeakPolarHBondContact O-CA 3.08Å; L311-Y319 WeakPolarHBondContact O-CD1 3.46Å; L311-F320 HydrophobicContact CB-CB 4.37Å; L311-F320 HydrophobicContact CB-CD2 4.05Å; L311-F320 PolarHBondContact O-N 3.43Å; L311-F325 HydrophobicContact CD1-CB 3.94Å; L311-F325 HydrophobicContact CD1-CD1 4.07Å; L311-F325 HydrophobicContact CD1-CD2 3.47Å; L311-F325 VanDerWaalsContact CD1-CD2 3.47Å; L311-F325 HydrophobicContact CD1-CE1 4.49Å; L311-F325 HydrophobicContact CD1-CE2 3.98Å; L311-F325 HydrophobicContact CD1-CG 3.53Å; L311-F325 HydrophobicContact CD1-CZ 4.45Å; L311-I327 HydrophobicContact CD1-CD1 3.82Å; L311-I327 HydrophobicContact CD2-CD1 4.22Å; L311-I327 HydrophobicContact CG-CD1 4.3Å; L311-L362 HydrophobicContact CD1-CD1 4.21Å; L311-L362 HydrophobicContact CG-CD1 4.26Å
312	K	89.9	Confident	87.7	Confident	13 Å²	13	42.2 Å²	42.2	6%	0.057	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.3	-174.6	-166.2	-178.9	-178.3	-175.2	0	110.9	S31 V279 E281 T316 D317 Y319	S31-K312 VanDerWaalsContact OG-CE 3.25Å; S31-K312 WeakPolarHBondContact OG-CE 3.31Å; S31-K312 PolarHBondContact OG-NZ 3.29Å; V279-K312 PolarHBondContact N-O 3.21Å; V279-K312 PolarHBondContact O-N 3.47Å; E281-K312 WeakPolarHBondContact OE1-CD 3.35Å; E281-K312 IonicContact OE1-NZ 3.19Å; K312-T316 WeakPolarHBondContact CE-O 3.18Å; K312-T316 WeakPolarHBondContact CG-O 3.17Å; K312-D317 IonicContact NZ-OD1 3.02Å; K312-D317 PolarHBondContact NZ-OD1 3.3Å; K312-Y319 HydrophobicContact CB-CD1 3.97Å; K312-Y319 HydrophobicContact CB-CE1 4.1Å; K312-Y319 HydrophobicContact CD-CE1 4.07Å; K312-Y319 HydrophobicContact CG-CD1 4.27Å; K312-Y319 HydrophobicContact CG-CE1 4.29Å
313	H	91.5	Very high	87.9	Confident	22 Å²	22	42.7 Å²	42.7	10%	0.102	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	142.7	172.7	-172.5	-84.3	0	0	0	110	T270 W315 T316 F320	T270-H313 WeakPolarHBondContact CG2-CE1 3.28Å; T270-H313 PolarHBondContact OG1-CE1 2.94Å; H313-W315 WeakPolarHBondContact ND1-CB 3.22Å; H313-W315 PolarHBondContact ND1-N 3.18Å; H313-W315 VanDerWaalsContact ND1-N 3.13Å; H313-W315 PolarHBondContact O-N 3.32Å; H313-T316 WeakPolarHBondContact CB-OG1 3.41Å; H313-T316 PolarHBondContact O-N 3.44Å; H313-F320 HydrophobicContact CB-CE1 4.46Å; H313-F320 HydrophobicContact CB-CE2 3.88Å; H313-F320 HydrophobicContact CB-CZ 3.63Å; H313-F320 AromaticContact CD2-CZ 3.88Å; H313-F320 VanDerWaalsContact N-CE2 3.29Å
314	I	92.1	Very high	88.3	Confident	1 Å²	1	42 Å²	42	1%	0.005	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.8	-175.9	-156.5	174.5	0	0	0	114.7	F28 S31 I32 F266 L269 P277 V279	F28-I314 HydrophobicContact CD1-CD1 3.42Å; F28-I314 VanDerWaalsContact CD1-CD1 3.42Å; F28-I314 HydrophobicContact CD1-CG1 4.47Å; F28-I314 HydrophobicContact CD2-CD1 4.47Å; F28-I314 HydrophobicContact CE1-CD1 3.41Å; F28-I314 VanDerWaalsContact CE1-CD1 3.41Å; F28-I314 HydrophobicContact CE2-CD1 4.47Å; F28-I314 HydrophobicContact CG-CD1 3.98Å; F28-I314 HydrophobicContact CZ-CD1 3.97Å; S31-I314 CarbonylContact C-O 3.41Å; S31-I314 VanDerWaalsContact CA-O 3.31Å; S31-I314 WeakPolarHBondContact CA-O 3.35Å; I32-I314 PolarHBondContact N-O 3.02Å; F266-I314 HydrophobicContact CD1-CD1 4.02Å; F266-I314 HydrophobicContact CD1-CG1 4.17Å; F266-I314 HydrophobicContact CD1-CG2 4.38Å; F266-I314 HydrophobicContact CE1-CD1 3.58Å; F266-I314 HydrophobicContact CE1-CG1 3.85Å; L269-I314 HydrophobicContact CD2-CD1 4.1Å; L269-I314 HydrophobicContact CD2-CG2 4.31Å; P277-I314 HydrophobicContact CB-CB 4.01Å; P277-I314 HydrophobicContact CB-CD1 4.44Å; P277-I314 HydrophobicContact CB-CG2 3.72Å; P277-I314 HydrophobicContact CG-CB 4.15Å; P277-I314 HydrophobicContact CG-CG2 3.41Å; P277-I314 VanDerWaalsContact CG-CG2 3.41Å; P277-I314 PolarHBondContact O-N 3.32Å; V279-I314 HydrophobicContact CG2-CB 4.15Å; V279-I314 HydrophobicContact CG2-CG1 4.09Å
315	W	92.4	Very high	88.6	Confident	15 Å²	15	36 Å²	36	6%	0.057	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-3.6	-172.3	-170.6	-114.3	0	0	0	115	I32 K37 L68 V263 F266 T270 H313	I32-W315 HydrophobicContact CB-CE3 3.9Å; I32-W315 HydrophobicContact CB-CZ3 4.14Å; I32-W315 HydrophobicContact CG1-CE3 4Å; I32-W315 HydrophobicContact CG1-CZ3 4.07Å; I32-W315 HydrophobicContact CG2-CE3 4.05Å; I32-W315 HydrophobicContact CG2-CZ3 3.89Å; K37-W315 WeakPolarHBondContact CE-O 3.33Å; K37-W315 PolarHBondContact NZ-O 2.9Å; L68-W315 HydrophobicContact CD2-CH2 4.11Å; L68-W315 HydrophobicContact CD2-CZ2 4.18Å; V263-W315 HydrophobicContact CG1-CH2 3.77Å; V263-W315 HydrophobicContact CG1-CZ2 4.48Å; F266-W315 HydrophobicContact CB-CE3 3.57Å; F266-W315 HydrophobicContact CB-CH2 4.35Å; F266-W315 HydrophobicContact CB-CZ3 3.37Å; F266-W315 HydrophobicContact CG-CE3 4.31Å; F266-W315 HydrophobicContact CG-CZ3 4.17Å; T270-W315 HydrophobicContact CG2-CB 4.05Å; T270-W315 HydrophobicContact CG2-CG 4.17Å; T270-W315 VanDerWaalsContact OG1-CB 3.25Å; T270-W315 WeakPolarHBondContact OG1-CB 3.15Å; H313-W315 WeakPolarHBondContact ND1-CB 3.22Å; H313-W315 PolarHBondContact ND1-N 3.18Å; H313-W315 VanDerWaalsContact ND1-N 3.13Å; H313-W315 PolarHBondContact O-N 3.32Å
316	T	85.2	Confident	88.7	Confident	40 Å²	40	40 Å²	40	25%	0.245	20%	0.198	C	C	.	.			trans	-139.9	150	-170	63.1	0	0	0	0	111.4	K312 H313 T318	K312-T316 WeakPolarHBondContact CE-O 3.18Å; K312-T316 WeakPolarHBondContact CG-O 3.17Å; H313-T316 WeakPolarHBondContact CB-OG1 3.41Å; H313-T316 PolarHBondContact O-N 3.44Å; T316-T318 WeakPolarHBondContact CB-OG1 2.84Å; T316-T318 PolarHBondContact O-N 2.95Å; T316-T318 PolarHBondContact OG1-OG1 3.37Å
317	D	82.5	Confident	88.9	Confident	69 Å²	69	36.2 Å²	36.2	37%	0.369	18%	0.179	S	C	.	.	S	Bend	trans	-76.5	2.3	172.8	-72	-46.2	0	0	0	114.8	V34 K312	V34-D317 VanDerWaalsContact CG2-OD2 3.29Å; V34-D317 WeakPolarHBondContact CG2-OD2 2.99Å; V34-D317 PolarHBondContact N-OD2 3.38Å; K312-D317 IonicContact NZ-OD1 3.02Å; K312-D317 PolarHBondContact NZ-OD1 3.3Å
318	T	87.2	Confident	89	Confident	95 Å²	95	39.6 Å²	39.6	58%	0.583	19%	0.193	S	C	*	.	P	Polyproline II helix	trans	-89.1	134	-179.3	51	0	0	0	0	112.4	T316	T316-T318 WeakPolarHBondContact CB-OG1 2.84Å; T316-T318 PolarHBondContact O-N 2.95Å; T316-T318 PolarHBondContact OG1-OG1 3.37Å
319	Y	89.4	Confident	89.1	Confident	76 Å²	76	38.7 Å²	38.7	30%	0.298	19%	0.187	S	C	.	.	B	Isolated β-bridge	trans	-82.2	145.7	174.1	-64.1	-74.2	0	0	0	111.5	E281 R310 L311 K312	E281-Y319 WeakPolarHBondContact OE2-CE1 3.21Å; E281-Y319 PolarHBondContact OE2-OH 3.29Å; R310-Y319 HydrophobicContact CB-CD1 3.64Å; R310-Y319 HydrophobicContact CB-CE1 3.72Å; R310-Y319 HydrophobicContact CB-CG 4.49Å; R310-Y319 HydrophobicContact CG-CD1 4.43Å; R310-Y319 HydrophobicContact CG-CE1 4.46Å; L311-Y319 CarbonylContact O-C 3.56Å; L311-Y319 WeakPolarHBondContact O-CA 3.08Å; L311-Y319 WeakPolarHBondContact O-CD1 3.46Å; K312-Y319 HydrophobicContact CB-CD1 3.97Å; K312-Y319 HydrophobicContact CB-CE1 4.1Å; K312-Y319 HydrophobicContact CD-CE1 4.07Å; K312-Y319 HydrophobicContact CG-CD1 4.27Å; K312-Y319 HydrophobicContact CG-CE1 4.29Å
320	F	90.3	Very high	88.9	Confident	30 Å²	30	41.8 Å²	41.8	13%	0.132	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-72	156.7	169.3	-66.5	-74.6	0	0	0	111.3	L276 V278 L311 H313 E324 F325	L276-F320 HydrophobicContact CD1-CE1 4.36Å; L276-F320 HydrophobicContact CD1-CZ 4.01Å; V278-F320 HydrophobicContact CB-CE2 4.43Å; V278-F320 HydrophobicContact CG1-CD2 4.24Å; V278-F320 HydrophobicContact CG1-CE2 4.02Å; V278-F320 HydrophobicContact CG2-CE2 3.94Å; V278-F320 HydrophobicContact CG2-CZ 4.36Å; L311-F320 HydrophobicContact CB-CB 4.37Å; L311-F320 HydrophobicContact CB-CD2 4.05Å; L311-F320 PolarHBondContact O-N 3.43Å; H313-F320 HydrophobicContact CB-CE1 4.46Å; H313-F320 HydrophobicContact CB-CE2 3.88Å; H313-F320 HydrophobicContact CB-CZ 3.63Å; H313-F320 AromaticContact CD2-CZ 3.88Å; H313-F320 VanDerWaalsContact N-CE2 3.29Å; F320-E324 WeakPolarHBondContact CD1-OE2 3.49Å; F320-F325 HydrophobicContact CB-CD2 4.33Å; F320-F325 HydrophobicContact CB-CE2 3.58Å; F320-F325 HydrophobicContact CB-CZ 4.48Å; F320-F325 HydrophobicContact CD1-CE2 4.06Å; F320-F325 HydrophobicContact CD1-CZ 4.29Å; F320-F325 AromaticContact CD2-CE2 3.98Å; F320-F325 HydrophobicContact CD2-CE2 3.98Å; F320-F325 HydrophobicContact CD2-CZ 4.12Å; F320-F325 HydrophobicContact CE2-CZ 4.37Å; F320-F325 AromaticContact CG-CE2 3.63Å; F320-F325 HydrophobicContact CG-CE2 3.63Å; F320-F325 HydrophobicContact CG-CZ 4.07Å
321	K	89.8	Confident	88.9	Confident	127 Å²	127	39.4 Å²	39.4	55%	0.552	19%	0.192	S	C	*	.	P	Polyproline II helix	trans	-75.2	138.2	171.5	-63.7	176.2	179.4	178.2	0	109.8	S323 E324	K321-S323 PolarHBondContact O-N 3Å; K321-S323 VanDerWaalsContact O-N 3.12Å; K321-E324 HydrophobicContact CB-CG 4.18Å; K321-E324 WeakPolarHBondContact CB-OE1 3.36Å; K321-E324 PolarHBondContact N-OE1 3.33Å; K321-E324 WeakPolarHBondContact O-CB 3.33Å; K321-E324 PolarHBondContact O-N 3.37Å
322	P	87.2	Confident	88.7	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.026	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-53.2	-35.5	177.3	-29.5	37.2	0	0	0	113.6	E324 F325 Q355 A361 L362	P322-E324 PolarHBondContact O-N 2.84Å; P322-E324 VanDerWaalsContact O-N 3.13Å; P322-F325 PolarHBondContact O-N 2.93Å; P322-Q355 HydrophobicContact CB-CB 3.83Å; P322-Q355 HydrophobicContact CB-CG 3.78Å; P322-Q355 PolarHBondContact O-NE2 2.85Å; P322-A361 WeakPolarHBondContact CG-O 3.36Å; P322-L362 HydrophobicContact CB-CD2 3.91Å; P322-L362 HydrophobicContact CB-CG 4.04Å
323	S	86.4	Confident	88.7	Confident	31 Å²	31	40.6 Å²	40.6	22%	0.217	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.8	-16.6	179.2	65	0	0	0	0	115.3	K321 F325	K321-S323 PolarHBondContact O-N 3Å; K321-S323 VanDerWaalsContact O-N 3.12Å; S323-F325 VanDerWaalsContact C-N 3.26Å
324	E	86.4	Confident	88.4	Confident	48 Å²	48	40.6 Å²	40.6	22%	0.224	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-77.2	-13.7	179.6	-65.3	174.1	-130.9	0	0	112.6	F320 K321 P322 G386 T390	F320-E324 WeakPolarHBondContact CD1-OE2 3.49Å; K321-E324 HydrophobicContact CB-CG 4.18Å; K321-E324 WeakPolarHBondContact CB-OE1 3.36Å; K321-E324 PolarHBondContact N-OE1 3.33Å; K321-E324 WeakPolarHBondContact O-CB 3.33Å; K321-E324 PolarHBondContact O-N 3.37Å; P322-E324 PolarHBondContact O-N 2.84Å; P322-E324 VanDerWaalsContact O-N 3.13Å; E324-G386 PolarHBondContact O-N 3.18Å; E324-T390 HydrophobicContact CB-CG2 4.45Å
325	F	88.7	Confident	87.9	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.4	-175.1	-58.8	-88.1	0	0	0	111.3	L276 V278 L311 F320 P322 S323 I327 L396 I399	L276-F325 HydrophobicContact CD2-CE1 4.33Å; L276-F325 HydrophobicContact CD2-CZ 4.16Å; V278-F325 HydrophobicContact CG2-CE1 4.03Å; V278-F325 HydrophobicContact CG2-CZ 4.02Å; L311-F325 HydrophobicContact CD1-CB 3.94Å; L311-F325 HydrophobicContact CD1-CD1 4.07Å; L311-F325 HydrophobicContact CD1-CD2 3.47Å; L311-F325 VanDerWaalsContact CD1-CD2 3.47Å; L311-F325 HydrophobicContact CD1-CE1 4.49Å; L311-F325 HydrophobicContact CD1-CE2 3.98Å; L311-F325 HydrophobicContact CD1-CG 3.53Å; L311-F325 HydrophobicContact CD1-CZ 4.45Å; F320-F325 HydrophobicContact CB-CD2 4.33Å; F320-F325 HydrophobicContact CB-CE2 3.58Å; F320-F325 HydrophobicContact CB-CZ 4.48Å; F320-F325 HydrophobicContact CD1-CE2 4.06Å; F320-F325 HydrophobicContact CD1-CZ 4.29Å; F320-F325 AromaticContact CD2-CE2 3.98Å; F320-F325 HydrophobicContact CD2-CE2 3.98Å; F320-F325 HydrophobicContact CD2-CZ 4.12Å; F320-F325 HydrophobicContact CE2-CZ 4.37Å; F320-F325 AromaticContact CG-CE2 3.63Å; F320-F325 HydrophobicContact CG-CE2 3.63Å; F320-F325 HydrophobicContact CG-CZ 4.07Å; P322-F325 PolarHBondContact O-N 2.93Å; S323-F325 VanDerWaalsContact C-N 3.26Å; F325-I327 HydrophobicContact CB-CG1 4.23Å; F325-L396 HydrophobicContact CD1-CD1 4.24Å; F325-L396 HydrophobicContact CE1-CD1 4.33Å; F325-L396 HydrophobicContact CE1-CD2 3.81Å; F325-I399 HydrophobicContact CD1-CD1 3.81Å; F325-I399 HydrophobicContact CE1-CD1 3.76Å
326	E	88.4	Confident	86.9	Confident	108 Å²	108	47.2 Å²	47.2	51%	0.505	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.8	164.5	-175.2	172.2	-177.6	0	0	108.2	A383 T384	E326-A383 CarbonylContact O-C 3.49Å; E326-A383 WeakPolarHBondContact O-CA 3.49Å; E326-T384 PolarHBondContact N-O 2.92Å; E326-T384 PolarHBondContact O-N 2.82Å; E326-T384 PolarHBondContact O-OG1 3.43Å
327	I	89.9	Confident	86	Confident	5 Å²	5	57 Å²	57	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.3	-177.9	-51	-168.8	0	0	0	109	L309 L311 F325 T352 F353 L362 V381 A383	L309-I327 HydrophobicContact CD1-CD1 4.09Å; L311-I327 HydrophobicContact CD1-CD1 3.82Å; L311-I327 HydrophobicContact CD2-CD1 4.22Å; L311-I327 HydrophobicContact CG-CD1 4.3Å; F325-I327 HydrophobicContact CB-CG1 4.23Å; I327-T352 WeakPolarHBondContact O-CA 3.34Å; I327-F353 HydrophobicContact CB-CB 4.5Å; I327-F353 HydrophobicContact CB-CD2 3.73Å; I327-F353 HydrophobicContact CB-CE2 4.32Å; I327-F353 HydrophobicContact CB-CG 4.33Å; I327-F353 HydrophobicContact CG2-CD2 3.5Å; I327-F353 HydrophobicContact CG2-CE2 3.57Å; I327-F353 HydrophobicContact CG2-CG 4.41Å; I327-F353 WeakPolarHBondContact O-CD2 3.38Å; I327-F353 PolarHBondContact O-N 2.81Å; I327-F353 VanDerWaalsContact O-N 3.1Å; I327-L362 HydrophobicContact CD1-CD1 3.47Å; I327-L362 VanDerWaalsContact CD1-CD1 3.47Å; I327-L362 HydrophobicContact CG1-CD1 4.14Å; I327-V381 HydrophobicContact CG2-CG1 3.15Å; I327-A383 HydrophobicContact CG1-CB 3.99Å
328	K	90.9	Very high	84.9	Confident	73 Å²	73	59.4 Å²	59.4	32%	0.317	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.2	174.9	-172.2	174.1	-179.1	174	0	110.5	D349 T352 V381 T382	K328-D349 WeakPolarHBondContact CE-OD1 3.39Å; K328-D349 VanDerWaalsContact CE-OD2 3.25Å; K328-D349 WeakPolarHBondContact CE-OD2 3.29Å; K328-D349 IonicContact NZ-OD1 2.88Å; K328-D349 PolarHBondContact NZ-OD1 3.39Å; K328-D349 IonicContact NZ-OD2 3.75Å; K328-D349 PolarHBondContact NZ-OD2 3.01Å; K328-T352 HydrophobicContact CB-CG2 4.39Å; K328-V381 WeakPolarHBondContact O-CA 3.32Å; K328-T382 PolarHBondContact N-O 3.05Å; K328-T382 PolarHBondContact O-N 2.94Å
329	A	91	Very high	83.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.7	173.4	0	0	0	0	0	110.7	L350 G351 F353 L364 L379 D380	A329-L350 HydrophobicContact CB-CB 3.82Å; A329-L350 HydrophobicContact CB-CD1 4.21Å; A329-L350 PolarHBondContact O-N 3.46Å; A329-G351 PolarHBondContact N-O 3.06Å; A329-F353 HydrophobicContact CB-CE2 4.03Å; A329-L364 HydrophobicContact CB-CD2 3.38Å; A329-L379 HydrophobicContact CB-CD1 4.27Å; A329-D380 WeakPolarHBondContact CA-O 3.18Å
330	H	87.4	Confident	82.9	Confident	64 Å²	64	57 Å²	57	30%	0.296	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-8.1	-174.1	-63.4	-84.6	0	0	0	113.8	S348 D380 T382	H330-S348 CarbonylContact C-O 3.59Å; H330-S348 CarbonylContact O-C 3.6Å; H330-S348 WeakPolarHBondContact O-CA 3.39Å; H330-D380 HydrophobicContact CB-CB 4.15Å; H330-D380 PolarHBondContact N-O 2.98Å; H330-T382 PolarHBondContact CD2-OG1 3.39Å; H330-T382 WeakPolarHBondContact NE2-CB 3.38Å; H330-T382 PolarHBondContact NE2-OG1 2.92Å
331	G	88.2	Confident	82.4	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.5	160.2	175.7	0	0	0	0	0	113.6	S347 D380	G331-S347 WeakPolarHBondContact CA-O 3.41Å; G331-D380 PolarHBondContact O-N 2.79Å
332	V	88.8	Confident	82	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.3	174.6	-174.3	0	0	0	0	110	I345 S346 L350 L366 L368 Y377 E378 L379 L406	V332-I345 HydrophobicContact CB-CD1 4.33Å; V332-I345 HydrophobicContact CB-CG1 4.11Å; V332-I345 HydrophobicContact CG1-CD1 3.78Å; V332-I345 HydrophobicContact CG1-CG1 3.97Å; V332-I345 WeakPolarHBondContact O-CG1 3.25Å; V332-I345 PolarHBondContact O-N 3.25Å; V332-S346 PolarHBondContact N-OG 3.47Å; V332-L350 HydrophobicContact CG2-CD1 4.03Å; V332-L366 HydrophobicContact CG2-CD1 4.13Å; V332-L368 HydrophobicContact CB-CD2 4.22Å; V332-L368 HydrophobicContact CG1-CD2 4.46Å; V332-L368 HydrophobicContact CG2-CD2 3.94Å; V332-Y377 HydrophobicContact CG1-CD1 4.28Å; V332-Y377 HydrophobicContact CG1-CG 4.24Å; V332-E378 CarbonylContact C-O 3.53Å; V332-E378 WeakPolarHBondContact CA-O 3.38Å; V332-L379 HydrophobicContact CG2-CD1 3.72Å; V332-L406 HydrophobicContact CG1-CD2 4.31Å
333	Y	89.4	Confident	81.9	Confident	42 Å²	42	61.4 Å²	61.4	17%	0.165	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.2	-175.9	-61.9	-97.8	0	0	0	111.1	R342 I343 L344 Y377 E378 D380	Y333-R342 HydrophobicContact CD1-CB 4.02Å; Y333-R342 HydrophobicContact CG-CB 4.49Å; Y333-R342 VanDerWaalsContact CG-CZ 3.49Å; Y333-I343 CarbonylContact C-O 3.54Å; Y333-I343 VanDerWaalsContact CA-O 3.28Å; Y333-I343 WeakPolarHBondContact CA-O 3.21Å; Y333-L344 HydrophobicContact CD1-CB 4.1Å; Y333-L344 HydrophobicContact CD1-CD1 4.31Å; Y333-L344 HydrophobicContact CE1-CB 3.87Å; Y333-L344 HydrophobicContact CE1-CD1 3.85Å; Y333-L344 HydrophobicContact CE1-CG 4.43Å; Y333-L344 HydrophobicContact CE2-CD1 4.11Å; Y333-Y377 CarbonylContact O-C 3.5Å; Y333-Y377 WeakPolarHBondContact O-CA 3.37Å; Y333-E378 PolarHBondContact N-O 3.26Å; Y333-E378 PolarHBondContact O-N 3.42Å; Y333-D380 HydrophobicContact CE2-CB 4.09Å; Y333-D380 WeakPolarHBondContact CE2-OD2 3.46Å
334	A	85.6	Confident	81.8	Confident	22 Å²	22	63.4 Å²	63.4	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.4	165.5	0	0	0	0	0	109.4	R342 I343 I345 Y377	A334-R342 WeakPolarHBondContact O-CA 3.44Å; A334-I343 PolarHBondContact N-O 3.45Å; A334-I343 PolarHBondContact O-N 3.38Å; A334-I345 HydrophobicContact CB-CG2 3.97Å; A334-Y377 HydrophobicContact CB-CD1 3.91Å; A334-Y377 HydrophobicContact CB-CE1 3.77Å
335	I	79.7	Confident	81.6	Confident	54 Å²	54	62.2 Å²	62.2	28%	0.277	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	121.3	176	-55.4	172.5	0	0	0	109.4	R337 Y376 E378	I335-R337 PolarHBondContact O-N 2.83Å; I335-R337 VanDerWaalsContact O-N 3.1Å; I335-Y376 HydrophobicContact CD1-CD1 4.27Å; I335-Y376 HydrophobicContact CD1-CE1 3.72Å; I335-E378 HydrophobicContact CD1-CG 3.88Å; I335-E378 WeakPolarHBondContact CD1-OE1 3.29Å; I335-E378 HydrophobicContact CG1-CG 4.44Å
336	K	72.7	Confident	81.3	Confident	102 Å²	102	62.7 Å²	62.7	44%	0.443	32%	0.315	S	S	.	.			trans	-73.5	103.9	173	-171.4	170.6	176.9	-174.4	0	109.2	T338 T339 G340 D341	K336-T338 PolarHBondContact O-N 3.19Å; K336-T339 WeakPolarHBondContact CD-OG1 3.42Å; K336-T339 PolarHBondContact O-N 2.69Å; K336-T339 VanDerWaalsContact O-N 3.13Å; K336-G340 WeakPolarHBondContact O-CA 3.4Å; K336-G340 PolarHBondContact O-N 3.04Å; K336-D341 PolarHBondContact N-O 2.91Å
337	R	65.2	Low	81.1	Confident	244 Å²	244	60.4 Å²	60.4	92%	0.921	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-29.8	-176.1	-70.2	-177.4	-177.5	161.5	0.7	114.9	I335	I335-R337 PolarHBondContact O-N 2.83Å; I335-R337 VanDerWaalsContact O-N 3.1Å
338	T	61.2	Low	80.7	Confident	120 Å²	120	64.1 Å²	64.1	74%	0.736	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-33	-176.8	48.2	0	0	0	0	114.3	K336	K336-T338 PolarHBondContact O-N 3.19Å
339	T	64.8	Low	80.4	Confident	75 Å²	75	64.1 Å²	64.1	46%	0.46	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-17.2	-175.5	57.1	0	0	0	0	113.4	K336 D341	K336-T339 WeakPolarHBondContact CD-OG1 3.42Å; K336-T339 PolarHBondContact O-N 2.69Å; K336-T339 VanDerWaalsContact O-N 3.13Å; T339-D341 WeakPolarHBondContact CB-OD2 3.42Å; T339-D341 PolarHBondContact O-N 3.5Å; T339-D341 PolarHBondContact OG1-N 2.79Å; T339-D341 PolarHBondContact OG1-OD2 2.8Å
340	G	69.6	Low	80.1	Confident	47 Å²	47	65.2 Å²	65.2	49%	0.485	35%	0.347	S	S	.	.			trans	76.7	2.5	-171	0	0	0	0	0	113.6	K336	K336-G340 WeakPolarHBondContact O-CA 3.4Å; K336-G340 PolarHBondContact O-N 3.04Å
341	D	78.6	Confident	80.1	Confident	92 Å²	92	63.4 Å²	63.4	49%	0.492	35%	0.345	S	S	.	.			trans	-67.3	136.5	-178.3	-61.3	-38.9	0	0	0	111.1	K336 T339	K336-D341 PolarHBondContact N-O 2.91Å; T339-D341 WeakPolarHBondContact CB-OD2 3.42Å; T339-D341 PolarHBondContact O-N 3.5Å; T339-D341 PolarHBondContact OG1-N 2.79Å; T339-D341 PolarHBondContact OG1-OD2 2.8Å
342	R	82.7	Confident	80	Confident	69 Å²	69	67 Å²	67	26%	0.26	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.4	175.5	-61.7	179.2	75.9	-129.3	8.5	109.9	Y333 A334 E378 D380	Y333-R342 HydrophobicContact CD1-CB 4.02Å; Y333-R342 HydrophobicContact CG-CB 4.49Å; Y333-R342 VanDerWaalsContact CG-CZ 3.49Å; A334-R342 WeakPolarHBondContact O-CA 3.44Å; R342-E378 IonicContact NE-OE2 2.72Å; R342-E378 PolarHBondContact NE-OE2 2.91Å; R342-E378 IonicContact NH2-OE2 3.05Å; R342-D380 IonicContact CZ-OD1 3.3Å; R342-D380 IonicContact CZ-OD2 2.78Å; R342-D380 IonicContact NH1-OD2 3.14Å; R342-D380 PolarHBondContact NH1-OD2 3.03Å; R342-D380 VanDerWaalsContact NH1-OD2 3.07Å; R342-D380 IonicContact NH2-OD1 3.78Å; R342-D380 PolarHBondContact NH2-OD1 3.5Å; R342-D380 IonicContact NH2-OD2 3.42Å; R342-D380 PolarHBondContact NH2-OD2 3.22Å
343	I	83.4	Confident	80.1	Confident	91 Å²	91	67.5 Å²	67.5	47%	0.467	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.2	177.9	-56.2	172.5	0	0	0	108	Y333 A334 I345	Y333-I343 CarbonylContact C-O 3.54Å; Y333-I343 VanDerWaalsContact CA-O 3.28Å; Y333-I343 WeakPolarHBondContact CA-O 3.21Å; A334-I343 PolarHBondContact N-O 3.45Å; A334-I343 PolarHBondContact O-N 3.38Å; I343-I345 PolarHBondContact O-N 3.14Å
344	L	85.6	Confident	80.1	Confident	74 Å²	74	73.2 Å²	73.2	39%	0.387	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.6	175.5	-179.6	69.1	0	0	0	109.7	Y333 S346	Y333-L344 HydrophobicContact CD1-CB 4.1Å; Y333-L344 HydrophobicContact CD1-CD1 4.31Å; Y333-L344 HydrophobicContact CE1-CB 3.87Å; Y333-L344 HydrophobicContact CE1-CD1 3.85Å; Y333-L344 HydrophobicContact CE1-CG 4.43Å; Y333-L344 HydrophobicContact CE2-CD1 4.11Å; L344-S346 WeakPolarHBondContact CD1-O 3.47Å; L344-S346 WeakPolarHBondContact CD2-O 3.33Å; L344-S346 WeakPolarHBondContact CG-O 3.03Å
345	I	82.7	Confident	80.3	Confident	23 Å²	23	77 Å²	77	12%	0.118	41%	0.409	C	S	.	.			trans	-120.1	18.1	-177.4	58	147.3	0	0	0	113.2	V332 A334 I343 D369 T372 Y377	V332-I345 HydrophobicContact CB-CD1 4.33Å; V332-I345 HydrophobicContact CB-CG1 4.11Å; V332-I345 HydrophobicContact CG1-CD1 3.78Å; V332-I345 HydrophobicContact CG1-CG1 3.97Å; V332-I345 WeakPolarHBondContact O-CG1 3.25Å; V332-I345 PolarHBondContact O-N 3.25Å; A334-I345 HydrophobicContact CB-CG2 3.97Å; I343-I345 PolarHBondContact O-N 3.14Å; I345-D369 PolarHBondContact O-N 3.46Å; I345-T372 HydrophobicContact CD1-CG2 3.46Å; I345-T372 VanDerWaalsContact CD1-CG2 3.46Å; I345-Y377 HydrophobicContact CD1-CD1 3.44Å; I345-Y377 VanDerWaalsContact CD1-CD1 3.44Å; I345-Y377 HydrophobicContact CD1-CE1 3.32Å; I345-Y377 HydrophobicContact CD1-CG 4.34Å; I345-Y377 HydrophobicContact CG1-CD1 4.31Å; I345-Y377 HydrophobicContact CG1-CE1 4.37Å
346	S	82.4	Confident	80.7	Confident	11 Å²	11	76.1 Å²	76.1	8%	0.077	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-154.9	179.4	-178.3	60.8	0	0	0	0	109.7	V332 L344	V332-S346 PolarHBondContact N-OG 3.47Å; L344-S346 WeakPolarHBondContact CD1-O 3.47Å; L344-S346 WeakPolarHBondContact CD2-O 3.33Å; L344-S346 WeakPolarHBondContact CG-O 3.03Å
347	S	83.2	Confident	81.1	Confident	61 Å²	61	76 Å²	76	43%	0.427	41%	0.409	S	S	.	.			trans	-57.5	143.6	168.7	179.5	0	0	0	0	111.5	G331 D349	G331-S347 WeakPolarHBondContact CA-O 3.41Å; S347-D349 WeakPolarHBondContact CB-O 3.46Å; S347-D349 PolarHBondContact O-N 3Å; S347-D349 PolarHBondContact OG-N 2.55Å; S347-D349 PolarHBondContact OG-O 3.3Å
348	S	82.6	Confident	82	Confident	83 Å²	83	73.6 Å²	73.6	58%	0.58	41%	0.405	S	S	*	.	S	Bend	trans	-73.3	-1.3	171.3	57.9	0	0	0	0	113.9	H330	H330-S348 CarbonylContact C-O 3.59Å; H330-S348 CarbonylContact O-C 3.6Å; H330-S348 WeakPolarHBondContact O-CA 3.39Å
349	D	84.6	Confident	83.1	Confident	73 Å²	73	72 Å²	72	39%	0.39	39%	0.392	S	S	.	.			trans	-139.3	111.2	167.9	-165.3	-11.5	0	0	0	108.2	K328 S347 G351	K328-D349 WeakPolarHBondContact CE-OD1 3.39Å; K328-D349 VanDerWaalsContact CE-OD2 3.25Å; K328-D349 WeakPolarHBondContact CE-OD2 3.29Å; K328-D349 IonicContact NZ-OD1 2.88Å; K328-D349 PolarHBondContact NZ-OD1 3.39Å; K328-D349 IonicContact NZ-OD2 3.75Å; K328-D349 PolarHBondContact NZ-OD2 3.01Å; S347-D349 WeakPolarHBondContact CB-O 3.46Å; S347-D349 PolarHBondContact O-N 3Å; S347-D349 PolarHBondContact OG-N 2.55Å; S347-D349 PolarHBondContact OG-O 3.3Å; D349-G351 PolarHBondContact OD1-N 3.46Å
350	L	84.2	Confident	84.2	Confident	23 Å²	23	71.1 Å²	71.1	12%	0.12	39%	0.385	C	S	.	.			trans	-95.6	-2.8	176.8	-67.2	168.4	0	0	0	111.6	A329 V332 L364 L366 L379	A329-L350 HydrophobicContact CB-CB 3.82Å; A329-L350 HydrophobicContact CB-CD1 4.21Å; A329-L350 PolarHBondContact O-N 3.46Å; V332-L350 HydrophobicContact CG2-CD1 4.03Å; L350-L364 HydrophobicContact CB-CD2 4.28Å; L350-L366 HydrophobicContact CD1-CD2 3.98Å; L350-L379 HydrophobicContact CD1-CD1 3.85Å
351	G	87.1	Confident	85.1	Confident	25 Å²	25	69 Å²	69	26%	0.258	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83	-161.9	-179.4	0	0	0	0	0	113.8	A329 D349	A329-G351 PolarHBondContact N-O 3.06Å; D349-G351 PolarHBondContact OD1-N 3.46Å
352	T	87	Confident	85.7	Confident	75 Å²	75	64.8 Å²	64.8	46%	0.46	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	148.6	-174.4	52.5	0	0	0	0	112	I327 K328	I327-T352 WeakPolarHBondContact O-CA 3.34Å; K328-T352 HydrophobicContact CB-CG2 4.39Å
353	F	89.8	Confident	86	Confident	12 Å²	12	65.1 Å²	65.1	5%	0.053	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-68.7	133.5	176.8	-74	-105.9	0	0	0	110.8	L307 L309 I327 A329 L362 Q363 L364 L379 V381	L307-F353 HydrophobicContact CD2-CE1 4.06Å; L307-F353 HydrophobicContact CD2-CZ 4.11Å; L307-F353 HydrophobicContact CG-CE1 4.35Å; L309-F353 HydrophobicContact CD2-CD1 4.04Å; L309-F353 HydrophobicContact CD2-CE1 3.37Å; L309-F353 HydrophobicContact CD2-CZ 3.67Å; L309-F353 HydrophobicContact CG-CD1 4.33Å; L309-F353 HydrophobicContact CG-CE1 4.05Å; I327-F353 HydrophobicContact CB-CB 4.5Å; I327-F353 HydrophobicContact CB-CD2 3.73Å; I327-F353 HydrophobicContact CB-CE2 4.32Å; I327-F353 HydrophobicContact CB-CG 4.33Å; I327-F353 HydrophobicContact CG2-CD2 3.5Å; I327-F353 HydrophobicContact CG2-CE2 3.57Å; I327-F353 HydrophobicContact CG2-CG 4.41Å; I327-F353 WeakPolarHBondContact O-CD2 3.38Å; I327-F353 PolarHBondContact O-N 2.81Å; I327-F353 VanDerWaalsContact O-N 3.1Å; A329-F353 HydrophobicContact CB-CE2 4.03Å; F353-L362 HydrophobicContact CB-CB 3.96Å; F353-L362 HydrophobicContact CB-CD2 3.94Å; F353-L362 HydrophobicContact CD1-CB 4.07Å; F353-L362 HydrophobicContact CG-CB 4.32Å; F353-Q363 CarbonylContact C-O 3.58Å; F353-Q363 WeakPolarHBondContact CA-O 3.49Å; F353-L364 HydrophobicContact CD1-CB 3.48Å; F353-L364 VanDerWaalsContact CD1-CB 3.48Å; F353-L364 HydrophobicContact CD2-CB 4.35Å; F353-L364 HydrophobicContact CD2-CD2 4.23Å; F353-L364 HydrophobicContact CE1-CB 3.47Å; F353-L364 VanDerWaalsContact CE1-CB 3.47Å; F353-L364 HydrophobicContact CE1-CD2 4.21Å; F353-L364 HydrophobicContact CE1-CG 4.5Å; F353-L364 HydrophobicContact CE2-CB 4.37Å; F353-L364 HydrophobicContact CE2-CD2 3.8Å; F353-L364 HydrophobicContact CG-CB 3.94Å; F353-L364 HydrophobicContact CZ-CB 3.95Å; F353-L364 HydrophobicContact CZ-CD2 3.79Å; F353-L379 HydrophobicContact CZ-CD2 4.47Å; F353-V381 HydrophobicContact CE2-CG1 4.45Å
354	K	90.5	Very high	86.4	Confident	162 Å²	162	61.4 Å²	61.4	70%	0.704	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.1	170.3	-65.8	-177.9	-179.3	176	0	109.8	L362 Q363	K354-L362 CarbonylContact O-C 3.57Å; K354-L362 WeakPolarHBondContact O-CA 3.27Å; K354-Q363 PolarHBondContact N-O 2.92Å; K354-Q363 PolarHBondContact O-N 2.99Å
355	Q	89.7	Confident	86.5	Confident	101 Å²	101	62.1 Å²	62.1	47%	0.472	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128	-178.6	-65.2	175.4	-4	0	0	110.6	P322 L362	P322-Q355 HydrophobicContact CB-CB 3.83Å; P322-Q355 HydrophobicContact CB-CG 3.78Å; P322-Q355 PolarHBondContact O-NE2 2.85Å; Q355-L362 HydrophobicContact CG-CD2 3.81Å
356	D	86.2	Confident	86.6	Confident	36 Å²	36	61.1 Å²	61.1	19%	0.193	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	88.8	167.5	177.4	11.9	0	0	0	109.1	K358 N359 N360 A361	D356-K358 PolarHBondContact O-N 3.43Å; D356-K358 PolarHBondContact OD1-N 3.23Å; D356-N359 PolarHBondContact O-N 3.33Å; D356-N359 WeakPolarHBondContact OD2-CB 3.25Å; D356-N359 PolarHBondContact OD2-ND2 3.31Å; D356-N360 PolarHBondContact O-N 3.03Å; D356-N360 VanDerWaalsContact O-N 3.15Å; D356-A361 WeakPolarHBondContact CA-O 3.26Å; D356-A361 HydrophobicContact CB-CB 4.3Å; D356-A361 PolarHBondContact N-O 2.85Å; D356-A361 PolarHBondContact O-N 3.46Å
357	D	82.2	Confident	86.5	Confident	99 Å²	99	66.7 Å²	66.7	53%	0.529	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.1	-177.4	-70.6	-28.5	0	0	0	113.1	N359	D357-N359 VanDerWaalsContact C-N 3.33Å; D357-N359 PolarHBondContact O-N 2.86Å
358	K	84.3	Confident	86.4	Confident	194 Å²	194	65.1 Å²	65.1	84%	0.843	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-36.5	-178.7	-68.4	-176.4	-179.5	178.7	0	111.6	D356	D356-K358 PolarHBondContact O-N 3.43Å; D356-K358 PolarHBondContact OD1-N 3.23Å
359	N	83.5	Confident	86.1	Confident	87 Å²	87	65.7 Å²	65.7	47%	0.465	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	7.3	-176	-66.2	-49	0	0	0	113.5	R310 D356 D357 A361	R310-N359 PolarHBondContact NE-O 3.39Å; R310-N359 PolarHBondContact NH2-O 3.05Å; R310-N359 VanDerWaalsContact NH2-O 3.08Å; D356-N359 PolarHBondContact O-N 3.33Å; D356-N359 WeakPolarHBondContact OD2-CB 3.25Å; D356-N359 PolarHBondContact OD2-ND2 3.31Å; D357-N359 VanDerWaalsContact C-N 3.33Å; D357-N359 PolarHBondContact O-N 2.86Å; N359-A361 HydrophobicContact CB-CB 4.13Å; N359-A361 PolarHBondContact O-N 3.16Å
360	N	89	Confident	85.5	Confident	56 Å²	56	68.6 Å²	68.6	30%	0.299	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	41	-169.2	-62.6	-41.2	0	0	0	112.2	R310 D356	R310-N360 WeakPolarHBondContact CG-O 3.14Å; D356-N360 PolarHBondContact O-N 3.03Å; D356-N360 VanDerWaalsContact O-N 3.15Å
361	A	88.8	Confident	85	Confident	1 Å²	1	76 Å²	76	1%	0.008	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	155	-172.7	0	0	0	0	0	111.6	L309 R310 P322 D356 N359	L309-A361 CarbonylContact O-C 3.42Å; L309-A361 WeakPolarHBondContact O-CA 3.38Å; R310-A361 HydrophobicContact CG-CB 4.41Å; P322-A361 WeakPolarHBondContact CG-O 3.36Å; D356-A361 WeakPolarHBondContact CA-O 3.26Å; D356-A361 HydrophobicContact CB-CB 4.3Å; D356-A361 PolarHBondContact N-O 2.85Å; D356-A361 PolarHBondContact O-N 3.46Å; N359-A361 HydrophobicContact CB-CB 4.13Å; N359-A361 PolarHBondContact O-N 3.16Å
362	L	89.9	Confident	84.6	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.7	176.2	-76.5	158.6	0	0	0	107.8	S308 L309 L311 P322 I327 F353 K354 Q355	S308-L362 WeakPolarHBondContact CA-O 3.49Å; L309-L362 HydrophobicContact CD1-CB 3.73Å; L309-L362 HydrophobicContact CD1-CD1 3.86Å; L309-L362 HydrophobicContact CD1-CG 4.43Å; L309-L362 HydrophobicContact CG-CB 4.08Å; L309-L362 PolarHBondContact N-O 3.45Å; L309-L362 PolarHBondContact O-N 3.35Å; L311-L362 HydrophobicContact CD1-CD1 4.21Å; L311-L362 HydrophobicContact CG-CD1 4.26Å; P322-L362 HydrophobicContact CB-CD2 3.91Å; P322-L362 HydrophobicContact CB-CG 4.04Å; I327-L362 HydrophobicContact CD1-CD1 3.47Å; I327-L362 VanDerWaalsContact CD1-CD1 3.47Å; I327-L362 HydrophobicContact CG1-CD1 4.14Å; F353-L362 HydrophobicContact CB-CB 3.96Å; F353-L362 HydrophobicContact CB-CD2 3.94Å; F353-L362 HydrophobicContact CD1-CB 4.07Å; F353-L362 HydrophobicContact CG-CB 4.32Å; K354-L362 CarbonylContact O-C 3.57Å; K354-L362 WeakPolarHBondContact O-CA 3.27Å; Q355-L362 HydrophobicContact CG-CD2 3.81Å
363	Q	90.3	Very high	84.3	Confident	76 Å²	76	74.8 Å²	74.8	36%	0.355	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.6	-173.7	-66.5	-174.2	1.7	0	0	111.9	L307 S308 F353 K354	L307-Q363 CarbonylContact O-C 3.57Å; L307-Q363 VanDerWaalsContact O-CA 3.24Å; L307-Q363 WeakPolarHBondContact O-CA 3.49Å; S308-Q363 WeakPolarHBondContact OG-CG 3.44Å; F353-Q363 CarbonylContact C-O 3.58Å; F353-Q363 WeakPolarHBondContact CA-O 3.49Å; K354-Q363 PolarHBondContact N-O 2.92Å; K354-Q363 PolarHBondContact O-N 2.99Å
364	L	90.6	Very high	84	Confident	14 Å²	14	75 Å²	75	7%	0.073	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.6	174.1	-179.6	66.5	0	0	0	109.7	L307 A329 L350 F353 L366	L307-L364 PolarHBondContact N-O 2.82Å; L307-L364 PolarHBondContact O-N 3.13Å; A329-L364 HydrophobicContact CB-CD2 3.38Å; L350-L364 HydrophobicContact CB-CD2 4.28Å; F353-L364 HydrophobicContact CD1-CB 3.48Å; F353-L364 VanDerWaalsContact CD1-CB 3.48Å; F353-L364 HydrophobicContact CD2-CB 4.35Å; F353-L364 HydrophobicContact CD2-CD2 4.23Å; F353-L364 HydrophobicContact CE1-CB 3.47Å; F353-L364 VanDerWaalsContact CE1-CB 3.47Å; F353-L364 HydrophobicContact CE1-CD2 4.21Å; F353-L364 HydrophobicContact CE1-CG 4.5Å; F353-L364 HydrophobicContact CE2-CB 4.37Å; F353-L364 HydrophobicContact CE2-CD2 3.8Å; F353-L364 HydrophobicContact CG-CB 3.94Å; F353-L364 HydrophobicContact CZ-CB 3.95Å; F353-L364 HydrophobicContact CZ-CD2 3.79Å; L364-L366 HydrophobicContact CD2-CD2 3.79Å; L364-L366 HydrophobicContact CG-CD2 4.12Å
365	T	87.3	Confident	83.7	Confident	89 Å²	89	68 Å²	68	55%	0.546	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	119	168.8	-53	0	0	0	0	108.3	P305	P305-T365 WeakPolarHBondContact O-CA 3.19Å
366	L	85.5	Confident	83.5	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	35%	0.35	C	S	.	.			trans	-82.1	122.5	178.2	-53.1	179.6	0	0	0	109.3	I300 P305 V332 L350 L364 L368 L379 L406	I300-L366 HydrophobicContact CD1-CD1 3.26Å; I300-L366 HydrophobicContact CD1-CG 4.17Å; P305-L366 HydrophobicContact CB-CB 4.33Å; P305-L366 VanDerWaalsContact CG-O 3.26Å; P305-L366 WeakPolarHBondContact CG-O 3.43Å; P305-L366 PolarHBondContact O-N 2.71Å; V332-L366 HydrophobicContact CG2-CD1 4.13Å; L350-L366 HydrophobicContact CD1-CD2 3.98Å; L364-L366 HydrophobicContact CD2-CD2 3.79Å; L364-L366 HydrophobicContact CG-CD2 4.12Å; L366-L368 HydrophobicContact CB-CD1 4.42Å; L366-L368 HydrophobicContact CB-CD2 4.05Å; L366-L368 HydrophobicContact CB-CG 3.98Å; L366-L368 PolarHBondContact O-N 3.32Å; L366-L379 HydrophobicContact CD2-CD1 4.16Å; L366-L406 HydrophobicContact CD1-CD2 3.93Å
367	N	80.9	Confident	83.6	Confident	127 Å²	127	66.1 Å²	66.1	68%	0.679	34%	0.343	S	S	*	.			trans	-85.8	93.5	173.1	-167.2	15	0	0	0	109
368	L	79.7	Confident	83.9	Confident	29 Å²	29	62.7 Å²	62.7	15%	0.152	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-97.1	153	-174.4	-59.3	172.2	0	0	0	111.2	P305 V332 L366 M408	P305-L368 HydrophobicContact CB-CD1 3.81Å; P305-L368 HydrophobicContact CG-CD1 4.46Å; V332-L368 HydrophobicContact CB-CD2 4.22Å; V332-L368 HydrophobicContact CG1-CD2 4.46Å; V332-L368 HydrophobicContact CG2-CD2 3.94Å; L366-L368 HydrophobicContact CB-CD1 4.42Å; L366-L368 HydrophobicContact CB-CD2 4.05Å; L366-L368 HydrophobicContact CB-CG 3.98Å; L366-L368 PolarHBondContact O-N 3.32Å; L368-M408 HydrophobicContact CD1-CE 3.72Å; L368-M408 HydrophobicContact CD1-SD 3.34Å; L368-M408 WeakPolarHBondContact CD1-SD 3.39Å
369	D	77.3	Confident	84.2	Confident	94 Å²	94	53.5 Å²	53.5	50%	0.503	28%	0.284	S	S	.	.			trans	-63.4	143	173.3	-70.1	-19.5	0	0	0	111	I345 K371 T372	I345-D369 PolarHBondContact O-N 3.46Å; D369-K371 PolarHBondContact O-N 3.27Å; D369-T372 WeakPolarHBondContact O-CB 3.46Å; D369-T372 PolarHBondContact O-N 3.4Å; D369-T372 PolarHBondContact O-OG1 3.37Å
370	T	70.7	Confident	84.6	Confident	134 Å²	134	50.7 Å²	50.7	82%	0.822	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-14.3	-178.4	60.5	0	0	0	0	113.8
371	K	74.6	Confident	84.7	Confident	180 Å²	180	48.2 Å²	48.2	78%	0.783	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-4.1	176.4	-64.5	-175.3	-180	-177.8	0	113.1	D369 T373	D369-K371 PolarHBondContact O-N 3.27Å; K371-T373 PolarHBondContact O-N 2.95Å
372	T	79.1	Confident	84.8	Confident	12 Å²	12	49.7 Å²	49.7	7%	0.074	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-66.8	121.6	-178.2	-53.6	0	0	0	0	110.2	Q302 I345 D369 Y377 M408	Q302-T372 PolarHBondContact NE2-O 2.83Å; I345-T372 HydrophobicContact CD1-CG2 3.46Å; I345-T372 VanDerWaalsContact CD1-CG2 3.46Å; D369-T372 WeakPolarHBondContact O-CB 3.46Å; D369-T372 PolarHBondContact O-N 3.4Å; D369-T372 PolarHBondContact O-OG1 3.37Å; T372-Y377 HydrophobicContact CG2-CE1 4.1Å; T372-Y377 HydrophobicContact CG2-CE2 4.33Å; T372-Y377 WeakPolarHBondContact CG2-OH 3.42Å; T372-M408 HydrophobicContact CG2-CE 3.24Å
373	T	80.4	Confident	84.7	Confident	61 Å²	61	49.8 Å²	49.8	37%	0.374	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-90.4	165.9	179.4	58.7	0	0	0	0	111.7	K371 Y377 I470	K371-T373 PolarHBondContact O-N 2.95Å; T373-Y377 WeakPolarHBondContact O-CE2 3.46Å; T373-Y377 PolarHBondContact O-OH 3.21Å; T373-I470 HydrophobicContact CG2-CG2 4.2Å
374	A	83.4	Confident	84.6	Confident	17 Å²	17	49.2 Å²	49.2	14%	0.14	27%	0.268	C	S	.	.	S	Bend	trans	-61.3	151.2	169	0	0	0	0	0	111.5	M408 T410 L472	A374-M408 WeakPolarHBondContact CA-O 3.19Å; A374-M408 WeakPolarHBondContact CB-O 3.4Å; A374-T410 HydrophobicContact CB-CG2 3.6Å; A374-L472 HydrophobicContact CB-CD2 4.35Å
375	G	83.6	Confident	84.2	Confident	14 Å²	14	51 Å²	51	14%	0.144	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144	-161.7	-179.8	0	0	0	0	0	114.9	Y377 Y407 M408	G375-Y377 WeakPolarHBondContact O-CD2 3.48Å; G375-Y407 WeakPolarHBondContact O-CA 3.3Å; G375-M408 PolarHBondContact N-O 3.39Å; G375-M408 PolarHBondContact O-N 2.99Å
376	Y	85.8	Confident	83.7	Confident	83 Å²	83	47.3 Å²	47.3	33%	0.325	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.3	-176.6	-176.2	-102.8	0	0	0	112.5	I335 E378 P405 Y407	I335-Y376 HydrophobicContact CD1-CD1 4.27Å; I335-Y376 HydrophobicContact CD1-CE1 3.72Å; Y376-E378 HydrophobicContact CE1-CG 4.26Å; Y376-P405 HydrophobicContact CE2-CB 3.93Å; Y376-P405 WeakPolarHBondContact OH-CB 3.33Å; Y376-Y407 AromaticContact CD2-CD2 3.68Å; Y376-Y407 HydrophobicContact CD2-CD2 3.68Å; Y376-Y407 HydrophobicContact CD2-CE1 4.45Å; Y376-Y407 AromaticContact CD2-CE2 3.28Å; Y376-Y407 HydrophobicContact CD2-CE2 3.28Å; Y376-Y407 HydrophobicContact CD2-CG 4.49Å; Y376-Y407 AromaticContact CD2-CZ 3.7Å; Y376-Y407 HydrophobicContact CE2-CD2 4.21Å; Y376-Y407 AromaticContact CE2-CE2 3.76Å; Y376-Y407 HydrophobicContact CE2-CE2 3.76Å; Y376-Y407 HydrophobicContact CG-CE2 4.38Å
377	Y	88.5	Confident	82.8	Confident	16 Å²	16	53 Å²	53	6%	0.063	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	170.3	-178.8	-61.9	-82	0	0	0	110.6	V332 Y333 A334 I345 T372 T373 G375 L406 M408	V332-Y377 HydrophobicContact CG1-CD1 4.28Å; V332-Y377 HydrophobicContact CG1-CG 4.24Å; Y333-Y377 CarbonylContact O-C 3.5Å; Y333-Y377 WeakPolarHBondContact O-CA 3.37Å; A334-Y377 HydrophobicContact CB-CD1 3.91Å; A334-Y377 HydrophobicContact CB-CE1 3.77Å; I345-Y377 HydrophobicContact CD1-CD1 3.44Å; I345-Y377 VanDerWaalsContact CD1-CD1 3.44Å; I345-Y377 HydrophobicContact CD1-CE1 3.32Å; I345-Y377 HydrophobicContact CD1-CG 4.34Å; I345-Y377 HydrophobicContact CG1-CD1 4.31Å; I345-Y377 HydrophobicContact CG1-CE1 4.37Å; T372-Y377 HydrophobicContact CG2-CE1 4.1Å; T372-Y377 HydrophobicContact CG2-CE2 4.33Å; T372-Y377 WeakPolarHBondContact CG2-OH 3.42Å; T373-Y377 WeakPolarHBondContact O-CE2 3.46Å; T373-Y377 PolarHBondContact O-OH 3.21Å; G375-Y377 WeakPolarHBondContact O-CD2 3.48Å; Y377-L406 PolarHBondContact N-O 2.97Å; Y377-L406 PolarHBondContact O-N 3.09Å; Y377-L406 VanDerWaalsContact O-O 3.09Å; Y377-M408 HydrophobicContact CD2-CB 3.97Å; Y377-M408 HydrophobicContact CD2-CG 3.6Å; Y377-M408 HydrophobicContact CE2-CB 3.83Å; Y377-M408 HydrophobicContact CE2-CE 4.09Å; Y377-M408 HydrophobicContact CE2-CG 3.78Å
378	E	89.5	Confident	81.8	Confident	27 Å²	27	54.6 Å²	54.6	13%	0.126	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.3	172.8	-68.4	177.8	163.3	0	0	110.3	V332 Y333 I335 R342 Y376 I404	V332-E378 CarbonylContact C-O 3.53Å; V332-E378 WeakPolarHBondContact CA-O 3.38Å; Y333-E378 PolarHBondContact N-O 3.26Å; Y333-E378 PolarHBondContact O-N 3.42Å; I335-E378 HydrophobicContact CD1-CG 3.88Å; I335-E378 WeakPolarHBondContact CD1-OE1 3.29Å; I335-E378 HydrophobicContact CG1-CG 4.44Å; R342-E378 IonicContact NE-OE2 2.72Å; R342-E378 PolarHBondContact NE-OE2 2.91Å; R342-E378 IonicContact NH2-OE2 3.05Å; Y376-E378 HydrophobicContact CE1-CG 4.26Å; E378-I404 WeakPolarHBondContact CA-O 3.24Å
379	L	90.4	Very high	80.5	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.1	175.1	177.3	73.1	0	0	0	110	L307 A329 V332 L350 F353 L366 V381 I404	L307-L379 HydrophobicContact CD2-CD2 3.39Å; A329-L379 HydrophobicContact CB-CD1 4.27Å; V332-L379 HydrophobicContact CG2-CD1 3.72Å; L350-L379 HydrophobicContact CD1-CD1 3.85Å; F353-L379 HydrophobicContact CZ-CD2 4.47Å; L366-L379 HydrophobicContact CD2-CD1 4.16Å; L379-V381 HydrophobicContact CD2-CG2 3.6Å; L379-V381 HydrophobicContact CG-CG2 3.66Å; L379-I404 HydrophobicContact CB-CB 4.44Å; L379-I404 PolarHBondContact N-O 3.26Å; L379-I404 PolarHBondContact O-N 3.45Å
380	D	91.1	Very high	79.4	Confident	28 Å²	28	59 Å²	59	15%	0.15	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	121.3	173.6	-75.5	-12	0	0	0	110.3	A329 H330 G331 Y333 R342 Q403	A329-D380 WeakPolarHBondContact CA-O 3.18Å; H330-D380 HydrophobicContact CB-CB 4.15Å; H330-D380 PolarHBondContact N-O 2.98Å; G331-D380 PolarHBondContact O-N 2.79Å; Y333-D380 HydrophobicContact CE2-CB 4.09Å; Y333-D380 WeakPolarHBondContact CE2-OD2 3.46Å; R342-D380 IonicContact CZ-OD1 3.3Å; R342-D380 IonicContact CZ-OD2 2.78Å; R342-D380 IonicContact NH1-OD2 3.14Å; R342-D380 PolarHBondContact NH1-OD2 3.03Å; R342-D380 VanDerWaalsContact NH1-OD2 3.07Å; R342-D380 IonicContact NH2-OD1 3.78Å; R342-D380 PolarHBondContact NH2-OD1 3.5Å; R342-D380 IonicContact NH2-OD2 3.42Å; R342-D380 PolarHBondContact NH2-OD2 3.22Å; D380-Q403 WeakPolarHBondContact OD1-CG 3.42Å
381	V	91	Very high	78.6	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.2	-177.1	179.8	0	0	0	0	110.5	I327 K328 F353 L379 S401 V402 I404	I327-V381 HydrophobicContact CG2-CG1 3.15Å; K328-V381 WeakPolarHBondContact O-CA 3.32Å; F353-V381 HydrophobicContact CE2-CG1 4.45Å; L379-V381 HydrophobicContact CD2-CG2 3.6Å; L379-V381 HydrophobicContact CG-CG2 3.66Å; V381-S401 CarbonylContact O-C 3.56Å; V381-S401 VanDerWaalsContact O-CA 3.31Å; V381-S401 WeakPolarHBondContact O-CA 3.36Å; V381-S401 PolarHBondContact O-N 3.41Å; V381-V402 HydrophobicContact CB-CG2 4.3Å; V381-V402 PolarHBondContact N-O 2.71Å; V381-V402 PolarHBondContact O-N 3.23Å; V381-I404 HydrophobicContact CB-CD1 4.02Å; V381-I404 HydrophobicContact CB-CG1 4.5Å; V381-I404 HydrophobicContact CG2-CD1 3.58Å; V381-I404 HydrophobicContact CG2-CG1 4.19Å
382	T	90.3	Very high	77.9	Confident	33 Å²	33	52.7 Å²	52.7	20%	0.202	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.5	170.2	-56.7	0	0	0	0	109.4	K328 H330 S401	K328-T382 PolarHBondContact N-O 3.05Å; K328-T382 PolarHBondContact O-N 2.94Å; H330-T382 PolarHBondContact CD2-OG1 3.39Å; H330-T382 WeakPolarHBondContact NE2-CB 3.38Å; H330-T382 PolarHBondContact NE2-OG1 2.92Å; T382-S401 PolarHBondContact OG1-OG 3.11Å
383	A	89.1	Confident	77.5	Confident	5 Å²	5	60.3 Å²	60.3	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.6	172.6	0	0	0	0	0	111.6	E326 I327 I399	E326-A383 CarbonylContact O-C 3.49Å; E326-A383 WeakPolarHBondContact O-CA 3.49Å; I327-A383 HydrophobicContact CG1-CB 3.99Å; A383-I399 HydrophobicContact CB-CB 3.91Å; A383-I399 HydrophobicContact CB-CD1 3.69Å; A383-I399 HydrophobicContact CB-CG1 3.89Å; A383-I399 WeakPolarHBondContact CB-O 3.05Å; A383-I399 PolarHBondContact N-O 3.12Å
384	T	87	Confident	77.6	Confident	65 Å²	65	59.2 Å²	59.2	40%	0.399	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	155.4	171.6	58.3	0	0	0	0	110.1	E326 G386	E326-T384 PolarHBondContact N-O 2.92Å; E326-T384 PolarHBondContact O-N 2.82Å; E326-T384 PolarHBondContact O-OG1 3.43Å; T384-G386 PolarHBondContact O-N 3.33Å
385	P	83.3	Confident	77.9	Confident	51 Å²	51	62 Å²	62	33%	0.331	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	134.3	173.9	-23.9	35.1	0	0	0	111.5	L396	P385-L396 HydrophobicContact CG-CD1 3.96Å; P385-L396 HydrophobicContact CG-CG 4.15Å
386	G	76.1	Confident	78.1	Confident	11 Å²	11	61.8 Å²	61.8	11%	0.113	33%	0.33	C	S	.	.			trans	-67.6	160.7	178.3	0	0	0	0	0	113	E324 T384 K388	E324-G386 PolarHBondContact O-N 3.18Å; T384-G386 PolarHBondContact O-N 3.33Å; G386-K388 VanDerWaalsContact C-N 3.26Å; G386-K388 PolarHBondContact O-N 3.06Å
387	S	66.6	Low	78.3	Confident	123 Å²	123	58 Å²	58	86%	0.86	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.3	-179	59.3	0	0	0	0	113.8	K389	S387-K389 VanDerWaalsContact C-N 3.32Å; S387-K389 PolarHBondContact O-N 3.43Å; S387-K389 VanDerWaalsContact O-N 3.08Å
388	K	60.4	Low	78.3	Confident	160 Å²	160	57.4 Å²	57.4	70%	0.696	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	72.2	175.7	-69.1	-177.6	-178.6	174.1	0	110.5	G386	G386-K388 VanDerWaalsContact C-N 3.26Å; G386-K388 PolarHBondContact O-N 3.06Å
389	K	52.9	Low	78.2	Confident	195 Å²	195	56.2 Å²	56.2	85%	0.848	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	25.6	96.7	167.6	-80.9	-173.1	174.9	-178.7	0	116.1	S387	S387-K389 VanDerWaalsContact C-N 3.32Å; S387-K389 PolarHBondContact O-N 3.43Å; S387-K389 VanDerWaalsContact O-N 3.08Å
390	T	53.7	Low	77.9	Confident	21 Å²	21	57 Å²	57	13%	0.129	32%	0.315	C	S	.	.	S	Bend		-76.9	165.2	126.6	54.6	0	0	0	0	107.7	E324 G392	E324-T390 HydrophobicContact CB-CG2 4.45Å; T390-G392 PolarHBondContact O-N 3.18Å
391	N	54.4	Low	77.7	Confident	119 Å²	119	58.7 Å²	58.7	64%	0.636	33%	0.329	S	S	*	.			trans	-56.7	96.1	164.6	-68.5	-38.7	0	0	0	106.5	H393 Q394	N391-H393 PolarHBondContact O-N 3.2Å; N391-Q394 PolarHBondContact O-N 3.25Å
392	G	58.5	Low	77.6	Confident	62 Å²	62	58.5 Å²	58.5	64%	0.639	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	2.3	-168.2	0	0	0	0	0	114.9	T390	T390-G392 PolarHBondContact O-N 3.18Å
393	H	70.8	Confident	77.5	Confident	172 Å²	172	59.2 Å²	59.2	80%	0.796	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-17.1	171.1	-54.8	-60.1	0	0	0	113.3	N391	N391-H393 PolarHBondContact O-N 3.2Å
394	Q	84	Confident	77.4	Confident	38 Å²	38	59 Å²	59	18%	0.178	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-75.6	127.7	178.2	-80.4	178.6	-52.7	0	0	111.1	P273 L276 N391	P273-Q394 WeakPolarHBondContact O-CG 3.45Å; L276-Q394 HydrophobicContact CB-CB 4.27Å; N391-Q394 PolarHBondContact O-N 3.25Å
395	K	88	Confident	77.5	Confident	76 Å²	76	56.8 Å²	56.8	33%	0.33	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.1	175.1	-173.9	66.7	174.8	-169.5	0	109.9	E237 L274 L275 L276	E237-K395 WeakPolarHBondContact OE1-CE 3.42Å; E237-K395 IonicContact OE1-NZ 3.42Å; E237-K395 PolarHBondContact OE1-NZ 2.59Å; E237-K395 WeakPolarHBondContact OE2-CE 3.34Å; E237-K395 IonicContact OE2-NZ 2.76Å; E237-K395 PolarHBondContact OE2-NZ 2.86Å; L274-K395 WeakPolarHBondContact O-CB 3.24Å; L274-K395 PolarHBondContact O-N 3.17Å; L275-K395 HydrophobicContact CD2-CB 4.41Å; L276-K395 PolarHBondContact N-O 2.9Å
396	L	89.5	Confident	77.6	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	127.2	176.6	-58	-178.4	0	0	0	110.4	L276 F325 P385 I399	L276-L396 HydrophobicContact CB-CD2 4.08Å; L276-L396 HydrophobicContact CD2-CD2 3.68Å; L276-L396 HydrophobicContact CG-CD2 4.21Å; F325-L396 HydrophobicContact CD1-CD1 4.24Å; F325-L396 HydrophobicContact CE1-CD1 4.33Å; F325-L396 HydrophobicContact CE1-CD2 3.81Å; P385-L396 HydrophobicContact CG-CD1 3.96Å; P385-L396 HydrophobicContact CG-CG 4.15Å; L396-I399 HydrophobicContact CB-CD1 4.21Å; L396-I399 HydrophobicContact CB-CG1 3.93Å; L396-I399 HydrophobicContact CD1-CD1 3.85Å; L396-I399 HydrophobicContact CD1-CG1 4.25Å; L396-I399 HydrophobicContact CD2-CD1 4.4Å; L396-I399 HydrophobicContact CG-CD1 4.37Å
397	L	90	Very high	78.1	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.5	172.9	-67.3	-179.3	0	0	0	110.4	F28 E237 L240 V241 L269 L275 L276 V278 I399	F28-L397 HydrophobicContact CE2-CB 3.88Å; F28-L397 WeakPolarHBondContact CE2-O 3.15Å; F28-L397 HydrophobicContact CZ-CB 4.2Å; E237-L397 HydrophobicContact CB-CD2 4.05Å; E237-L397 HydrophobicContact CG-CD2 4.2Å; L240-L397 HydrophobicContact CD2-CD1 3.97Å; V241-L397 HydrophobicContact CG2-CB 4.29Å; L269-L397 HydrophobicContact CD1-CD1 3.99Å; L275-L397 HydrophobicContact CB-CD1 4.11Å; L275-L397 HydrophobicContact CD1-CD1 4.06Å; L275-L397 HydrophobicContact CD2-CD1 3.78Å; L275-L397 HydrophobicContact CD2-CD2 4.35Å; L275-L397 HydrophobicContact CD2-CG 4.06Å; L275-L397 HydrophobicContact CG-CD1 4.2Å; L276-L397 PolarHBondContact O-N 3.39Å; V278-L397 PolarHBondContact N-O 2.86Å; L397-I399 VanDerWaalsContact C-N 3.34Å
398	G	86.9	Confident	79.1	Confident	4 Å²	4	51.3 Å²	51.3	4%	0.041	27%	0.266	C	S	.	.	S	Bend	trans	81.5	4	175.3	0	0	0	0	0	115.7	L27	L27-G398 WeakPolarHBondContact CD2-O 3.41Å
399	I	87.4	Confident	80.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.24	C	C	.	.			trans	-139.9	-3.5	178.5	60.8	171.5	0	0	0	114.6	V278 I280 F325 A383 L396 L397 S401	V278-I399 HydrophobicContact CB-CD1 3.72Å; V278-I399 HydrophobicContact CB-CG1 4.13Å; V278-I399 HydrophobicContact CB-CG2 3.89Å; V278-I399 HydrophobicContact CG1-CD1 3.89Å; V278-I399 HydrophobicContact CG1-CG2 3.91Å; V278-I399 HydrophobicContact CG2-CD1 3.82Å; V278-I399 HydrophobicContact CG2-CG1 4.49Å; I280-I399 HydrophobicContact CD1-CG2 3.89Å; I280-I399 HydrophobicContact CG1-CG2 3.68Å; F325-I399 HydrophobicContact CD1-CD1 3.81Å; F325-I399 HydrophobicContact CE1-CD1 3.76Å; A383-I399 HydrophobicContact CB-CB 3.91Å; A383-I399 HydrophobicContact CB-CD1 3.69Å; A383-I399 HydrophobicContact CB-CG1 3.89Å; A383-I399 WeakPolarHBondContact CB-O 3.05Å; A383-I399 PolarHBondContact N-O 3.12Å; L396-I399 HydrophobicContact CB-CD1 4.21Å; L396-I399 HydrophobicContact CB-CG1 3.93Å; L396-I399 HydrophobicContact CD1-CD1 3.85Å; L396-I399 HydrophobicContact CD1-CG1 4.25Å; L396-I399 HydrophobicContact CD2-CD1 4.4Å; L396-I399 HydrophobicContact CG-CD1 4.37Å; L397-I399 VanDerWaalsContact C-N 3.34Å; I399-S401 PolarHBondContact O-N 3.34Å
400	A	84.4	Confident	82.1	Confident	18 Å²	18	35.9 Å²	35.9	15%	0.149	20%	0.2	C	C	.	.	S	Bend	trans	-85.2	108.9	174.6	0	0	0	0	0	109.1	N25	N25-A400 WeakPolarHBondContact CB-O 3.43Å; N25-A400 PolarHBondContact ND2-O 2.82Å
401	S	87	Confident	83.8	Confident	63 Å²	63	39 Å²	39	44%	0.441	21%	0.213	S	C	.	.	S	Bend	trans	54.1	66.9	178.2	-55.6	0	0	0	0	113.6	N25 V381 T382 I399	N25-S401 PolarHBondContact N-O 2.94Å; V381-S401 CarbonylContact O-C 3.56Å; V381-S401 VanDerWaalsContact O-CA 3.31Å; V381-S401 WeakPolarHBondContact O-CA 3.36Å; V381-S401 PolarHBondContact O-N 3.41Å; T382-S401 PolarHBondContact OG1-OG 3.11Å; I399-S401 PolarHBondContact O-N 3.34Å
402	V	89.5	Confident	85.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	150	-174.4	-64.1	0	0	0	0	111.8	N25 L27 I280 V381 I404	N25-V402 HydrophobicContact CB-CG1 4Å; N25-V402 WeakPolarHBondContact O-CG1 3.39Å; L27-V402 HydrophobicContact CD2-CB 3.58Å; L27-V402 HydrophobicContact CD2-CG1 3.97Å; L27-V402 HydrophobicContact CD2-CG2 3.54Å; L27-V402 HydrophobicContact CG-CB 4.11Å; I280-V402 HydrophobicContact CD1-CG2 4.25Å; V381-V402 HydrophobicContact CB-CG2 4.3Å; V381-V402 PolarHBondContact N-O 2.71Å; V381-V402 PolarHBondContact O-N 3.23Å; V402-I404 HydrophobicContact CG2-CG1 4.35Å
403	Q	87.6	Confident	87	Confident	47 Å²	47	34.5 Å²	34.5	22%	0.22	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.2	172.8	-82	166.5	11.4	0	0	109.3	S24 L27 D380 P405	S24-Q403 VanDerWaalsContact CB-CD 3.47Å; S24-Q403 PolarHBondContact OG-NE2 3.46Å; S24-Q403 PolarHBondContact OG-OE1 2.86Å; S24-Q403 VanDerWaalsContact OG-OE1 3.06Å; L27-Q403 WeakPolarHBondContact CD1-O 3.39Å; D380-Q403 WeakPolarHBondContact OD1-CG 3.42Å; Q403-P405 WeakPolarHBondContact O-CD 3.46Å
404	I	88.2	Confident	88	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.8	177.9	-52.6	179.4	0	0	0	109.7	L27 I280 L298 E378 L379 V381 V402 L406	L27-I404 HydrophobicContact CD1-CB 4.4Å; L27-I404 HydrophobicContact CD1-CG1 4.12Å; L27-I404 HydrophobicContact CD2-CG1 4.38Å; I280-I404 HydrophobicContact CD1-CD1 3.63Å; I280-I404 HydrophobicContact CD1-CG1 4.23Å; I280-I404 HydrophobicContact CG2-CD1 4.37Å; L298-I404 HydrophobicContact CD1-CG2 3.55Å; L298-I404 HydrophobicContact CG-CG2 3.78Å; E378-I404 WeakPolarHBondContact CA-O 3.24Å; L379-I404 HydrophobicContact CB-CB 4.44Å; L379-I404 PolarHBondContact N-O 3.26Å; L379-I404 PolarHBondContact O-N 3.45Å; V381-I404 HydrophobicContact CB-CD1 4.02Å; V381-I404 HydrophobicContact CB-CG1 4.5Å; V381-I404 HydrophobicContact CG2-CD1 3.58Å; V381-I404 HydrophobicContact CG2-CG1 4.19Å; V402-I404 HydrophobicContact CG2-CG1 4.35Å; I404-L406 PolarHBondContact O-N 3.19Å
405	P	87.5	Confident	88.3	Confident	19 Å²	19	26.6 Å²	26.6	12%	0.123	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	125.6	171	-25.4	36.1	0	0	0	111.3	I297 L298 Y376 Q403	I297-P405 HydrophobicContact CG1-CB 4.24Å; L298-P405 PolarHBondContact N-O 3.47Å; Y376-P405 HydrophobicContact CE2-CB 3.93Å; Y376-P405 WeakPolarHBondContact OH-CB 3.33Å; Q403-P405 WeakPolarHBondContact O-CD 3.46Å
406	L	87.2	Confident	88.3	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.1	-176.3	176.9	65.2	0	0	0	110.5	L298 I300 V332 L366 Y377 I404	L298-L406 HydrophobicContact CB-CD1 4.23Å; L298-L406 CarbonylContact O-C 3.53Å; L298-L406 WeakPolarHBondContact O-CA 3.43Å; I300-L406 HydrophobicContact CB-CD1 4.03Å; I300-L406 HydrophobicContact CD1-CD1 3.26Å; I300-L406 HydrophobicContact CD1-CD2 3.87Å; I300-L406 HydrophobicContact CD1-CG 4.2Å; I300-L406 HydrophobicContact CG1-CD1 3.47Å; I300-L406 VanDerWaalsContact CG1-CD1 3.47Å; V332-L406 HydrophobicContact CG1-CD2 4.31Å; L366-L406 HydrophobicContact CD1-CD2 3.93Å; Y377-L406 PolarHBondContact N-O 2.97Å; Y377-L406 PolarHBondContact O-N 3.09Å; Y377-L406 VanDerWaalsContact O-O 3.09Å; I404-L406 PolarHBondContact O-N 3.19Å
407	Y	86.7	Confident	88.5	Confident	67 Å²	67	29 Å²	29	26%	0.263	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.4	167.5	-88.7	-101.8	0	0	0	110.1	I297 L298 S299 I300 G375 Y376	I297-Y407 HydrophobicContact CD1-CE2 4.1Å; I297-Y407 HydrophobicContact CG2-CD2 3.19Å; I297-Y407 HydrophobicContact CG2-CE2 3.75Å; I297-Y407 HydrophobicContact CG2-CG 4.09Å; L298-Y407 PolarHBondContact O-N 3.37Å; S299-Y407 CarbonylContact C-O 3.56Å; S299-Y407 VanDerWaalsContact CA-O 3.25Å; S299-Y407 WeakPolarHBondContact CA-O 3.32Å; I300-Y407 PolarHBondContact N-O 3.15Å; G375-Y407 WeakPolarHBondContact O-CA 3.3Å; Y376-Y407 AromaticContact CD2-CD2 3.68Å; Y376-Y407 HydrophobicContact CD2-CD2 3.68Å; Y376-Y407 HydrophobicContact CD2-CE1 4.45Å; Y376-Y407 AromaticContact CD2-CE2 3.28Å; Y376-Y407 HydrophobicContact CD2-CE2 3.28Å; Y376-Y407 HydrophobicContact CD2-CG 4.49Å; Y376-Y407 AromaticContact CD2-CZ 3.7Å; Y376-Y407 HydrophobicContact CE2-CD2 4.21Å; Y376-Y407 AromaticContact CE2-CE2 3.76Å; Y376-Y407 HydrophobicContact CE2-CE2 3.76Å; Y376-Y407 HydrophobicContact CG-CE2 4.38Å
408	M	86.5	Confident	88.7	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.8	169.4	-73.3	-118.3	-65	0	0	109.5	I300 Q302 L368 T372 A374 G375 Y377	I300-M408 WeakPolarHBondContact O-CA 3.45Å; Q302-M408 HydrophobicContact CG-CE 4.36Å; L368-M408 HydrophobicContact CD1-CE 3.72Å; L368-M408 HydrophobicContact CD1-SD 3.34Å; L368-M408 WeakPolarHBondContact CD1-SD 3.39Å; T372-M408 HydrophobicContact CG2-CE 3.24Å; A374-M408 WeakPolarHBondContact CA-O 3.19Å; A374-M408 WeakPolarHBondContact CB-O 3.4Å; G375-M408 PolarHBondContact N-O 3.39Å; G375-M408 PolarHBondContact O-N 2.99Å; Y377-M408 HydrophobicContact CD2-CB 3.97Å; Y377-M408 HydrophobicContact CD2-CG 3.6Å; Y377-M408 HydrophobicContact CE2-CB 3.83Å; Y377-M408 HydrophobicContact CE2-CE 4.09Å; Y377-M408 HydrophobicContact CE2-CG 3.78Å
409	I	88.3	Confident	89	Confident	31 Å²	31	30.6 Å²	30.6	16%	0.159	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	148.9	177.9	61.4	170.3	0	0	0	110.3	I300 Q302 S538 K540	I300-I409 VanDerWaalsContact O-CG1 3.28Å; I300-I409 WeakPolarHBondContact O-CG1 3.47Å; I300-I409 PolarHBondContact O-N 3.32Å; Q302-I409 PolarHBondContact N-O 2.89Å; I409-S538 CarbonylContact C-O 3.53Å; I409-S538 VanDerWaalsContact CA-O 3.29Å; I409-S538 WeakPolarHBondContact CA-O 3.43Å; I409-K540 HydrophobicContact CD1-CB 4.17Å; I409-K540 HydrophobicContact CD1-CG 4.09Å
410	T	88.5	Confident	89.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-136.2	160.7	177.6	-163.7	0	0	0	0	111.3	Q302 A374 D466 L472 S538 I539 K540	Q302-T410 PolarHBondContact OE1-OG1 3.47Å; A374-T410 HydrophobicContact CB-CG2 3.6Å; T410-D466 HydrophobicContact CG2-CB 3.83Å; T410-L472 HydrophobicContact CG2-CD1 3.76Å; T410-L472 HydrophobicContact CG2-CD2 4.03Å; T410-S538 PolarHBondContact N-O 3.13Å; T410-I539 WeakPolarHBondContact O-CA 3.37Å; T410-K540 PolarHBondContact O-N 3.44Å
411	E	88.3	Confident	89.6	Confident	87 Å²	87	31 Å²	31	41%	0.407	16%	0.162	S	C	.	.			trans	-82.3	121.9	169.1	-169	-176	154.3	0	0	108.7	K413 D466 S467	E411-K413 WeakPolarHBondContact OE1-CE 3.29Å; E411-K413 IonicContact OE1-NZ 3.12Å; E411-K413 PolarHBondContact OE1-NZ 3.33Å; E411-D466 CarbonylContact O-C 3.56Å; E411-S467 PolarHBondContact O-N 3.29Å; E411-S467 PolarHBondContact O-OG 3.19Å
412	A	89.8	Confident	89.7	Confident	9 Å²	9	29.4 Å²	29.4	7%	0.074	15%	0.148	C	C	.	.			trans	-94.1	140.3	177.6	0	0	0	0	0	110.7	I464 V465 L472 I539 I543	A412-I464 HydrophobicContact CB-CG2 4.12Å; A412-V465 WeakPolarHBondContact CA-O 3.26Å; A412-L472 HydrophobicContact CB-CD1 3.77Å; A412-I539 HydrophobicContact CB-CB 4.41Å; A412-I539 HydrophobicContact CB-CD1 3.8Å; A412-I539 HydrophobicContact CB-CG1 3.85Å; A412-I539 HydrophobicContact CB-CG2 3.66Å; A412-I543 HydrophobicContact CB-CD1 3.98Å
413	K	90.8	Very high	89.5	Confident	77 Å²	77	32.2 Å²	32.2	34%	0.335	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.6	176.4	-67.1	-177.5	177.5	169.6	0	110.2	E411 A415 I464 V465	E411-K413 WeakPolarHBondContact OE1-CE 3.29Å; E411-K413 IonicContact OE1-NZ 3.12Å; E411-K413 PolarHBondContact OE1-NZ 3.33Å; K413-A415 PolarHBondContact O-N 3.01Å; K413-I464 WeakPolarHBondContact O-CA 3.44Å; K413-V465 PolarHBondContact N-O 2.98Å; K413-V465 PolarHBondContact O-N 2.88Å
414	V	92	Very high	88.9	Confident	13 Å²	13	32.3 Å²	32.3	8%	0.079	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	118.1	168	-175.7	0	0	0	0	107.5	Q416 A417 P437 L462 L532 I543 W545	V414-Q416 WeakPolarHBondContact CG1-O 3.02Å; V414-A417 HydrophobicContact CG1-CB 3.99Å; V414-P437 HydrophobicContact CB-CB 4.19Å; V414-P437 HydrophobicContact CB-CG 4.19Å; V414-P437 HydrophobicContact CG1-CG 4.26Å; V414-P437 WeakPolarHBondContact O-CG 3.45Å; V414-L462 HydrophobicContact CG1-CD2 4.19Å; V414-L532 HydrophobicContact CG2-CD2 3.75Å; V414-I543 HydrophobicContact CG2-CD1 4.37Å; V414-W545 HydrophobicContact CB-CZ3 4.36Å; V414-W545 HydrophobicContact CG1-CZ3 4.03Å; V414-W545 HydrophobicContact CG2-CE3 4.11Å; V414-W545 HydrophobicContact CG2-CZ3 4.29Å
415	A	89.6	Confident	88	Confident	30 Å²	30	36.8 Å²	36.8	25%	0.248	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-43.9	177.7	0	0	0	0	0	111.5	K413 N463 V465	K413-A415 PolarHBondContact O-N 3.01Å; A415-N463 WeakPolarHBondContact CB-OD1 3.5Å; A415-N463 PolarHBondContact N-O 3.37Å; A415-V465 HydrophobicContact CB-CB 4.36Å; A415-V465 HydrophobicContact CB-CG1 3.68Å; A415-V465 HydrophobicContact CB-CG2 3.76Å
416	Q	88.9	Confident	86.9	Confident	134 Å²	134	45.2 Å²	45.2	63%	0.626	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	141.8	-177.3	-64.9	-178.5	1	0	0	108.9	V414 L462 N463	V414-Q416 WeakPolarHBondContact CG1-O 3.02Å; Q416-L462 WeakPolarHBondContact O-CA 3.29Å; Q416-N463 PolarHBondContact O-N 3.47Å
417	A	93.5	Very high	85.8	Confident	2 Å²	2	52.7 Å²	52.7	2%	0.017	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	117.8	178.8	0	0	0	0	0	108.1	V414 L435 D461 L462 W545	V414-A417 HydrophobicContact CG1-CB 3.99Å; A417-L435 HydrophobicContact CB-CB 3.92Å; A417-L435 HydrophobicContact CB-CD1 4.27Å; A417-L435 PolarHBondContact O-N 3.25Å; A417-D461 WeakPolarHBondContact CA-O 3.27Å; A417-L462 HydrophobicContact CB-CD2 3.39Å; A417-W545 HydrophobicContact CB-CH2 3.72Å; A417-W545 HydrophobicContact CB-CZ3 3.78Å
418	T	93.6	Very high	85.1	Confident	40 Å²	40	54.7 Å²	54.7	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137	179.8	-53.7	0	0	0	0	109.3	D432 I433 D461	T418-D432 HydrophobicContact CG2-CB 4.33Å; T418-I433 WeakPolarHBondContact CA-O 3.4Å; T418-D461 PolarHBondContact N-O 2.91Å; T418-D461 PolarHBondContact O-N 2.97Å
419	V	94.5	Very high	84.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.3	172.3	177.4	0	0	0	0	107.8	I433 L435 I458 S459 I460 F548	V419-I433 HydrophobicContact CB-CB 4.25Å; V419-I433 PolarHBondContact N-O 2.88Å; V419-I433 PolarHBondContact O-N 2.89Å; V419-L435 HydrophobicContact CG2-CD1 3.61Å; V419-L435 HydrophobicContact CG2-CD2 4.31Å; V419-L435 HydrophobicContact CG2-CG 4.01Å; V419-I458 HydrophobicContact CG1-CD1 3.48Å; V419-I458 VanDerWaalsContact CG1-CD1 3.48Å; V419-I458 HydrophobicContact CG1-CG1 3.51Å; V419-S459 CarbonylContact C-O 3.56Å; V419-S459 WeakPolarHBondContact CA-O 3.32Å; V419-I460 HydrophobicContact CG2-CG1 4.36Å; V419-F548 HydrophobicContact CG2-CD1 4.23Å; V419-F548 HydrophobicContact CG2-CE1 3.55Å; V419-F548 HydrophobicContact CG2-CZ 4.05Å
420	T	92.5	Very high	84	Confident	15 Å²	15	61.8 Å²	61.8	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.9	179.4	-59.5	0	0	0	0	109.2	M422 H429 A431 D432 S459	T420-M422 HydrophobicContact CG2-CG 3.89Å; T420-M422 HydrophobicContact CG2-SD 4.3Å; T420-H429 WeakPolarHBondContact CG2-NE2 3.05Å; T420-A431 WeakPolarHBondContact CA-O 3.45Å; T420-D432 WeakPolarHBondContact CB-OD1 3.41Å; T420-D432 WeakPolarHBondContact CG2-OD1 3.5Å; T420-D432 PolarHBondContact OG1-OD1 3.42Å; T420-S459 PolarHBondContact N-O 2.59Å; T420-S459 PolarHBondContact O-N 2.94Å
421	I	91.6	Very high	83.8	Confident	12 Å²	12	63.5 Å²	63.5	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.9	175.4	-56.6	175	0	0	0	107.8	V430 A431 I433 I450 L452 Q456	I421-V430 HydrophobicContact CB-CB 4.39Å; I421-V430 HydrophobicContact CG2-CB 4.2Å; I421-V430 WeakPolarHBondContact O-CA 3.35Å; I421-V430 VanDerWaalsContact O-CB 3.31Å; I421-V430 WeakPolarHBondContact O-CB 3.43Å; I421-V430 PolarHBondContact O-N 2.85Å; I421-A431 PolarHBondContact N-O 2.67Å; I421-A431 PolarHBondContact O-N 2.92Å; I421-I433 HydrophobicContact CD1-CD1 4.28Å; I421-I450 HydrophobicContact CD1-CG2 3.83Å; I421-L452 HydrophobicContact CG2-CD1 3.85Å; I421-Q456 HydrophobicContact CG2-CB 4.27Å
422	M	88.9	Confident	83.8	Confident	30 Å²	30	63.8 Å²	63.8	15%	0.148	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.3	-179	-62	173.4	-76.4	0	0	110.3	T420 Q428 Q456 Q457 L511	T420-M422 HydrophobicContact CG2-CG 3.89Å; T420-M422 HydrophobicContact CG2-SD 4.3Å; M422-Q428 WeakPolarHBondContact CA-O 3.45Å; M422-Q456 CarbonylContact O-C 3.52Å; M422-Q456 WeakPolarHBondContact O-CA 3.41Å; M422-Q457 HydrophobicContact CB-CG 3.97Å; M422-Q457 HydrophobicContact CE-CG 4.35Å; M422-Q457 PolarHBondContact N-O 3.49Å; M422-Q457 PolarHBondContact O-N 3.31Å; M422-L511 HydrophobicContact CE-CD1 3.91Å
423	N	84.5	Confident	83.8	Confident	60 Å²	60	64.4 Å²	64.4	32%	0.321	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	124.4	168.9	-170.8	-50.8	0	0	0	109.7	A425 R426 E427 Q428 V430	N423-A425 VanDerWaalsContact C-N 3.31Å; N423-A425 PolarHBondContact O-N 3.47Å; N423-A425 PolarHBondContact OD1-N 2.97Å; N423-A425 VanDerWaalsContact OD1-N 3.08Å; N423-R426 PolarHBondContact O-N 2.85Å; N423-E427 WeakPolarHBondContact O-CA 3.29Å; N423-E427 PolarHBondContact O-N 3.3Å; N423-Q428 PolarHBondContact N-O 3.02Å; N423-V430 HydrophobicContact CB-CG2 4.37Å
424	T	75.4	Confident	83.8	Confident	49 Å²	49	65.2 Å²	65.2	30%	0.301	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.5	-174.5	-51.6	0	0	0	0	112.4	R426 G455 D513	T424-R426 PolarHBondContact O-N 2.61Å; T424-G455 PolarHBondContact N-O 2.73Å; T424-G455 PolarHBondContact OG1-O 2.71Å; T424-D513 WeakPolarHBondContact CG2-OD2 3.25Å
425	A	68.8	Low	83.8	Confident	94 Å²	94	65.1 Å²	65.1	78%	0.777	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-22.6	-172.6	0	0	0	0	0	114.6	N423	N423-A425 VanDerWaalsContact C-N 3.31Å; N423-A425 PolarHBondContact O-N 3.47Å; N423-A425 PolarHBondContact OD1-N 2.97Å; N423-A425 VanDerWaalsContact OD1-N 3.08Å
426	R	65	Low	83.9	Confident	196 Å²	196	67.8 Å²	67.8	74%	0.74	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	-1.1	-175.6	-67.1	-173.1	-179.5	-178.8	0.4	114	N423 T424 Q428	N423-R426 PolarHBondContact O-N 2.85Å; T424-R426 PolarHBondContact O-N 2.61Å; R426-Q428 HydrophobicContact CB-CB 3.91Å; R426-Q428 PolarHBondContact O-N 3.21Å
427	E	64.2	Low	83.9	Confident	159 Å²	159	63.3 Å²	63.3	74%	0.743	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	29.6	-164.6	-62	-176.5	169.6	0	0	111.9	N423 H429	N423-E427 WeakPolarHBondContact O-CA 3.29Å; N423-E427 PolarHBondContact O-N 3.3Å; E427-H429 PolarHBondContact O-N 3Å
428	Q	72.4	Confident	83.5	Confident	109 Å²	109	70.9 Å²	70.9	51%	0.509	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	125	-174.9	-169.5	174	-8.3	0	0	108.5	M422 N423 R426 V430	M422-Q428 WeakPolarHBondContact CA-O 3.45Å; N423-Q428 PolarHBondContact N-O 3.02Å; R426-Q428 HydrophobicContact CB-CB 3.91Å; R426-Q428 PolarHBondContact O-N 3.21Å; Q428-V430 PolarHBondContact O-N 3.22Å
429	H	71.7	Confident	83.5	Confident	103 Å²	103	75.7 Å²	75.7	48%	0.477	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	122.2	179.8	-155.2	-83.5	0	0	0	110.8	T420 E427 D432	T420-H429 WeakPolarHBondContact CG2-NE2 3.05Å; E427-H429 PolarHBondContact O-N 3Å; H429-D432 IonicContact CE1-OD1 3.13Å; H429-D432 PolarHBondContact CE1-OD1 3.47Å; H429-D432 IonicContact CE1-OD2 3.49Å; H429-D432 PolarHBondContact CE1-OD2 3.48Å; H429-D432 IonicContact NE2-OD1 3.06Å; H429-D432 PolarHBondContact NE2-OD1 3.45Å; H429-D432 IonicContact NE2-OD2 3.63Å
430	V	79.9	Confident	83.4	Confident	78 Å²	78	78.2 Å²	78.2	47%	0.473	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-52.6	-176.7	-177.9	0	0	0	0	110.8	I421 N423 Q428	I421-V430 HydrophobicContact CB-CB 4.39Å; I421-V430 HydrophobicContact CG2-CB 4.2Å; I421-V430 WeakPolarHBondContact O-CA 3.35Å; I421-V430 VanDerWaalsContact O-CB 3.31Å; I421-V430 WeakPolarHBondContact O-CB 3.43Å; I421-V430 PolarHBondContact O-N 2.85Å; N423-V430 HydrophobicContact CB-CG2 4.37Å; Q428-V430 PolarHBondContact O-N 3.22Å
431	A	83.7	Confident	83.6	Confident	37 Å²	37	81.2 Å²	81.2	31%	0.306	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	146.9	-177	0	0	0	0	0	112.2	T420 I421	T420-A431 WeakPolarHBondContact CA-O 3.45Å; I421-A431 PolarHBondContact N-O 2.67Å; I421-A431 PolarHBondContact O-N 2.92Å
432	D	87.9	Confident	83.6	Confident	93 Å²	93	86.3 Å²	86.3	50%	0.497	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129	165.8	-81.2	-26	0	0	0	110.3	T418 T420 H429	T418-D432 HydrophobicContact CG2-CB 4.33Å; T420-D432 WeakPolarHBondContact CB-OD1 3.41Å; T420-D432 WeakPolarHBondContact CG2-OD1 3.5Å; T420-D432 PolarHBondContact OG1-OD1 3.42Å; H429-D432 IonicContact CE1-OD1 3.13Å; H429-D432 PolarHBondContact CE1-OD1 3.47Å; H429-D432 IonicContact CE1-OD2 3.49Å; H429-D432 PolarHBondContact CE1-OD2 3.48Å; H429-D432 IonicContact NE2-OD1 3.06Å; H429-D432 PolarHBondContact NE2-OD1 3.45Å; H429-D432 IonicContact NE2-OD2 3.63Å
433	I	89.9	Confident	83.7	Confident	22 Å²	22	85.6 Å²	85.6	11%	0.113	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	105.1	176.7	-56.5	167.9	0	0	0	107.3	T418 V419 I421 L435 Y441 I450	T418-I433 WeakPolarHBondContact CA-O 3.4Å; V419-I433 HydrophobicContact CB-CB 4.25Å; V419-I433 PolarHBondContact N-O 2.88Å; V419-I433 PolarHBondContact O-N 2.89Å; I421-I433 HydrophobicContact CD1-CD1 4.28Å; I433-L435 HydrophobicContact CG2-CD2 3.95Å; I433-L435 PolarHBondContact O-N 3Å; I433-Y441 HydrophobicContact CD1-CE1 4.31Å; I433-Y441 HydrophobicContact CG2-CD1 4.19Å; I433-Y441 HydrophobicContact CG2-CD2 3.97Å; I433-Y441 HydrophobicContact CG2-CE1 3.82Å; I433-Y441 HydrophobicContact CG2-CE2 3.6Å; I433-Y441 HydrophobicContact CG2-CG 4.25Å; I433-I450 HydrophobicContact CD1-CD1 3.74Å; I433-I450 HydrophobicContact CD1-CG1 4.23Å; I433-I450 HydrophobicContact CD1-CG2 4.49Å
434	S	90.5	Very high	83.8	Confident	94 Å²	94	89 Å²	89	66%	0.657	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.7	170.5	-58.7	0	0	0	0	109.9
435	L	93.2	Very high	84.3	Confident	10 Å²	10	89 Å²	89	5%	0.052	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.9	178.2	-55.6	177	0	0	0	110.2	A417 V419 I433 P437 Y441 W545 M547 F548	A417-L435 HydrophobicContact CB-CB 3.92Å; A417-L435 HydrophobicContact CB-CD1 4.27Å; A417-L435 PolarHBondContact O-N 3.25Å; V419-L435 HydrophobicContact CG2-CD1 3.61Å; V419-L435 HydrophobicContact CG2-CD2 4.31Å; V419-L435 HydrophobicContact CG2-CG 4.01Å; I433-L435 HydrophobicContact CG2-CD2 3.95Å; I433-L435 PolarHBondContact O-N 3Å; L435-P437 WeakPolarHBondContact O-CD 3.4Å; L435-Y441 VanDerWaalsContact CD2-CB 3.48Å; L435-Y441 HydrophobicContact CD2-CD1 4.35Å; L435-Y441 HydrophobicContact CD2-CD2 4.27Å; L435-Y441 HydrophobicContact CD2-CG 3.79Å; L435-W545 HydrophobicContact CB-CH2 3.81Å; L435-W545 HydrophobicContact CB-CZ2 4.19Å; L435-W545 HydrophobicContact CD1-CH2 4.17Å; L435-M547 HydrophobicContact CD1-CB 4.24Å; L435-M547 HydrophobicContact CD1-CE 3.34Å; L435-F548 HydrophobicContact CD1-CD1 3.92Å; L435-F548 HydrophobicContact CD1-CE1 4.11Å; L435-F548 HydrophobicContact CD2-CD1 4.32Å
436	T	92	Very high	85.1	Confident	86 Å²	86	90.2 Å²	90.2	53%	0.528	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-89.9	118.2	170.2	-56.2	0	0	0	0	108.8	K439 W545	T436-K439 HydrophobicContact CG2-CD 4.07Å; T436-K439 HydrophobicContact CG2-CG 4.42Å; T436-K439 PolarHBondContact O-N 2.94Å; T436-W545 VanDerWaalsContact O-CZ2 3.28Å; T436-W545 WeakPolarHBondContact O-CZ2 3.35Å
437	P	88.5	Confident	86.1	Confident	41 Å²	41	83.8 Å²	83.8	27%	0.266	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	147.1	176.6	-29.7	36.5	0	0	0	113.1	V414 L435 K439	V414-P437 HydrophobicContact CB-CB 4.19Å; V414-P437 HydrophobicContact CB-CG 4.19Å; V414-P437 HydrophobicContact CG1-CG 4.26Å; V414-P437 WeakPolarHBondContact O-CG 3.45Å; L435-P437 WeakPolarHBondContact O-CD 3.4Å; P437-K439 PolarHBondContact O-N 3Å
438	E	85.2	Confident	87.3	Confident	160 Å²	160	76.7 Å²	76.7	75%	0.748	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-4.3	-179.1	-55.1	176.6	-178.6	0	0	115.6
439	K	93	Very high	88.3	Confident	142 Å²	142	71.5 Å²	71.5	62%	0.617	42%	0.417	S	S	*	.	S	Bend	trans	-109.9	142.4	173.4	-64.4	-173.6	-179.5	179.4	0	110.4	T436 P437 W545	T436-K439 HydrophobicContact CG2-CD 4.07Å; T436-K439 HydrophobicContact CG2-CG 4.42Å; T436-K439 PolarHBondContact O-N 2.94Å; P437-K439 PolarHBondContact O-N 3Å; K439-W545 WeakPolarHBondContact O-CZ2 3.26Å; K439-W545 PolarHBondContact O-NE1 3.44Å
440	T	93.6	Very high	89.3	Confident	53 Å²	53	67 Å²	67	33%	0.325	40%	0.396	S	S	.	.			trans	-81	122.8	171	-57.2	0	0	0	0	109.1	H546 M547	T440-H546 WeakPolarHBondContact CA-O 3.3Å; T440-H546 WeakPolarHBondContact CG2-CD2 3.39Å; T440-H546 WeakPolarHBondContact CG2-NE2 3.44Å; T440-H546 PolarHBondContact OG1-CD2 3.36Å; T440-H546 PolarHBondContact OG1-O 2.92Å; T440-M547 WeakPolarHBondContact CA-O 3.38Å
441	Y	94.8	Very high	89.8	Confident	78 Å²	78	65.4 Å²	65.4	31%	0.306	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-71.6	135.3	172.9	175.8	-95.6	0	0	0	110.4	I433 L435 A443 I450 M547 F548	I433-Y441 HydrophobicContact CD1-CE1 4.31Å; I433-Y441 HydrophobicContact CG2-CD1 4.19Å; I433-Y441 HydrophobicContact CG2-CD2 3.97Å; I433-Y441 HydrophobicContact CG2-CE1 3.82Å; I433-Y441 HydrophobicContact CG2-CE2 3.6Å; I433-Y441 HydrophobicContact CG2-CG 4.25Å; L435-Y441 VanDerWaalsContact CD2-CB 3.48Å; L435-Y441 HydrophobicContact CD2-CD1 4.35Å; L435-Y441 HydrophobicContact CD2-CD2 4.27Å; L435-Y441 HydrophobicContact CD2-CG 3.79Å; Y441-A443 HydrophobicContact CE1-CB 4.02Å; Y441-I450 HydrophobicContact CD1-CD1 3.96Å; Y441-I450 HydrophobicContact CD1-CG1 4.09Å; Y441-I450 HydrophobicContact CE1-CD1 3.96Å; Y441-I450 HydrophobicContact CE1-CG1 3.84Å; Y441-M547 PolarHBondContact N-O 2.85Å; Y441-F548 HydrophobicContact CD1-CB 4.39Å
442	K	92.8	Very high	90.1	Very high	119 Å²	119	63.8 Å²	63.8	52%	0.517	37%	0.372	S	S	.	.			trans	-119.8	118.8	174.5	-66.5	-64.6	179.5	-177.4	0	108.5	G448 D549	K442-G448 WeakPolarHBondContact CA-O 3.44Å; K442-D549 IonicContact NZ-OD2 2.72Å; K442-D549 PolarHBondContact NZ-OD2 3.3Å
443	A	89.7	Confident	90	Very high	15 Å²	15	65.3 Å²	65.3	12%	0.124	38%	0.376	C	S	.	.			trans	-70.3	162.4	176.7	0	0	0	0	0	110.7	Y441 T445 G448 A449 I450	Y441-A443 HydrophobicContact CE1-CB 4.02Å; A443-T445 HydrophobicContact CB-CG2 4.34Å; A443-T445 PolarHBondContact O-N 2.97Å; A443-T445 VanDerWaalsContact O-N 3.08Å; A443-G448 PolarHBondContact N-O 3.42Å; A443-A449 WeakPolarHBondContact CB-O 3.17Å; A443-I450 HydrophobicContact CB-CG1 4.26Å
444	S	87.1	Confident	89.7	Confident	131 Å²	131	69.3 Å²	69.3	92%	0.916	40%	0.397	S	S	*	.	S	Bend	trans	-72.3	6.6	176.7	56.5	0	0	0	0	114.3
445	T	87.5	Confident	89.5	Confident	49 Å²	49	65.9 Å²	65.9	30%	0.301	38%	0.376	S	S	.	.	S	Bend	trans	-76.4	159.4	178.2	60.5	0	0	0	0	110.9	A443 S447 G448 A449	A443-T445 HydrophobicContact CB-CG2 4.34Å; A443-T445 PolarHBondContact O-N 2.97Å; A443-T445 VanDerWaalsContact O-N 3.08Å; T445-S447 PolarHBondContact O-N 2.94Å; T445-S447 PolarHBondContact OG1-OG 3.14Å; T445-G448 PolarHBondContact O-N 2.91Å; T445-G448 PolarHBondContact OG1-N 3.46Å; T445-A449 WeakPolarHBondContact CG2-O 3.31Å; T445-A449 PolarHBondContact OG1-N 3.19Å; T445-A449 VanDerWaalsContact OG1-N 3.17Å; T445-A449 PolarHBondContact OG1-O 3.41Å
446	A	85.1	Confident	89.3	Confident	120 Å²	120	66.4 Å²	66.4	99%	0.992	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.9	179.6	0	0	0	0	0	113.5
447	S	85.6	Confident	89.3	Confident	60 Å²	60	63.3 Å²	63.3	42%	0.42	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.9	174.8	56.6	0	0	0	0	113.3	T445 A449	T445-S447 PolarHBondContact O-N 2.94Å; T445-S447 PolarHBondContact OG1-OG 3.14Å; S447-A449 PolarHBondContact O-N 3.01Å; S447-A449 PolarHBondContact OG-N 3.34Å
448	G	89.8	Confident	89.5	Confident	11 Å²	11	61.4 Å²	61.4	11%	0.113	35%	0.346	C	S	.	.	S	Bend	trans	72.2	3.6	-169.7	0	0	0	0	0	114.4	K442 A443 T445	K442-G448 WeakPolarHBondContact CA-O 3.44Å; A443-G448 PolarHBondContact N-O 3.42Å; T445-G448 PolarHBondContact O-N 2.91Å; T445-G448 PolarHBondContact OG1-N 3.46Å
449	A	92.8	Very high	89.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-91.4	147.3	179.3	0	0	0	0	0	111.6	A443 T445 S447 T451 I527 D549 D551	A443-A449 WeakPolarHBondContact CB-O 3.17Å; T445-A449 WeakPolarHBondContact CG2-O 3.31Å; T445-A449 PolarHBondContact OG1-N 3.19Å; T445-A449 VanDerWaalsContact OG1-N 3.17Å; T445-A449 PolarHBondContact OG1-O 3.41Å; S447-A449 PolarHBondContact O-N 3.01Å; S447-A449 PolarHBondContact OG-N 3.34Å; A449-T451 PolarHBondContact O-N 3.08Å; A449-I527 HydrophobicContact CB-CG2 4.15Å; A449-D549 CarbonylContact C-O 3.05Å; A449-D549 VanDerWaalsContact CA-O 3.28Å; A449-D549 WeakPolarHBondContact CA-O 3.41Å; A449-D549 HydrophobicContact CB-CB 3.81Å; A449-D549 WeakPolarHBondContact CB-O 3.45Å; A449-D551 HydrophobicContact CB-CB 4.26Å
450	I	92.5	Very high	90	Very high	8 Å²	8	47.4 Å²	47.4	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	119.4	168	-61	174.6	0	0	0	107	I421 I433 Y441 A443 F548 D549 L550 D551	I421-I450 HydrophobicContact CD1-CG2 3.83Å; I433-I450 HydrophobicContact CD1-CD1 3.74Å; I433-I450 HydrophobicContact CD1-CG1 4.23Å; I433-I450 HydrophobicContact CD1-CG2 4.49Å; Y441-I450 HydrophobicContact CD1-CD1 3.96Å; Y441-I450 HydrophobicContact CD1-CG1 4.09Å; Y441-I450 HydrophobicContact CE1-CD1 3.96Å; Y441-I450 HydrophobicContact CE1-CG1 3.84Å; A443-I450 HydrophobicContact CB-CG1 4.26Å; I450-F548 HydrophobicContact CD1-CB 4.26Å; I450-F548 HydrophobicContact CD1-CD2 3.7Å; I450-F548 HydrophobicContact CD1-CE2 4.11Å; I450-F548 HydrophobicContact CD1-CG 3.92Å; I450-F548 HydrophobicContact CG1-CD2 4.39Å; I450-D549 PolarHBondContact N-O 3.4Å; I450-L550 HydrophobicContact CB-CD1 4.08Å; I450-L550 HydrophobicContact CG2-CD1 4.09Å; I450-L550 CarbonylContact O-C 3.54Å; I450-L550 WeakPolarHBondContact O-CA 3.33Å; I450-D551 PolarHBondContact O-N 2.69Å
451	T	90.8	Very high	89.9	Confident	44 Å²	44	46.9 Å²	46.9	27%	0.27	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.4	176.1	-57.6	0	0	0	0	109.1	A449	A449-T451 PolarHBondContact O-N 3.08Å
452	L	89.6	Confident	89.8	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-99.2	118.8	174.7	-164	63.9	0	0	0	108.5	I421 Q456 I458 P514 L550 D551 L552	I421-L452 HydrophobicContact CG2-CD1 3.85Å; L452-Q456 HydrophobicContact CD1-CB 3.57Å; L452-Q456 HydrophobicContact CG-CB 4.05Å; L452-I458 HydrophobicContact CD1-CB 4.44Å; L452-I458 HydrophobicContact CD2-CB 4.23Å; L452-I458 HydrophobicContact CD2-CG2 4.08Å; L452-P514 HydrophobicContact CD2-CG 3.31Å; L452-P514 HydrophobicContact CG-CG 4.32Å; L452-L550 HydrophobicContact CB-CD1 4.22Å; L452-D551 PolarHBondContact N-O 2.93Å; L452-D551 VanDerWaalsContact N-O 3.15Å; L452-L552 HydrophobicContact CB-CD2 4.28Å; L452-L552 HydrophobicContact CD2-CD2 3.82Å
453	E	85.9	Confident	89.7	Confident	125 Å²	125	39.1 Å²	39.1	58%	0.584	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-78.8	159.3	179.5	-59.5	-177.9	165.3	0	0	111.3	G455 Q456	E453-G455 PolarHBondContact O-N 3.32Å; E453-Q456 HydrophobicContact CB-CG 4.16Å; E453-Q456 WeakPolarHBondContact O-CB 3.47Å; E453-Q456 PolarHBondContact O-N 3.27Å
454	I	84	Confident	89.7	Confident	107 Å²	107	38.4 Å²	38.4	55%	0.549	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	134.2	177.5	-60.1	168.6	0	0	0	109.2	Q456 V555	I454-Q456 VanDerWaalsContact C-N 3.33Å; I454-V555 HydrophobicContact CD1-CG2 3.95Å; I454-V555 HydrophobicContact CG2-CG2 4.33Å
455	G	85.3	Confident	89.8	Confident	21 Å²	21	32.4 Å²	32.4	22%	0.216	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	8.4	-173.7	0	0	0	0	0	115.1	T424 E453 D515	T424-G455 PolarHBondContact N-O 2.73Å; T424-G455 PolarHBondContact OG1-O 2.71Å; E453-G455 PolarHBondContact O-N 3.32Å; G455-D515 WeakPolarHBondContact CA-OD2 3.18Å; G455-D515 PolarHBondContact N-OD2 3.23Å
456	Q	90.2	Very high	89.7	Confident	22 Å²	22	30.2 Å²	30.2	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.9	169	-62.5	-179.4	-15	0	0	111.2	I421 M422 L452 E453 I454 P514	I421-Q456 HydrophobicContact CG2-CB 4.27Å; M422-Q456 CarbonylContact O-C 3.52Å; M422-Q456 WeakPolarHBondContact O-CA 3.41Å; L452-Q456 HydrophobicContact CD1-CB 3.57Å; L452-Q456 HydrophobicContact CG-CB 4.05Å; E453-Q456 HydrophobicContact CB-CG 4.16Å; E453-Q456 WeakPolarHBondContact O-CB 3.47Å; E453-Q456 PolarHBondContact O-N 3.27Å; I454-Q456 VanDerWaalsContact C-N 3.33Å; Q456-P514 WeakPolarHBondContact O-CD 3.26Å
457	Q	91.2	Very high	89.4	Confident	21 Å²	21	26.5 Å²	26.5	10%	0.098	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	157.4	172.2	63.4	178	5.4	0	0	110.7	M422 L511 D513	M422-Q457 HydrophobicContact CB-CG 3.97Å; M422-Q457 HydrophobicContact CE-CG 4.35Å; M422-Q457 PolarHBondContact N-O 3.49Å; M422-Q457 PolarHBondContact O-N 3.31Å; Q457-L511 HydrophobicContact CG-CD1 4.35Å; Q457-D513 HydrophobicContact CB-CB 4.24Å
458	I	93.3	Very high	89.1	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.8	-178.5	-172.9	174	0	0	0	110.2	V419 L452 I460 L512 F548 L550	V419-I458 HydrophobicContact CG1-CD1 3.48Å; V419-I458 VanDerWaalsContact CG1-CD1 3.48Å; V419-I458 HydrophobicContact CG1-CG1 3.51Å; L452-I458 HydrophobicContact CD1-CB 4.44Å; L452-I458 HydrophobicContact CD2-CB 4.23Å; L452-I458 HydrophobicContact CD2-CG2 4.08Å; I458-I460 HydrophobicContact CG1-CG1 4.45Å; I458-L512 HydrophobicContact CG2-CB 3.73Å; I458-L512 HydrophobicContact CG2-CD2 4.02Å; I458-L512 HydrophobicContact CG2-CG 4.13Å; I458-L512 PolarHBondContact N-O 3.13Å; I458-L512 PolarHBondContact O-N 3.39Å; I458-F548 HydrophobicContact CD1-CE2 4.03Å; I458-F548 HydrophobicContact CD1-CZ 3.92Å; I458-L550 HydrophobicContact CD1-CD1 3.96Å; I458-L550 HydrophobicContact CD1-CD2 4.32Å
459	S	93	Very high	88.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.2	171.8	-177.3	0	0	0	0	109.5	V419 T420 D461 K509 L510	V419-S459 CarbonylContact C-O 3.56Å; V419-S459 WeakPolarHBondContact CA-O 3.32Å; T420-S459 PolarHBondContact N-O 2.59Å; T420-S459 PolarHBondContact O-N 2.94Å; S459-D461 PolarHBondContact OG-OD2 3.2Å; S459-K509 WeakPolarHBondContact OG-CE 3.2Å; S459-L510 CarbonylContact C-O 3.6Å; S459-L510 VanDerWaalsContact CA-O 3.31Å; S459-L510 WeakPolarHBondContact CA-O 3.44Å
460	I	95.1	Very high	88.1	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114	176.3	-56.5	172.7	0	0	0	107.3	V419 I458 L462 I479 K509 L510 V530 M547 F548	V419-I460 HydrophobicContact CG2-CG1 4.36Å; I458-I460 HydrophobicContact CG1-CG1 4.45Å; I460-L462 HydrophobicContact CG2-CD1 3.99Å; I460-L462 HydrophobicContact CG2-CD2 4.36Å; I460-L462 HydrophobicContact CG2-CG 3.98Å; I460-I479 HydrophobicContact CB-CD1 4Å; I460-I479 HydrophobicContact CD1-CD1 3.78Å; I460-I479 HydrophobicContact CD1-CG2 4.36Å; I460-I479 HydrophobicContact CG1-CD1 4.49Å; I460-I479 HydrophobicContact CG2-CD1 3.77Å; I460-K509 CarbonylContact O-C 3.6Å; I460-K509 WeakPolarHBondContact O-CA 3.18Å; I460-L510 HydrophobicContact CB-CB 4.48Å; I460-L510 PolarHBondContact N-O 3.27Å; I460-L510 PolarHBondContact O-N 3.4Å; I460-V530 HydrophobicContact CD1-CG1 4.48Å; I460-M547 HydrophobicContact CG2-CE 3.76Å; I460-F548 HydrophobicContact CD1-CE1 4.28Å; I460-F548 HydrophobicContact CD1-CZ 3.9Å; I460-F548 HydrophobicContact CG1-CZ 4.45Å
461	D	93.1	Very high	87.6	Confident	42 Å²	42	39.4 Å²	39.4	23%	0.225	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.3	-178.7	-72.8	-73.4	0	0	0	109.6	A417 T418 S459 Y508 K509	A417-D461 WeakPolarHBondContact CA-O 3.27Å; T418-D461 PolarHBondContact N-O 2.91Å; T418-D461 PolarHBondContact O-N 2.97Å; S459-D461 PolarHBondContact OG-OD2 3.2Å; D461-Y508 WeakPolarHBondContact CA-O 3.37Å; D461-K509 WeakPolarHBondContact OD1-CB 3.22Å; D461-K509 WeakPolarHBondContact OD1-CD 3.11Å; D461-K509 WeakPolarHBondContact OD1-CE 3.47Å; D461-K509 WeakPolarHBondContact OD1-CG 3.31Å
462	L	92.2	Very high	87.1	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.016	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.9	-170	-62.9	161.2	0	0	0	110.8	V414 Q416 A417 I460 I479 S507 Y508 L532 W545 M547	V414-L462 HydrophobicContact CG1-CD2 4.19Å; Q416-L462 WeakPolarHBondContact O-CA 3.29Å; A417-L462 HydrophobicContact CB-CD2 3.39Å; I460-L462 HydrophobicContact CG2-CD1 3.99Å; I460-L462 HydrophobicContact CG2-CD2 4.36Å; I460-L462 HydrophobicContact CG2-CG 3.98Å; L462-I479 HydrophobicContact CD1-CD1 4.23Å; L462-S507 CarbonylContact O-C 3.59Å; L462-S507 WeakPolarHBondContact O-CA 3.48Å; L462-Y508 PolarHBondContact N-O 3.18Å; L462-Y508 PolarHBondContact O-N 3.01Å; L462-L532 HydrophobicContact CD1-CD1 3.66Å; L462-L532 HydrophobicContact CD1-CD2 4.2Å; L462-L532 HydrophobicContact CD2-CD2 4.48Å; L462-W545 HydrophobicContact CD2-CZ3 4.41Å; L462-M547 HydrophobicContact CD2-CE 3.83Å
463	N	90.6	Very high	86.5	Confident	31 Å²	31	41.3 Å²	41.3	17%	0.166	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.7	168.2	176.1	-110.9	0	0	0	110	A415 Q416 V465 S471 K506	A415-N463 WeakPolarHBondContact CB-OD1 3.5Å; A415-N463 PolarHBondContact N-O 3.37Å; Q416-N463 PolarHBondContact O-N 3.47Å; N463-V465 VanDerWaalsContact OD1-CG1 3.26Å; N463-V465 WeakPolarHBondContact OD1-CG1 3.25Å; N463-S471 PolarHBondContact ND2-OG 3.4Å; N463-K506 PolarHBondContact ND2-O 3.23Å
464	I	90.3	Very high	86.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.5	-179.7	-54.7	172.2	0	0	0	107.8	A412 K413 L472 V477 Y508 V534	A412-I464 HydrophobicContact CB-CG2 4.12Å; K413-I464 WeakPolarHBondContact O-CA 3.44Å; I464-L472 HydrophobicContact CG2-CB 4.3Å; I464-L472 PolarHBondContact O-N 2.85Å; I464-V477 HydrophobicContact CD1-CG1 4.48Å; I464-V477 HydrophobicContact CD1-CG2 3.82Å; I464-Y508 HydrophobicContact CD1-CD2 3.77Å; I464-Y508 HydrophobicContact CD1-CE2 3.84Å; I464-Y508 HydrophobicContact CG1-CD2 4.17Å; I464-Y508 HydrophobicContact CG1-CE2 4.39Å; I464-V534 HydrophobicContact CD1-CB 4.5Å; I464-V534 HydrophobicContact CD1-CG1 3.88Å; I464-V534 HydrophobicContact CD1-CG2 3.76Å
465	V	88.7	Confident	85.7	Confident	6 Å²	6	37.8 Å²	37.8	4%	0.036	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	158.3	-179.7	-60.7	0	0	0	0	111.4	A412 K413 A415 N463 I470	A412-V465 WeakPolarHBondContact CA-O 3.26Å; K413-V465 PolarHBondContact N-O 2.98Å; K413-V465 PolarHBondContact O-N 2.88Å; A415-V465 HydrophobicContact CB-CB 4.36Å; A415-V465 HydrophobicContact CB-CG1 3.68Å; A415-V465 HydrophobicContact CB-CG2 3.76Å; N463-V465 VanDerWaalsContact OD1-CG1 3.26Å; N463-V465 WeakPolarHBondContact OD1-CG1 3.25Å; V465-I470 CarbonylContact C-O 3.55Å; V465-I470 WeakPolarHBondContact CA-O 3.47Å
466	D	85	Confident	85.6	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.011	21%	0.206	C	C	.	.			trans	-80.9	-177.6	170	76.7	-1.1	0	0	0	112.2	Q302 T410 E411 N468 R469 I470 L472	Q302-D466 PolarHBondContact NE2-OD2 3.42Å; Q302-D466 PolarHBondContact OE1-OD2 2.82Å; T410-D466 HydrophobicContact CG2-CB 3.83Å; E411-D466 CarbonylContact O-C 3.56Å; D466-N468 PolarHBondContact O-N 3.19Å; D466-N468 VanDerWaalsContact OD1-CA 3.24Å; D466-N468 WeakPolarHBondContact OD1-CA 3.31Å; D466-N468 WeakPolarHBondContact OD1-CB 3.19Å; D466-N468 PolarHBondContact OD1-N 3.25Å; D466-R469 PolarHBondContact O-N 3.37Å; D466-R469 PolarHBondContact OD1-N 2.71Å; D466-I470 PolarHBondContact N-O 2.9Å; D466-I470 WeakPolarHBondContact OD1-CB 3.23Å; D466-I470 PolarHBondContact OD1-N 3.46Å; D466-L472 HydrophobicContact CB-CD1 3.76Å; D466-L472 HydrophobicContact CB-CD2 3.98Å; D466-L472 HydrophobicContact CB-CG 3.83Å
467	S	79.5	Confident	85.6	Confident	42 Å²	42	40.3 Å²	40.3	29%	0.294	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.3	176	-62	0	0	0	0	113.7	E411 R469	E411-S467 PolarHBondContact O-N 3.29Å; E411-S467 PolarHBondContact O-OG 3.19Å; S467-R469 VanDerWaalsContact C-N 3.34Å
468	N	78.6	Confident	85.6	Confident	88 Å²	88	41.6 Å²	41.6	47%	0.471	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	9.4	178.6	-63.3	-40.1	0	0	0	112.8	Q302 D466 I470	Q302-N468 PolarHBondContact NE2-ND2 3.34Å; D466-N468 PolarHBondContact O-N 3.19Å; D466-N468 VanDerWaalsContact OD1-CA 3.24Å; D466-N468 WeakPolarHBondContact OD1-CA 3.31Å; D466-N468 WeakPolarHBondContact OD1-CB 3.19Å; D466-N468 PolarHBondContact OD1-N 3.25Å; N468-I470 HydrophobicContact CB-CD1 4.09Å; N468-I470 HydrophobicContact CB-CG1 4.11Å; N468-I470 PolarHBondContact O-N 3Å
469	R	79.3	Confident	85.7	Confident	179 Å²	179	41.6 Å²	41.6	68%	0.675	21%	0.207	S	C	*	.	S	Bend	trans	63.5	21.1	-176.4	-55.9	-66.7	-167.4	167.5	1.5	114.2	D466 S467	D466-R469 PolarHBondContact O-N 3.37Å; D466-R469 PolarHBondContact OD1-N 2.71Å; S467-R469 VanDerWaalsContact C-N 3.34Å
470	I	81.9	Confident	85.7	Confident	59 Å²	59	41.8 Å²	41.8	30%	0.303	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-83.9	135.1	172.8	-54.7	173.5	0	0	0	108.3	T373 V465 D466 N468 L472	T373-I470 HydrophobicContact CG2-CG2 4.2Å; V465-I470 CarbonylContact C-O 3.55Å; V465-I470 WeakPolarHBondContact CA-O 3.47Å; D466-I470 PolarHBondContact N-O 2.9Å; D466-I470 WeakPolarHBondContact OD1-CB 3.23Å; D466-I470 PolarHBondContact OD1-N 3.46Å; N468-I470 HydrophobicContact CB-CD1 4.09Å; N468-I470 HydrophobicContact CB-CG1 4.11Å; N468-I470 PolarHBondContact O-N 3Å; I470-L472 PolarHBondContact O-N 3.21Å
471	S	82.1	Confident	85.6	Confident	25 Å²	25	41.7 Å²	41.7	18%	0.175	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-63.3	130.2	-179.4	-155.8	0	0	0	0	111	N463 E504 K506	N463-S471 PolarHBondContact ND2-OG 3.4Å; S471-E504 WeakPolarHBondContact CB-O 3.2Å; S471-K506 PolarHBondContact OG-N 3.11Å; S471-K506 PolarHBondContact OG-O 3.2Å
472	L	80.6	Confident	85.6	Confident	17 Å²	17	40.4 Å²	40.4	9%	0.089	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-100.6	144.4	178.5	-73.5	173.8	0	0	0	111.7	A374 T410 A412 I464 D466 I470	A374-L472 HydrophobicContact CB-CD2 4.35Å; T410-L472 HydrophobicContact CG2-CD1 3.76Å; T410-L472 HydrophobicContact CG2-CD2 4.03Å; A412-L472 HydrophobicContact CB-CD1 3.77Å; I464-L472 HydrophobicContact CG2-CB 4.3Å; I464-L472 PolarHBondContact O-N 2.85Å; D466-L472 HydrophobicContact CB-CD1 3.76Å; D466-L472 HydrophobicContact CB-CD2 3.98Å; D466-L472 HydrophobicContact CB-CG 3.83Å; I470-L472 PolarHBondContact O-N 3.21Å
473	T	77.6	Confident	85.4	Confident	69 Å²	69	40.5 Å²	40.5	42%	0.423	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-96	122	159.6	49.7	0	0	0	0	109.6	E496 K506 Y508	T473-E496 WeakPolarHBondContact CG2-OE1 3.41Å; T473-K506 HydrophobicContact CG2-CD 3.37Å; T473-Y508 WeakPolarHBondContact CA-OH 3.48Å
474	A	79.4	Confident	85.3	Confident	9 Å²	9	43.1 Å²	43.1	7%	0.074	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-96.2	141.6	165.1	0	0	0	0	0	110.3	Q476 V477 Y508 V534 D536 I539	A474-Q476 PolarHBondContact O-N 3.35Å; A474-V477 HydrophobicContact CB-CG2 3.86Å; A474-Y508 PolarHBondContact N-OH 3.04Å; A474-Y508 PolarHBondContact O-OH 3.36Å; A474-V534 HydrophobicContact CB-CG1 3.74Å; A474-D536 HydrophobicContact CB-CB 4.1Å; A474-I539 HydrophobicContact CB-CD1 4.31Å
475	H	73.6	Confident	85	Confident	150 Å²	150	51.9 Å²	51.9	69%	0.694	25%	0.251	S	S	*	.	S	Bend	trans	-57	-38.8	177.4	179.2	-135.1	0	0	0	111.3	D536	H475-D536 WeakPolarHBondContact CA-OD2 3.26Å; H475-D536 WeakPolarHBondContact CB-OD2 3.05Å; H475-D536 PolarHBondContact N-OD2 2.94Å
476	Q	81.8	Confident	84.6	Confident	93 Å²	93	52.7 Å²	52.7	44%	0.435	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	133.1	174.7	-61.1	-179.4	-25.4	0	0	111.3	A474 F478 G535	A474-Q476 PolarHBondContact O-N 3.35Å; Q476-F478 HydrophobicContact CB-CD2 4.3Å; Q476-F478 HydrophobicContact CB-CE1 4.41Å; Q476-F478 HydrophobicContact CB-CE2 3.51Å; Q476-F478 HydrophobicContact CB-CZ 3.6Å; Q476-F478 HydrophobicContact CG-CE2 4.36Å; Q476-F478 HydrophobicContact CG-CZ 4.06Å; Q476-F478 VanDerWaalsContact OE1-CZ 3.22Å; Q476-G535 PolarHBondContact O-N 2.97Å
477	V	90.1	Very high	84.4	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.3	173.6	178.7	0	0	0	0	107.5	I464 A474 C494 Y508 L532 V534	I464-V477 HydrophobicContact CD1-CG1 4.48Å; I464-V477 HydrophobicContact CD1-CG2 3.82Å; A474-V477 HydrophobicContact CB-CG2 3.86Å; V477-C494 HydrophobicContact CB-CB 4.11Å; V477-C494 HydrophobicContact CG1-CB 3.98Å; V477-C494 PolarHBondContact O-N 3.25Å; V477-Y508 HydrophobicContact CB-CD1 3.92Å; V477-Y508 HydrophobicContact CB-CE1 4.21Å; V477-Y508 HydrophobicContact CB-CG 4.23Å; V477-Y508 HydrophobicContact CG1-CD1 4.46Å; V477-Y508 HydrophobicContact CG1-CG 4.31Å; V477-Y508 HydrophobicContact CG2-CD1 3.66Å; V477-Y508 HydrophobicContact CG2-CD2 4.04Å; V477-Y508 HydrophobicContact CG2-CE1 3.56Å; V477-Y508 HydrophobicContact CG2-CE2 3.96Å; V477-Y508 HydrophobicContact CG2-CG 3.9Å; V477-L532 HydrophobicContact CG1-CD1 3.8Å; V477-V534 HydrophobicContact CG1-CG2 4.21Å; V477-V534 HydrophobicContact CG2-CG1 4.31Å
478	F	92.7	Very high	84.5	Confident	49 Å²	49	55.3 Å²	55.3	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	147.6	-176.3	-58.8	-70.5	0	0	0	111.7	Q476 T491 Y492 T493 I533	Q476-F478 HydrophobicContact CB-CD2 4.3Å; Q476-F478 HydrophobicContact CB-CE1 4.41Å; Q476-F478 HydrophobicContact CB-CE2 3.51Å; Q476-F478 HydrophobicContact CB-CZ 3.6Å; Q476-F478 HydrophobicContact CG-CE2 4.36Å; Q476-F478 HydrophobicContact CG-CZ 4.06Å; Q476-F478 VanDerWaalsContact OE1-CZ 3.22Å; F478-T491 HydrophobicContact CB-CG2 3.78Å; F478-T491 HydrophobicContact CD1-CG2 3.94Å; F478-T491 HydrophobicContact CG-CG2 4.03Å; F478-Y492 CarbonylContact C-O 3.56Å; F478-Y492 WeakPolarHBondContact CA-O 3.3Å; F478-T493 HydrophobicContact CD1-CG2 4.25Å; F478-T493 HydrophobicContact CE1-CG2 4.05Å; F478-T493 VanDerWaalsContact CE1-OG1 3.29Å; F478-T493 WeakPolarHBondContact CE1-OG1 3.22Å; F478-I533 HydrophobicContact CB-CB 4.24Å; F478-I533 PolarHBondContact N-O 2.71Å; F478-I533 PolarHBondContact O-N 3.31Å
479	I	94.1	Very high	84.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.2	166.5	-67.2	174.1	0	0	0	107.3	I460 L462 L481 Y492 L510 V530 D531 L532	I460-I479 HydrophobicContact CB-CD1 4Å; I460-I479 HydrophobicContact CD1-CD1 3.78Å; I460-I479 HydrophobicContact CD1-CG2 4.36Å; I460-I479 HydrophobicContact CG1-CD1 4.49Å; I460-I479 HydrophobicContact CG2-CD1 3.77Å; L462-I479 HydrophobicContact CD1-CD1 4.23Å; I479-L481 HydrophobicContact CG2-CD1 4.12Å; I479-Y492 PolarHBondContact N-O 2.85Å; I479-Y492 PolarHBondContact O-N 2.96Å; I479-L510 HydrophobicContact CB-CD2 3.73Å; I479-L510 HydrophobicContact CD1-CB 3.92Å; I479-L510 HydrophobicContact CD1-CD2 3.68Å; I479-L510 HydrophobicContact CD1-CG 4.46Å; I479-L510 HydrophobicContact CG1-CD2 4.21Å; I479-L510 HydrophobicContact CG2-CD2 3.98Å; I479-V530 HydrophobicContact CG2-CG1 3.6Å; I479-D531 WeakPolarHBondContact CA-O 3.48Å; I479-L532 HydrophobicContact CG1-CD1 4.16Å
480	Q	92.9	Very high	85.3	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.028	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.3	179.4	-175.6	174	65	0	0	110	A489 I490 T491 V530 D531 I533 A591 I592	Q480-A489 HydrophobicContact CG-CB 4.08Å; Q480-I490 CarbonylContact C-O 3.55Å; Q480-I490 WeakPolarHBondContact CA-O 3.41Å; Q480-T491 PolarHBondContact NE2-OG1 3.15Å; Q480-V530 WeakPolarHBondContact O-CA 2.98Å; Q480-D531 PolarHBondContact N-O 2.79Å; Q480-D531 PolarHBondContact O-N 3.38Å; Q480-I533 HydrophobicContact CB-CD1 4.08Å; Q480-A591 PolarHBondContact OE1-O 3.1Å; Q480-I592 PolarHBondContact NE2-O 3.23Å
481	L	93.6	Very high	85.7	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.3	174.8	-66.2	90.9	0	0	0	108.4	I479 A489 I490 Y492 L512 F521 Y528 K529 V530 L550 L552	I479-L481 HydrophobicContact CG2-CD1 4.12Å; L481-A489 VanDerWaalsContact O-CA 3.3Å; L481-A489 WeakPolarHBondContact O-CA 3.27Å; L481-I490 PolarHBondContact N-O 3.28Å; L481-I490 PolarHBondContact O-N 3.25Å; L481-Y492 HydrophobicContact CD1-CD2 3.73Å; L481-Y492 HydrophobicContact CD1-CE2 4.01Å; L481-L512 HydrophobicContact CD2-CD2 3.71Å; L481-F521 HydrophobicContact CB-CE1 4.14Å; L481-F521 HydrophobicContact CD2-CE1 4.13Å; L481-F521 HydrophobicContact CD2-CZ 4.1Å; L481-Y528 HydrophobicContact CB-CD1 4.04Å; L481-K529 CarbonylContact C-O 3.56Å; L481-K529 WeakPolarHBondContact CA-O 3.4Å; L481-V530 HydrophobicContact CD2-CG2 4.3Å; L481-V530 HydrophobicContact CG-CG2 4.22Å; L481-L550 HydrophobicContact CD2-CD2 4.14Å; L481-L552 HydrophobicContact CD2-CD1 4.24Å
482	T	91.9	Very high	86.1	Confident	15 Å²	15	44 Å²	44	9%	0.092	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.2	-177.7	-56.3	0	0	0	0	111	Q484 Q488 A489 Y528 K529	T482-Q484 PolarHBondContact O-N 3.17Å; T482-Q488 CarbonylContact C-O 2.94Å; T482-Q488 VanDerWaalsContact CA-O 3.31Å; T482-Q488 WeakPolarHBondContact CA-O 3.46Å; T482-A489 HydrophobicContact CG2-CB 4.21Å; T482-A489 WeakPolarHBondContact OG1-CB 3.3Å; T482-Y528 CarbonylContact O-C 3.59Å; T482-Y528 WeakPolarHBondContact O-CA 3.25Å; T482-K529 PolarHBondContact N-O 2.57Å; T482-K529 PolarHBondContact O-N 2.99Å
483	H	89.8	Confident	86.6	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	124	178	-174.2	-119.8	0	0	0	111	K485 T486 Q487 Q488 L524 I527 Y528	H483-K485 VanDerWaalsContact C-N 3.33Å; H483-K485 PolarHBondContact O-N 3.05Å; H483-T486 PolarHBondContact ND1-N 2.86Å; H483-T486 PolarHBondContact ND1-OG1 2.62Å; H483-Q487 VanDerWaalsContact O-CA 3.23Å; H483-Q487 WeakPolarHBondContact O-CA 3.37Å; H483-Q487 PolarHBondContact O-N 3.31Å; H483-Q488 PolarHBondContact N-O 3.46Å; H483-L524 HydrophobicContact CB-CD2 4.22Å; H483-L524 WeakPolarHBondContact ND1-CD2 3.28Å; H483-I527 PolarHBondContact CD2-O 3.44Å; H483-Y528 HydrophobicContact CB-CD1 3.9Å; H483-Y528 HydrophobicContact CB-CE1 3.52Å; H483-Y528 AromaticContact CD2-CE2 3.78Å; H483-Y528 AromaticContact CD2-CZ 3.87Å
484	Q	87.5	Confident	87.3	Confident	85 Å²	85	44.5 Å²	44.5	40%	0.397	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-35	-170.2	-69.8	-175.1	-11.4	0	0	113.3	T482 Q487 I527 D549	T482-Q484 PolarHBondContact O-N 3.17Å; Q484-Q487 PolarHBondContact O-NE2 3.4Å; Q484-I527 HydrophobicContact CG-CG2 4.27Å; Q484-I527 PolarHBondContact N-O 3.37Å; Q484-D549 PolarHBondContact NE2-OD1 3.03Å
485	K	84	Confident	87.7	Confident	185 Å²	185	48.3 Å²	48.3	80%	0.804	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-40.5	-176.9	-62.8	179.5	178.4	175.6	0	113.6	H483	H483-K485 VanDerWaalsContact C-N 3.33Å; H483-K485 PolarHBondContact O-N 3.05Å
486	T	79.9	Confident	88.3	Confident	23 Å²	23	45.1 Å²	45.1	14%	0.141	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-11.6	-174.1	61.3	0	0	0	0	113.3	H483 Q488 L524 I566	H483-T486 PolarHBondContact ND1-N 2.86Å; H483-T486 PolarHBondContact ND1-OG1 2.62Å; T486-Q488 PolarHBondContact O-N 2.94Å; T486-Q488 VanDerWaalsContact O-N 3.1Å; T486-L524 HydrophobicContact CG2-CD2 3.94Å; T486-L524 WeakPolarHBondContact OG1-CD2 3.21Å; T486-I566 HydrophobicContact CG2-CD1 4.47Å; T486-I566 HydrophobicContact CG2-CG1 3.76Å
487	Q	81.9	Confident	88.1	Confident	98 Å²	98	42.9 Å²	42.9	46%	0.458	22%	0.22	S	C	.	.			trans	56.1	19.8	-173.9	-59.7	-66.8	-53.7	0	0	113.7	H483 Q484 P589	H483-Q487 VanDerWaalsContact O-CA 3.23Å; H483-Q487 WeakPolarHBondContact O-CA 3.37Å; H483-Q487 PolarHBondContact O-N 3.31Å; Q484-Q487 PolarHBondContact O-NE2 3.4Å; Q487-P589 HydrophobicContact CB-CG 4.41Å
488	Q	82	Confident	87	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.245	C	C	.	.			trans	-69	135.7	168.5	-75.3	176	-10.7	0	0	109	T482 H483 T486 T562	T482-Q488 CarbonylContact C-O 2.94Å; T482-Q488 VanDerWaalsContact CA-O 3.31Å; T482-Q488 WeakPolarHBondContact CA-O 3.46Å; H483-Q488 PolarHBondContact N-O 3.46Å; T486-Q488 PolarHBondContact O-N 2.94Å; T486-Q488 VanDerWaalsContact O-N 3.1Å; Q488-T562 PolarHBondContact NE2-OG1 2.94Å; Q488-T562 PolarHBondContact OE1-OG1 3.46Å
489	A	86.6	Confident	85.3	Confident	6 Å²	6	48.4 Å²	48.4	5%	0.05	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.5	-174.9	0	0	0	0	0	110.9	Q480 L481 T482 G594 G596	Q480-A489 HydrophobicContact CG-CB 4.08Å; L481-A489 VanDerWaalsContact O-CA 3.3Å; L481-A489 WeakPolarHBondContact O-CA 3.27Å; T482-A489 HydrophobicContact CG2-CB 4.21Å; T482-A489 WeakPolarHBondContact OG1-CB 3.3Å; A489-G594 VanDerWaalsContact CB-CA 3.44Å; A489-G596 WeakPolarHBondContact O-CA 3.22Å; A489-G596 PolarHBondContact O-N 3.33Å; A489-G596 VanDerWaalsContact O-N 3.14Å
490	I	88.1	Confident	83.3	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.072	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.3	177.8	-57.7	80.9	0	0	0	107.1	Q480 L481 Y492 F521 Y528	Q480-I490 CarbonylContact C-O 3.55Å; Q480-I490 WeakPolarHBondContact CA-O 3.41Å; L481-I490 PolarHBondContact N-O 3.28Å; L481-I490 PolarHBondContact O-N 3.25Å; I490-Y492 HydrophobicContact CB-CE2 4.41Å; I490-Y492 HydrophobicContact CG2-CD2 4.15Å; I490-Y492 HydrophobicContact CG2-CE2 3.5Å; I490-F521 HydrophobicContact CB-CE1 4.25Å; I490-F521 HydrophobicContact CD1-CD1 3.54Å; I490-F521 HydrophobicContact CD1-CE1 3.84Å; I490-F521 HydrophobicContact CD1-CG 4.38Å; I490-F521 HydrophobicContact CG1-CD1 4Å; I490-F521 HydrophobicContact CG1-CE1 4.11Å; I490-Y528 HydrophobicContact CD1-CE1 4.17Å
491	T	90.2	Very high	81.4	Confident	63 Å²	63	64.9 Å²	64.9	39%	0.387	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.4	-177.1	-56.7	0	0	0	0	110.3	F478 Q480	F478-T491 HydrophobicContact CB-CG2 3.78Å; F478-T491 HydrophobicContact CD1-CG2 3.94Å; F478-T491 HydrophobicContact CG-CG2 4.03Å; Q480-T491 PolarHBondContact NE2-OG1 3.15Å
492	Y	90.7	Very high	79.3	Confident	32 Å²	32	70.5 Å²	70.5	13%	0.125	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	149.3	173.5	-68.5	-86	0	0	0	111.1	F478 I479 L481 I490 L510 L512 E520 F521	F478-Y492 CarbonylContact C-O 3.56Å; F478-Y492 WeakPolarHBondContact CA-O 3.3Å; I479-Y492 PolarHBondContact N-O 2.85Å; I479-Y492 PolarHBondContact O-N 2.96Å; L481-Y492 HydrophobicContact CD1-CD2 3.73Å; L481-Y492 HydrophobicContact CD1-CE2 4.01Å; I490-Y492 HydrophobicContact CB-CE2 4.41Å; I490-Y492 HydrophobicContact CG2-CD2 4.15Å; I490-Y492 HydrophobicContact CG2-CE2 3.5Å; Y492-L510 HydrophobicContact CG-CD1 4.26Å; Y492-L510 HydrophobicContact CG-CD2 4.46Å; Y492-L512 HydrophobicContact CE2-CD1 4.13Å; Y492-E520 WeakPolarHBondContact CE1-OE2 3.39Å; Y492-E520 PolarHBondContact OH-OE2 3.42Å; Y492-F521 HydrophobicContact CE2-CE2 4.29Å; Y492-F521 AromaticContact CE2-CZ 3.9Å; Y492-F521 HydrophobicContact CE2-CZ 3.9Å; Y492-F521 VanDerWaalsContact OH-CE2 3.28Å; Y492-F521 WeakPolarHBondContact OH-CE2 3.39Å
493	T	90.8	Very high	77.3	Confident	85 Å²	85	74.4 Å²	74.4	52%	0.521	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.2	172.8	-48.7	0	0	0	0	109.1	F478	F478-T493 HydrophobicContact CD1-CG2 4.25Å; F478-T493 HydrophobicContact CE1-CG2 4.05Å; F478-T493 VanDerWaalsContact CE1-OG1 3.29Å; F478-T493 WeakPolarHBondContact CE1-OG1 3.22Å
494	C	91.5	Very high	75.7	Confident	10 Å²	10	82.1 Å²	82.1	7%	0.068	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-74.3	144	174.5	-60.7	0	0	0	0	110.9	V477 Y508 K509	V477-C494 HydrophobicContact CB-CB 4.11Å; V477-C494 HydrophobicContact CG1-CB 3.98Å; V477-C494 PolarHBondContact O-N 3.25Å; C494-Y508 HydrophobicContact CB-CD1 4.27Å; C494-K509 CarbonylContact C-O 3.49Å; C494-K509 WeakPolarHBondContact CA-O 3.47Å
495	T	88.9	Confident	74.6	Confident	89 Å²	89	84 Å²	84	55%	0.546	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.7	173.2	50.9	0	0	0	0	110.1	Y508 K509	T495-Y508 WeakPolarHBondContact O-CA 3.38Å; T495-K509 PolarHBondContact N-O 3.49Å; T495-K509 PolarHBondContact O-N 3.05Å; T495-K509 PolarHBondContact OG1-O 3.03Å; T495-K509 VanDerWaalsContact OG1-O 3.12Å
496	E	85.3	Confident	74.3	Confident	84 Å²	84	77.6 Å²	77.6	39%	0.393	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.5	171.5	-172.9	-177.9	164.6	0	0	109	T473 K506 Y508	T473-E496 WeakPolarHBondContact CG2-OE1 3.41Å; E496-K506 VanDerWaalsContact OE1-CD 3.31Å; E496-K506 WeakPolarHBondContact OE1-CD 2.97Å; E496-K506 WeakPolarHBondContact OE1-CE 3.42Å; E496-K506 IonicContact OE1-NZ 2.91Å; E496-K506 PolarHBondContact OE1-NZ 3.28Å; E496-Y508 HydrophobicContact CB-CD1 4.27Å; E496-Y508 HydrophobicContact CB-CE1 3.9Å; E496-Y508 HydrophobicContact CG-CE1 4.21Å
497	T	77.8	Confident	74.5	Confident	45 Å²	45	77.8 Å²	77.8	28%	0.276	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.8	176.1	49.9	0	0	0	0	108.4	S507 K509	T497-S507 PolarHBondContact N-O 2.91Å; T497-S507 PolarHBondContact O-N 3.16Å; T497-S507 PolarHBondContact OG1-O 3.4Å; T497-S507 PolarHBondContact OG1-OG 2.94Å; T497-K509 HydrophobicContact CG2-CB 4.27Å
498	I	66.9	Low	75	Confident	102 Å²	102	73.4 Å²	73.4	52%	0.523	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.3	172.4	-56.2	172.4	0	0	0	105.5
499	T	57.4	Low	75.5	Confident	66 Å²	66	77.1 Å²	77.1	41%	0.405	40%	0.399	S	S	.	.			trans	-81.7	122.6	173.4	45.8	0	0	0	0	108.7	E501 K502 K505	T499-E501 PolarHBondContact O-N 3.47Å; T499-K502 CarbonylContact O-C 3.54Å; T499-K502 PolarHBondContact O-N 3.49Å; T499-K502 VanDerWaalsContact O-N 3.14Å; T499-K505 PolarHBondContact OG1-O 2.93Å
500	D	51	Low	75.8	Confident	166 Å²	166	77.4 Å²	77.4	89%	0.888	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-25	-176.5	-82	-33.8	0	0	0	113.2	K502	D500-K502 VanDerWaalsContact C-N 3.29Å; D500-K502 PolarHBondContact O-N 2.89Å
501	E	53.1	Low	76	Confident	185 Å²	185	81.2 Å²	81.2	86%	0.864	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.5	-178.6	-62.8	-168	168.7	0	0	113.1	T499	T499-E501 PolarHBondContact O-N 3.47Å
502	K	50.7	Low	76.1	Confident	121 Å²	121	78.5 Å²	78.5	53%	0.526	40%	0.403	S	S	.	.			trans	-151.7	106.1	176.4	-65.7	-173.2	-178.2	178.7	0	110.3	T499 D500 E504 K505	T499-K502 CarbonylContact O-C 3.54Å; T499-K502 PolarHBondContact O-N 3.49Å; T499-K502 VanDerWaalsContact O-N 3.14Å; D500-K502 VanDerWaalsContact C-N 3.29Å; D500-K502 PolarHBondContact O-N 2.89Å; K502-E504 PolarHBondContact O-N 2.97Å; K502-K505 HydrophobicContact CB-CB 4.37Å; K502-K505 HydrophobicContact CB-CG 4.43Å; K502-K505 HydrophobicContact CD-CD 4.5Å; K502-K505 PolarHBondContact O-N 3.23Å
503	P	49.6	Very low	76.1	Confident	98 Å²	98	78.1 Å²	78.1	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-18.3	177.2	23.3	-33	0	0	0	113.4
504	E	56.1	Low	76	Confident	167 Å²	167	74.3 Å²	74.3	78%	0.78	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-17.3	176.2	-63.8	-169.7	166.4	0	0	114.4	S471 K502	S471-E504 WeakPolarHBondContact CB-O 3.2Å; K502-E504 PolarHBondContact O-N 2.97Å
505	K	64.2	Low	75.7	Confident	124 Å²	124	77 Å²	77	54%	0.539	39%	0.393	S	S	.	.			trans	-101.5	104.4	178.2	-76.1	-166.9	175.7	-169.8	0	110.6	T499 K502	T499-K505 PolarHBondContact OG1-O 2.93Å; K502-K505 HydrophobicContact CB-CB 4.37Å; K502-K505 HydrophobicContact CB-CG 4.43Å; K502-K505 HydrophobicContact CD-CD 4.5Å; K502-K505 PolarHBondContact O-N 3.23Å
506	K	77.1	Confident	75.5	Confident	52 Å²	52	80.1 Å²	80.1	23%	0.226	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.1	178.9	-63.9	174.3	163.4	-129.8	0	109.9	N463 S471 T473 E496	N463-K506 PolarHBondContact ND2-O 3.23Å; S471-K506 PolarHBondContact OG-N 3.11Å; S471-K506 PolarHBondContact OG-O 3.2Å; T473-K506 HydrophobicContact CG2-CD 3.37Å; E496-K506 VanDerWaalsContact OE1-CD 3.31Å; E496-K506 WeakPolarHBondContact OE1-CD 2.97Å; E496-K506 WeakPolarHBondContact OE1-CE 3.42Å; E496-K506 IonicContact OE1-NZ 2.91Å; E496-K506 PolarHBondContact OE1-NZ 3.28Å
507	S	85.5	Confident	75.7	Confident	27 Å²	27	76.9 Å²	76.9	19%	0.189	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.5	177.7	41.1	0	0	0	0	110.8	L462 T497	L462-S507 CarbonylContact O-C 3.59Å; L462-S507 WeakPolarHBondContact O-CA 3.48Å; T497-S507 PolarHBondContact N-O 2.91Å; T497-S507 PolarHBondContact O-N 3.16Å; T497-S507 PolarHBondContact OG1-O 3.4Å; T497-S507 PolarHBondContact OG1-OG 2.94Å
508	Y	91.5	Very high	76.1	Confident	5 Å²	5	75.2 Å²	75.2	2%	0.02	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.5	173.4	-70.2	-81.9	0	0	0	108.6	D461 L462 I464 T473 A474 V477 C494 T495 E496	D461-Y508 WeakPolarHBondContact CA-O 3.37Å; L462-Y508 PolarHBondContact N-O 3.18Å; L462-Y508 PolarHBondContact O-N 3.01Å; I464-Y508 HydrophobicContact CD1-CD2 3.77Å; I464-Y508 HydrophobicContact CD1-CE2 3.84Å; I464-Y508 HydrophobicContact CG1-CD2 4.17Å; I464-Y508 HydrophobicContact CG1-CE2 4.39Å; T473-Y508 WeakPolarHBondContact CA-OH 3.48Å; A474-Y508 PolarHBondContact N-OH 3.04Å; A474-Y508 PolarHBondContact O-OH 3.36Å; V477-Y508 HydrophobicContact CB-CD1 3.92Å; V477-Y508 HydrophobicContact CB-CE1 4.21Å; V477-Y508 HydrophobicContact CB-CG 4.23Å; V477-Y508 HydrophobicContact CG1-CD1 4.46Å; V477-Y508 HydrophobicContact CG1-CG 4.31Å; V477-Y508 HydrophobicContact CG2-CD1 3.66Å; V477-Y508 HydrophobicContact CG2-CD2 4.04Å; V477-Y508 HydrophobicContact CG2-CE1 3.56Å; V477-Y508 HydrophobicContact CG2-CE2 3.96Å; V477-Y508 HydrophobicContact CG2-CG 3.9Å; C494-Y508 HydrophobicContact CB-CD1 4.27Å; T495-Y508 WeakPolarHBondContact O-CA 3.38Å; E496-Y508 HydrophobicContact CB-CD1 4.27Å; E496-Y508 HydrophobicContact CB-CE1 3.9Å; E496-Y508 HydrophobicContact CG-CE1 4.21Å
509	K	92	Very high	76.9	Confident	78 Å²	78	73.2 Å²	73.2	34%	0.339	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.5	-178.7	-172.8	165.9	-163.4	171.1	0	110.5	S459 I460 D461 C494 T495 T497	S459-K509 WeakPolarHBondContact OG-CE 3.2Å; I460-K509 CarbonylContact O-C 3.6Å; I460-K509 WeakPolarHBondContact O-CA 3.18Å; D461-K509 WeakPolarHBondContact OD1-CB 3.22Å; D461-K509 WeakPolarHBondContact OD1-CD 3.11Å; D461-K509 WeakPolarHBondContact OD1-CE 3.47Å; D461-K509 WeakPolarHBondContact OD1-CG 3.31Å; C494-K509 CarbonylContact C-O 3.49Å; C494-K509 WeakPolarHBondContact CA-O 3.47Å; T495-K509 PolarHBondContact N-O 3.49Å; T495-K509 PolarHBondContact O-N 3.05Å; T495-K509 PolarHBondContact OG1-O 3.03Å; T495-K509 VanDerWaalsContact OG1-O 3.12Å; T497-K509 HydrophobicContact CG2-CB 4.27Å
510	L	94.1	Very high	78.2	Confident	13 Å²	13	74.8 Å²	74.8	7%	0.068	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.3	163.5	176.1	66.1	0	0	0	108.3	S459 I460 I479 Y492	S459-L510 CarbonylContact C-O 3.6Å; S459-L510 VanDerWaalsContact CA-O 3.31Å; S459-L510 WeakPolarHBondContact CA-O 3.44Å; I460-L510 HydrophobicContact CB-CB 4.48Å; I460-L510 PolarHBondContact N-O 3.27Å; I460-L510 PolarHBondContact O-N 3.4Å; I479-L510 HydrophobicContact CB-CD2 3.73Å; I479-L510 HydrophobicContact CD1-CB 3.92Å; I479-L510 HydrophobicContact CD1-CD2 3.68Å; I479-L510 HydrophobicContact CD1-CG 4.46Å; I479-L510 HydrophobicContact CG1-CD2 4.21Å; I479-L510 HydrophobicContact CG2-CD2 3.98Å; Y492-L510 HydrophobicContact CG-CD1 4.26Å; Y492-L510 HydrophobicContact CG-CD2 4.46Å
511	L	92.2	Very high	79.9	Confident	94 Å²	94	66.9 Å²	66.9	49%	0.492	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.2	167.8	-175.9	68.1	0	0	0	108	M422 Q457	M422-L511 HydrophobicContact CE-CD1 3.91Å; Q457-L511 HydrophobicContact CG-CD1 4.35Å
512	L	92.3	Very high	81.4	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.5	174.6	172.9	67.3	0	0	0	108.7	I458 L481 Y492 F521	I458-L512 HydrophobicContact CG2-CB 3.73Å; I458-L512 HydrophobicContact CG2-CD2 4.02Å; I458-L512 HydrophobicContact CG2-CG 4.13Å; I458-L512 PolarHBondContact N-O 3.13Å; I458-L512 PolarHBondContact O-N 3.39Å; L481-L512 HydrophobicContact CD2-CD2 3.71Å; Y492-L512 HydrophobicContact CE2-CD1 4.13Å; L512-F521 HydrophobicContact CD1-CE2 4.03Å; L512-F521 HydrophobicContact CD1-CZ 4.21Å; L512-F521 HydrophobicContact CD2-CZ 4.38Å
513	D	90.4	Very high	83.2	Confident	23 Å²	23	57.7 Å²	57.7	12%	0.123	30%	0.296	C	S	.	.			trans	-105.2	107	168.8	-179.2	-20.2	0	0	0	107.7	T424 Q457 D515 M516 S517	T424-D513 WeakPolarHBondContact CG2-OD2 3.25Å; Q457-D513 HydrophobicContact CB-CB 4.24Å; D513-D515 PolarHBondContact O-N 3.13Å; D513-D515 WeakPolarHBondContact OD1-CB 3.32Å; D513-D515 PolarHBondContact OD1-N 2.93Å; D513-M516 HydrophobicContact CB-CB 4.01Å; D513-M516 HydrophobicContact CB-CG 4.14Å; D513-M516 PolarHBondContact O-N 3.04Å; D513-M516 PolarHBondContact OD1-N 3.26Å; D513-M516 VanDerWaalsContact OD2-CG 3.27Å; D513-M516 WeakPolarHBondContact OD2-CG 3.44Å; D513-S517 WeakPolarHBondContact O-CB 3.41Å; D513-S517 PolarHBondContact O-N 2.81Å; D513-S517 PolarHBondContact O-OG 3.2Å
514	P	88.1	Confident	85	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.039	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-34.6	-179.4	-20.2	30.1	0	0	0	113.2	L452 Q456 S517 A518 L552 F554	L452-P514 HydrophobicContact CD2-CG 3.31Å; L452-P514 HydrophobicContact CG-CG 4.32Å; Q456-P514 WeakPolarHBondContact O-CD 3.26Å; P514-S517 PolarHBondContact O-N 3.48Å; P514-A518 WeakPolarHBondContact O-CA 3.5Å; P514-A518 WeakPolarHBondContact O-CB 3.45Å; P514-A518 PolarHBondContact O-N 3.4Å; P514-L552 HydrophobicContact CB-CD2 4.28Å; P514-L552 HydrophobicContact CG-CD2 3.89Å; P514-F554 HydrophobicContact CB-CD1 4.24Å; P514-F554 HydrophobicContact CB-CE1 3.66Å; P514-F554 HydrophobicContact CB-CZ 4.47Å; P514-F554 WeakPolarHBondContact O-CD1 3.47Å; P514-F554 WeakPolarHBondContact O-CE1 3.48Å
515	D	84.8	Confident	86.6	Confident	67 Å²	67	48.1 Å²	48.1	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-70.4	-39.1	-176.6	-66.9	-36.4	0	0	0	110.1	G455 D513	G455-D515 WeakPolarHBondContact CA-OD2 3.18Å; G455-D515 PolarHBondContact N-OD2 3.23Å; D513-D515 PolarHBondContact O-N 3.13Å; D513-D515 WeakPolarHBondContact OD1-CB 3.32Å; D513-D515 PolarHBondContact OD1-N 2.93Å
516	M	86.2	Confident	87.9	Confident	153 Å²	153	43 Å²	43	75%	0.754	23%	0.232	S	C	*	.	H	α-helix	trans	-74.9	-33.4	176.2	-68	-65.2	-61.6	0	0	113.1	D513	D513-M516 HydrophobicContact CB-CB 4.01Å; D513-M516 HydrophobicContact CB-CG 4.14Å; D513-M516 PolarHBondContact O-N 3.04Å; D513-M516 PolarHBondContact OD1-N 3.26Å; D513-M516 VanDerWaalsContact OD2-CG 3.27Å; D513-M516 WeakPolarHBondContact OD2-CG 3.44Å
517	S	88	Confident	88.7	Confident	17 Å²	17	42.6 Å²	42.6	12%	0.119	23%	0.232	C	C	.	.	H	α-helix	trans	-95.8	2.8	-177.6	-64.6	0	0	0	0	113.7	D513 P514 A519 E520 F521	D513-S517 WeakPolarHBondContact O-CB 3.41Å; D513-S517 PolarHBondContact O-N 2.81Å; D513-S517 PolarHBondContact O-OG 3.2Å; P514-S517 PolarHBondContact O-N 3.48Å; S517-A519 PolarHBondContact O-N 3.27Å; S517-A519 VanDerWaalsContact O-N 3.09Å; S517-E520 VanDerWaalsContact O-CB 3.31Å; S517-E520 WeakPolarHBondContact O-CB 3.25Å; S517-E520 PolarHBondContact O-N 3.29Å; S517-F521 WeakPolarHBondContact O-CD2 3.26Å
518	A	86.8	Confident	89	Confident	9 Å²	9	41.3 Å²	41.3	7%	0.074	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-52.4	-38.9	-172	0	0	0	0	0	114.1	P514 E520 F521 D522 Y523 F554	P514-A518 WeakPolarHBondContact O-CA 3.5Å; P514-A518 WeakPolarHBondContact O-CB 3.45Å; P514-A518 PolarHBondContact O-N 3.4Å; A518-E520 VanDerWaalsContact C-N 3.3Å; A518-E520 PolarHBondContact O-N 3.45Å; A518-F521 CarbonylContact O-C 3.58Å; A518-F521 PolarHBondContact O-N 2.99Å; A518-D522 PolarHBondContact O-N 3.31Å; A518-Y523 HydrophobicContact CB-CD1 3.81Å; A518-Y523 HydrophobicContact CB-CE1 3.67Å; A518-Y523 PolarHBondContact O-N 2.93Å; A518-F554 HydrophobicContact CB-CB 4.49Å; A518-F554 HydrophobicContact CB-CD1 3.54Å; A518-F554 HydrophobicContact CB-CE1 4.08Å; A518-F554 HydrophobicContact CB-CG 4.25Å
519	A	84.3	Confident	89.2	Confident	61 Å²	61	44.6 Å²	44.6	50%	0.504	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-64.4	-32	177.8	0	0	0	0	0	112.9	S517 F521 D522 Y523	S517-A519 PolarHBondContact O-N 3.27Å; S517-A519 VanDerWaalsContact O-N 3.09Å; A519-F521 VanDerWaalsContact C-N 3.25Å; A519-F521 PolarHBondContact O-N 3.03Å; A519-D522 PolarHBondContact O-N 3.48Å; A519-D522 VanDerWaalsContact O-N 3.1Å; A519-Y523 HydrophobicContact CB-CE2 4.3Å
520	E	84.9	Confident	89.4	Confident	99 Å²	99	40.9 Å²	40.9	46%	0.463	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-69	-26.4	176.5	-58	-175.9	-151.5	0	0	112.3	Y492 S517 A518 D522 P597	Y492-E520 WeakPolarHBondContact CE1-OE2 3.39Å; Y492-E520 PolarHBondContact OH-OE2 3.42Å; S517-E520 VanDerWaalsContact O-CB 3.31Å; S517-E520 WeakPolarHBondContact O-CB 3.25Å; S517-E520 PolarHBondContact O-N 3.29Å; A518-E520 VanDerWaalsContact C-N 3.3Å; A518-E520 PolarHBondContact O-N 3.45Å; E520-D522 VanDerWaalsContact C-N 3.32Å; E520-P597 WeakPolarHBondContact O-CG 3.17Å
521	F	86	Confident	89.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-90.1	4.5	173.2	-65.8	-91.1	0	0	0	112.8	L481 I490 Y492 L512 S517 A518 A519 Y523 L524 Y528 L552 F554	L481-F521 HydrophobicContact CB-CE1 4.14Å; L481-F521 HydrophobicContact CD2-CE1 4.13Å; L481-F521 HydrophobicContact CD2-CZ 4.1Å; I490-F521 HydrophobicContact CB-CE1 4.25Å; I490-F521 HydrophobicContact CD1-CD1 3.54Å; I490-F521 HydrophobicContact CD1-CE1 3.84Å; I490-F521 HydrophobicContact CD1-CG 4.38Å; I490-F521 HydrophobicContact CG1-CD1 4Å; I490-F521 HydrophobicContact CG1-CE1 4.11Å; Y492-F521 HydrophobicContact CE2-CE2 4.29Å; Y492-F521 AromaticContact CE2-CZ 3.9Å; Y492-F521 HydrophobicContact CE2-CZ 3.9Å; Y492-F521 VanDerWaalsContact OH-CE2 3.28Å; Y492-F521 WeakPolarHBondContact OH-CE2 3.39Å; L512-F521 HydrophobicContact CD1-CE2 4.03Å; L512-F521 HydrophobicContact CD1-CZ 4.21Å; L512-F521 HydrophobicContact CD2-CZ 4.38Å; S517-F521 WeakPolarHBondContact O-CD2 3.26Å; A518-F521 CarbonylContact O-C 3.58Å; A518-F521 PolarHBondContact O-N 2.99Å; A519-F521 VanDerWaalsContact C-N 3.25Å; A519-F521 PolarHBondContact O-N 3.03Å; F521-Y523 PolarHBondContact O-N 2.93Å; F521-Y523 VanDerWaalsContact O-N 3.11Å; F521-L524 WeakPolarHBondContact O-CB 3.09Å; F521-L524 PolarHBondContact O-N 3.38Å; F521-Y528 HydrophobicContact CD1-CD1 4.47Å; F521-Y528 AromaticContact CD1-CE1 3.75Å; F521-Y528 HydrophobicContact CD1-CE1 3.75Å; F521-Y528 AromaticContact CD1-CZ 3.84Å; F521-Y528 HydrophobicContact CE1-CD1 4.37Å; F521-Y528 HydrophobicContact CE1-CE1 4.09Å; F521-L552 HydrophobicContact CD1-CD1 4.46Å; F521-L552 HydrophobicContact CE1-CD1 4.05Å; F521-L552 HydrophobicContact CZ-CD1 4.27Å; F521-F554 HydrophobicContact CB-CD2 4.41Å; F521-F554 HydrophobicContact CB-CE1 4.42Å; F521-F554 HydrophobicContact CB-CE2 3.57Å; F521-F554 HydrophobicContact CB-CZ 3.57Å; F521-F554 HydrophobicContact CD1-CE2 4.36Å; F521-F554 HydrophobicContact CD1-CZ 4.09Å; F521-F554 HydrophobicContact CD2-CE1 4.05Å; F521-F554 HydrophobicContact CD2-CE2 4.36Å; F521-F554 AromaticContact CD2-CZ 3.5Å; F521-F554 HydrophobicContact CD2-CZ 3.5Å; F521-F554 HydrophobicContact CE2-CZ 4.19Å; F521-F554 HydrophobicContact CG-CE1 4.37Å; F521-F554 AromaticContact CG-CE2 3.87Å; F521-F554 HydrophobicContact CG-CE2 3.87Å; F521-F554 AromaticContact CG-CZ 3.45Å; F521-F554 HydrophobicContact CG-CZ 3.45Å; F521-F554 VanDerWaalsContact CG-CZ 3.45Å
522	D	85.4	Confident	89.6	Confident	22 Å²	22	36.3 Å²	36.3	12%	0.118	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	31.9	-174.5	-163.1	41.8	0	0	0	112.2	A518 A519 E520 L524 A558 G559 T562 P597	A518-D522 PolarHBondContact O-N 3.31Å; A519-D522 PolarHBondContact O-N 3.48Å; A519-D522 VanDerWaalsContact O-N 3.1Å; E520-D522 VanDerWaalsContact C-N 3.32Å; D522-L524 PolarHBondContact O-N 2.88Å; D522-L524 VanDerWaalsContact O-N 3.14Å; D522-A558 WeakPolarHBondContact O-CA 3.4Å; D522-G559 PolarHBondContact O-N 3.22Å; D522-G559 WeakPolarHBondContact OD1-CA 3.21Å; D522-G559 VanDerWaalsContact OD2-C 3.29Å; D522-G559 WeakPolarHBondContact OD2-CA 3.15Å; D522-T562 WeakPolarHBondContact CB-OG1 3.27Å; D522-T562 WeakPolarHBondContact OD2-CB 3.4Å; D522-T562 PolarHBondContact OD2-N 3.48Å; D522-T562 PolarHBondContact OD2-OG1 3.34Å; D522-P597 HydrophobicContact CB-CB 4.12Å; D522-P597 HydrophobicContact CB-CG 3.71Å
523	Y	87	Confident	89.6	Confident	90 Å²	90	37.3 Å²	37.3	35%	0.353	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	20.4	-175.8	-54.8	-92.1	0	0	0	114.7	A518 A519 F521 S525 F554 E557	A518-Y523 HydrophobicContact CB-CD1 3.81Å; A518-Y523 HydrophobicContact CB-CE1 3.67Å; A518-Y523 PolarHBondContact O-N 2.93Å; A519-Y523 HydrophobicContact CB-CE2 4.3Å; F521-Y523 PolarHBondContact O-N 2.93Å; F521-Y523 VanDerWaalsContact O-N 3.11Å; Y523-S525 PolarHBondContact O-N 2.66Å; Y523-S525 VanDerWaalsContact O-N 3.13Å; Y523-F554 HydrophobicContact CD1-CB 4.47Å; Y523-E557 WeakPolarHBondContact CB-O 3.34Å
524	L	87.6	Confident	89.6	Confident	13 Å²	13	36.2 Å²	36.2	7%	0.068	20%	0.196	C	C	.	.			trans	-76.1	102.5	-179.1	178.4	52.9	0	0	0	111.5	H483 T486 F521 D522 Y528 F554 T562	H483-L524 HydrophobicContact CB-CD2 4.22Å; H483-L524 WeakPolarHBondContact ND1-CD2 3.28Å; T486-L524 HydrophobicContact CG2-CD2 3.94Å; T486-L524 WeakPolarHBondContact OG1-CD2 3.21Å; F521-L524 WeakPolarHBondContact O-CB 3.09Å; F521-L524 PolarHBondContact O-N 3.38Å; D522-L524 PolarHBondContact O-N 2.88Å; D522-L524 VanDerWaalsContact O-N 3.14Å; L524-Y528 WeakPolarHBondContact CB-OH 3.23Å; L524-Y528 WeakPolarHBondContact O-CE2 3.2Å; L524-Y528 PolarHBondContact O-OH 3.21Å; L524-F554 WeakPolarHBondContact O-CD2 3.1Å; L524-F554 WeakPolarHBondContact O-CE2 3.45Å; L524-T562 HydrophobicContact CB-CG2 4.03Å; L524-T562 HydrophobicContact CD1-CG2 3.73Å; L524-T562 HydrophobicContact CD2-CG2 3.74Å; L524-T562 HydrophobicContact CG-CG2 4.02Å
525	S	90.1	Very high	89.5	Confident	51 Å²	51	37.5 Å²	37.5	36%	0.357	21%	0.211	S	C	.	.			trans	-78.3	147.5	173.8	-60.5	0	0	0	0	112.1	Y523 L552 F554	Y523-S525 PolarHBondContact O-N 2.66Å; Y523-S525 VanDerWaalsContact O-N 3.13Å; S525-L552 CarbonylContact C-O 3.52Å; S525-L552 WeakPolarHBondContact CA-O 3.29Å; S525-L552 WeakPolarHBondContact CB-O 3.07Å; S525-F554 PolarHBondContact OG-N 3.16Å
526	G	90.7	Very high	89.4	Confident	17 Å²	17	35.8 Å²	35.8	18%	0.175	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-165.1	176.1	0	0	0	0	0	113.1	Y528 L552	G526-Y528 VanDerWaalsContact O-CD2 3.3Å; G526-Y528 WeakPolarHBondContact O-CD2 3.39Å; G526-L552 PolarHBondContact N-O 2.99Å; G526-L552 PolarHBondContact O-N 3.25Å
527	I	93.8	Very high	89.1	Confident	44 Å²	44	32.5 Å²	32.5	23%	0.226	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.2	-178	-56.3	175.7	0	0	0	109.7	A449 H483 Q484 D549 L550 D551	A449-I527 HydrophobicContact CB-CG2 4.15Å; H483-I527 PolarHBondContact CD2-O 3.44Å; Q484-I527 HydrophobicContact CG-CG2 4.27Å; Q484-I527 PolarHBondContact N-O 3.37Å; I527-D549 HydrophobicContact CG2-CB 3.89Å; I527-L550 CarbonylContact C-O 3.59Å; I527-L550 WeakPolarHBondContact CA-O 3.34Å; I527-D551 HydrophobicContact CG1-CB 4.31Å
528	Y	93.8	Very high	88.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.5	175.7	-72.6	-98.9	0	0	0	110.2	L481 T482 H483 I490 F521 L524 G526 D549 L550 L552	L481-Y528 HydrophobicContact CB-CD1 4.04Å; T482-Y528 CarbonylContact O-C 3.59Å; T482-Y528 WeakPolarHBondContact O-CA 3.25Å; H483-Y528 HydrophobicContact CB-CD1 3.9Å; H483-Y528 HydrophobicContact CB-CE1 3.52Å; H483-Y528 AromaticContact CD2-CE2 3.78Å; H483-Y528 AromaticContact CD2-CZ 3.87Å; I490-Y528 HydrophobicContact CD1-CE1 4.17Å; F521-Y528 HydrophobicContact CD1-CD1 4.47Å; F521-Y528 AromaticContact CD1-CE1 3.75Å; F521-Y528 HydrophobicContact CD1-CE1 3.75Å; F521-Y528 AromaticContact CD1-CZ 3.84Å; F521-Y528 HydrophobicContact CE1-CD1 4.37Å; F521-Y528 HydrophobicContact CE1-CE1 4.09Å; L524-Y528 WeakPolarHBondContact CB-OH 3.23Å; L524-Y528 WeakPolarHBondContact O-CE2 3.2Å; L524-Y528 PolarHBondContact O-OH 3.21Å; G526-Y528 VanDerWaalsContact O-CD2 3.3Å; G526-Y528 WeakPolarHBondContact O-CD2 3.39Å; Y528-D549 CarbonylContact O-C 3.6Å; Y528-D549 WeakPolarHBondContact O-CA 3.4Å; Y528-L550 PolarHBondContact N-O 2.97Å; Y528-L550 PolarHBondContact O-N 3.4Å; Y528-L552 HydrophobicContact CD2-CB 4.11Å; Y528-L552 HydrophobicContact CD2-CD1 3.81Å; Y528-L552 HydrophobicContact CD2-CG 4.14Å; Y528-L552 HydrophobicContact CE2-CB 4.18Å; Y528-L552 HydrophobicContact CE2-CD1 4.11Å; Y528-L552 HydrophobicContact CG-CD1 4.26Å
529	K	95	Very high	88.8	Confident	73 Å²	73	33 Å²	33	32%	0.317	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	121.2	167.1	-169.5	-166.2	-179.9	-139.4	0	108.6	L481 T482 D531 H546	L481-K529 CarbonylContact C-O 3.56Å; L481-K529 WeakPolarHBondContact CA-O 3.4Å; T482-K529 PolarHBondContact N-O 2.57Å; T482-K529 PolarHBondContact O-N 2.99Å; K529-D531 WeakPolarHBondContact CE-OD1 3.18Å; K529-D531 WeakPolarHBondContact CE-OD2 2.96Å; K529-D531 VanDerWaalsContact NZ-CG 3.3Å; K529-D531 IonicContact NZ-OD1 3.23Å; K529-D531 PolarHBondContact NZ-OD1 3.1Å; K529-D531 IonicContact NZ-OD2 4Å; K529-D531 PolarHBondContact NZ-OD2 2Å; K529-H546 VanDerWaalsContact CE-CG 3.48Å; K529-H546 WeakPolarHBondContact CE-ND1 3.39Å; K529-H546 WeakPolarHBondContact CG-CE1 3.43Å; K529-H546 VanDerWaalsContact CG-ND1 3.3Å; K529-H546 WeakPolarHBondContact CG-ND1 3.28Å
530	V	95.6	Very high	88.8	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115.2	179	-173.8	0	0	0	0	109.6	I460 I479 Q480 L481 H546 M547 F548 L550	I460-V530 HydrophobicContact CD1-CG1 4.48Å; I479-V530 HydrophobicContact CG2-CG1 3.6Å; Q480-V530 WeakPolarHBondContact O-CA 2.98Å; L481-V530 HydrophobicContact CD2-CG2 4.3Å; L481-V530 HydrophobicContact CG-CG2 4.22Å; V530-H546 PolarHBondContact O-ND1 3.44Å; V530-M547 PolarHBondContact O-N 3.24Å; V530-F548 HydrophobicContact CB-CD2 4.19Å; V530-F548 HydrophobicContact CB-CE1 4.47Å; V530-F548 HydrophobicContact CB-CE2 4.03Å; V530-F548 HydrophobicContact CB-CZ 4.17Å; V530-F548 WeakPolarHBondContact CB-O 3.34Å; V530-F548 HydrophobicContact CG1-CE1 4.23Å; V530-F548 HydrophobicContact CG1-CE2 4.31Å; V530-F548 HydrophobicContact CG1-CZ 3.97Å; V530-F548 HydrophobicContact CG2-CD2 3.99Å; V530-F548 HydrophobicContact CG2-CE2 3.66Å; V530-F548 HydrophobicContact CG2-CZ 4.17Å; V530-F548 PolarHBondContact N-O 3.28Å; V530-L550 HydrophobicContact CG2-CB 3.83Å; V530-L550 HydrophobicContact CG2-CD2 4.48Å
531	D	95	Very high	88.9	Confident	11 Å²	11	33.8 Å²	33.8	6%	0.059	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.6	-178.5	-67.9	-28.8	0	0	0	110.6	I479 Q480 K529 L544 W545 H546	I479-D531 WeakPolarHBondContact CA-O 3.48Å; Q480-D531 PolarHBondContact N-O 2.79Å; Q480-D531 PolarHBondContact O-N 3.38Å; K529-D531 WeakPolarHBondContact CE-OD1 3.18Å; K529-D531 WeakPolarHBondContact CE-OD2 2.96Å; K529-D531 VanDerWaalsContact NZ-CG 3.3Å; K529-D531 IonicContact NZ-OD1 3.23Å; K529-D531 PolarHBondContact NZ-OD1 3.1Å; K529-D531 IonicContact NZ-OD2 4Å; K529-D531 PolarHBondContact NZ-OD2 2Å; D531-L544 HydrophobicContact CB-CD1 4.38Å; D531-W545 CarbonylContact C-O 3.59Å; D531-W545 WeakPolarHBondContact CA-O 3.43Å; D531-H546 WeakPolarHBondContact OD1-CA 3.5Å; D531-H546 WeakPolarHBondContact OD1-CB 3.34Å; D531-H546 IonicContact OD1-CG 3.31Å; D531-H546 IonicContact OD1-ND1 3.22Å; D531-H546 PolarHBondContact OD1-ND1 3.13Å; D531-H546 VanDerWaalsContact OD1-ND1 3.16Å
532	L	95.1	Very high	89	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.3	167.7	175.8	66.5	0	0	0	109.6	V414 L462 V477 I479 V534 L544 W545 M547	V414-L532 HydrophobicContact CG2-CD2 3.75Å; L462-L532 HydrophobicContact CD1-CD1 3.66Å; L462-L532 HydrophobicContact CD1-CD2 4.2Å; L462-L532 HydrophobicContact CD2-CD2 4.48Å; V477-L532 HydrophobicContact CG1-CD1 3.8Å; I479-L532 HydrophobicContact CG1-CD1 4.16Å; L532-V534 HydrophobicContact CD1-CG2 4Å; L532-V534 HydrophobicContact CD2-CG2 4.06Å; L532-V534 HydrophobicContact CG-CG2 3.9Å; L532-L544 WeakPolarHBondContact O-CA 3.37Å; L532-W545 HydrophobicContact CB-CB 4.38Å; L532-W545 HydrophobicContact CD2-CE3 3.92Å; L532-W545 PolarHBondContact N-O 3.35Å; L532-W545 PolarHBondContact O-N 3.28Å; L532-M547 HydrophobicContact CB-CG 3.99Å; L532-M547 HydrophobicContact CB-SD 3.69Å
533	I	92.3	Very high	89.3	Confident	26 Å²	26	38.6 Å²	38.6	13%	0.133	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	111.9	175.9	-49.2	176.2	0	0	0	108.6	F478 Q480 I543 L544	F478-I533 HydrophobicContact CB-CB 4.24Å; F478-I533 PolarHBondContact N-O 2.71Å; F478-I533 PolarHBondContact O-N 3.31Å; Q480-I533 HydrophobicContact CB-CD1 4.08Å; I533-I543 CarbonylContact C-O 3.52Å; I533-I543 VanDerWaalsContact CA-O 3.3Å; I533-I543 WeakPolarHBondContact CA-O 3.24Å; I533-L544 HydrophobicContact CD1-CD1 4.4Å; I533-L544 HydrophobicContact CG1-CD1 3.8Å
534	V	91.4	Very high	89.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.3	176.1	-175.2	0	0	0	0	109.4	I464 A474 V477 L532 I539 P542 I543	I464-V534 HydrophobicContact CD1-CB 4.5Å; I464-V534 HydrophobicContact CD1-CG1 3.88Å; I464-V534 HydrophobicContact CD1-CG2 3.76Å; A474-V534 HydrophobicContact CB-CG1 3.74Å; V477-V534 HydrophobicContact CG1-CG2 4.21Å; V477-V534 HydrophobicContact CG2-CG1 4.31Å; L532-V534 HydrophobicContact CD1-CG2 4Å; L532-V534 HydrophobicContact CD2-CG2 4.06Å; L532-V534 HydrophobicContact CG-CG2 3.9Å; V534-I539 HydrophobicContact CG1-CD1 3.78Å; V534-P542 VanDerWaalsContact O-CA 3.3Å; V534-P542 WeakPolarHBondContact O-CA 3.23Å; V534-P542 WeakPolarHBondContact O-CB 3.36Å; V534-I543 HydrophobicContact CB-CB 3.94Å; V534-I543 HydrophobicContact CB-CD1 4.22Å; V534-I543 HydrophobicContact CB-CG1 4.34Å; V534-I543 HydrophobicContact CG2-CB 4.12Å; V534-I543 HydrophobicContact CG2-CD1 4.24Å; V534-I543 PolarHBondContact N-O 3.46Å; V534-I543 PolarHBondContact O-N 2.84Å
535	G	85.6	Confident	89.9	Confident	33 Å²	33	40.2 Å²	40.2	34%	0.34	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.6	174.6	0	0	0	0	0	111.9	Q476	Q476-G535 PolarHBondContact O-N 2.97Å
536	D	83.8	Confident	90.1	Very high	32 Å²	32	39.7 Å²	39.7	17%	0.171	23%	0.232	C	C	.	.			trans	-150.9	151.8	171.9	-171.6	-86.8	0	0	0	109.2	A474 H475 S538 I539	A474-D536 HydrophobicContact CB-CB 4.1Å; H475-D536 WeakPolarHBondContact CA-OD2 3.26Å; H475-D536 WeakPolarHBondContact CB-OD2 3.05Å; H475-D536 PolarHBondContact N-OD2 2.94Å; D536-S538 PolarHBondContact O-N 3.18Å; D536-S538 WeakPolarHBondContact OD1-CA 3.48Å; D536-S538 WeakPolarHBondContact OD1-CB 3.37Å; D536-S538 PolarHBondContact OD1-N 3.26Å; D536-S538 PolarHBondContact OD1-OG 2.71Å; D536-I539 HydrophobicContact CB-CD1 3.73Å; D536-I539 HydrophobicContact CB-CG1 3.9Å; D536-I539 PolarHBondContact O-N 3.21Å; D536-I539 VanDerWaalsContact O-N 3.13Å
537	S	79.5	Confident	90.4	Very high	83 Å²	83	38.9 Å²	38.9	58%	0.58	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.2	175.4	47.9	0	0	0	0	114
538	S	82.5	Confident	90.5	Very high	19 Å²	19	36.8 Å²	36.8	13%	0.133	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.2	-178.8	-35.2	0	0	0	0	112.3	I409 T410 D536	I409-S538 CarbonylContact C-O 3.53Å; I409-S538 VanDerWaalsContact CA-O 3.29Å; I409-S538 WeakPolarHBondContact CA-O 3.43Å; T410-S538 PolarHBondContact N-O 3.13Å; D536-S538 PolarHBondContact O-N 3.18Å; D536-S538 WeakPolarHBondContact OD1-CA 3.48Å; D536-S538 WeakPolarHBondContact OD1-CB 3.37Å; D536-S538 PolarHBondContact OD1-N 3.26Å; D536-S538 PolarHBondContact OD1-OG 2.71Å
539	I	86.1	Confident	90.6	Very high	17 Å²	17	37.2 Å²	37.2	9%	0.087	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-101.1	125.7	-179.8	-60	171.1	0	0	0	109.2	T410 A412 A474 V534 D536 A541	T410-I539 WeakPolarHBondContact O-CA 3.37Å; A412-I539 HydrophobicContact CB-CB 4.41Å; A412-I539 HydrophobicContact CB-CD1 3.8Å; A412-I539 HydrophobicContact CB-CG1 3.85Å; A412-I539 HydrophobicContact CB-CG2 3.66Å; A474-I539 HydrophobicContact CB-CD1 4.31Å; V534-I539 HydrophobicContact CG1-CD1 3.78Å; D536-I539 HydrophobicContact CB-CD1 3.73Å; D536-I539 HydrophobicContact CB-CG1 3.9Å; D536-I539 PolarHBondContact O-N 3.21Å; D536-I539 VanDerWaalsContact O-N 3.13Å; I539-A541 WeakPolarHBondContact CG2-O 3.38Å; I539-A541 PolarHBondContact O-N 3.47Å
540	K	84.4	Confident	90.7	Very high	119 Å²	119	33.8 Å²	33.8	52%	0.517	20%	0.2	S	C	.	.	S	Bend	trans	-62.6	-40.6	-178.3	-178.5	176.7	-177.3	176.3	0	113.1	D301 I409 T410	D301-K540 IonicContact OD2-NZ 3.2Å; D301-K540 PolarHBondContact OD2-NZ 2.92Å; I409-K540 HydrophobicContact CD1-CB 4.17Å; I409-K540 HydrophobicContact CD1-CG 4.09Å; T410-K540 PolarHBondContact O-N 3.44Å
541	A	86	Confident	90.6	Very high	58 Å²	58	34.7 Å²	34.7	48%	0.479	21%	0.205	S	C	.	.	S	Bend	trans	-136.3	126.5	177.8	0	0	0	0	0	109.7	I539	I539-A541 WeakPolarHBondContact CG2-O 3.38Å; I539-A541 PolarHBondContact O-N 3.47Å
542	P	89	Confident	90.5	Very high	99 Å²	99	34.2 Å²	34.2	64%	0.643	20%	0.203	S	C	*	.			trans	-62.2	146.8	178.6	28	-34.5	0	0	0	110.5	V534	V534-P542 VanDerWaalsContact O-CA 3.3Å; V534-P542 WeakPolarHBondContact O-CA 3.23Å; V534-P542 WeakPolarHBondContact O-CB 3.36Å
543	I	91.4	Very high	90.2	Very high	24 Å²	24	39.8 Å²	39.8	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120	175.9	-57.4	168.3	0	0	0	107.4	A412 V414 I533 V534 W545	A412-I543 HydrophobicContact CB-CD1 3.98Å; V414-I543 HydrophobicContact CG2-CD1 4.37Å; I533-I543 CarbonylContact C-O 3.52Å; I533-I543 VanDerWaalsContact CA-O 3.3Å; I533-I543 WeakPolarHBondContact CA-O 3.24Å; V534-I543 HydrophobicContact CB-CB 3.94Å; V534-I543 HydrophobicContact CB-CD1 4.22Å; V534-I543 HydrophobicContact CB-CG1 4.34Å; V534-I543 HydrophobicContact CG2-CB 4.12Å; V534-I543 HydrophobicContact CG2-CD1 4.24Å; V534-I543 PolarHBondContact N-O 3.46Å; V534-I543 PolarHBondContact O-N 2.84Å; I543-W545 HydrophobicContact CG2-CB 4.09Å
544	L	92.1	Very high	89.9	Confident	123 Å²	123	39.2 Å²	39.2	64%	0.644	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	102.6	165.4	178	64.8	0	0	0	107.4	D531 L532 I533	D531-L544 HydrophobicContact CB-CD1 4.38Å; L532-L544 WeakPolarHBondContact O-CA 3.37Å; I533-L544 HydrophobicContact CD1-CD1 4.4Å; I533-L544 HydrophobicContact CG1-CD1 3.8Å
545	W	94.7	Very high	89.4	Confident	14 Å²	14	44.3 Å²	44.3	5%	0.053	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117.7	-175.5	172.6	31.9	0	0	0	111	V414 A417 L435 T436 K439 L462 D531 L532 I543 M547	V414-W545 HydrophobicContact CB-CZ3 4.36Å; V414-W545 HydrophobicContact CG1-CZ3 4.03Å; V414-W545 HydrophobicContact CG2-CE3 4.11Å; V414-W545 HydrophobicContact CG2-CZ3 4.29Å; A417-W545 HydrophobicContact CB-CH2 3.72Å; A417-W545 HydrophobicContact CB-CZ3 3.78Å; L435-W545 HydrophobicContact CB-CH2 3.81Å; L435-W545 HydrophobicContact CB-CZ2 4.19Å; L435-W545 HydrophobicContact CD1-CH2 4.17Å; T436-W545 VanDerWaalsContact O-CZ2 3.28Å; T436-W545 WeakPolarHBondContact O-CZ2 3.35Å; K439-W545 WeakPolarHBondContact O-CZ2 3.26Å; K439-W545 PolarHBondContact O-NE1 3.44Å; L462-W545 HydrophobicContact CD2-CZ3 4.41Å; D531-W545 CarbonylContact C-O 3.59Å; D531-W545 WeakPolarHBondContact CA-O 3.43Å; L532-W545 HydrophobicContact CB-CB 4.38Å; L532-W545 HydrophobicContact CD2-CE3 3.92Å; L532-W545 PolarHBondContact N-O 3.35Å; L532-W545 PolarHBondContact O-N 3.28Å; I543-W545 HydrophobicContact CG2-CB 4.09Å; W545-M547 HydrophobicContact CD2-CG 3.8Å; W545-M547 HydrophobicContact CE3-CG 3.76Å; W545-M547 HydrophobicContact CG-CG 4.31Å; W545-M547 HydrophobicContact CH2-CE 4.41Å; W545-M547 HydrophobicContact CH2-CG 4.37Å; W545-M547 HydrophobicContact CZ2-CG 4.39Å; W545-M547 HydrophobicContact CZ3-CE 4.11Å; W545-M547 HydrophobicContact CZ3-CG 4.05Å; W545-M547 PolarHBondContact O-N 2.84Å; W545-M547 VanDerWaalsContact O-N 3.14Å
546	H	95	Very high	89.1	Confident	40 Å²	40	45.2 Å²	45.2	19%	0.185	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	100.4	167.6	178.4	40.8	0	0	0	110.7	T440 K529 V530 D531 F548 D549	T440-H546 WeakPolarHBondContact CA-O 3.3Å; T440-H546 WeakPolarHBondContact CG2-CD2 3.39Å; T440-H546 WeakPolarHBondContact CG2-NE2 3.44Å; T440-H546 PolarHBondContact OG1-CD2 3.36Å; T440-H546 PolarHBondContact OG1-O 2.92Å; K529-H546 VanDerWaalsContact CE-CG 3.48Å; K529-H546 WeakPolarHBondContact CE-ND1 3.39Å; K529-H546 WeakPolarHBondContact CG-CE1 3.43Å; K529-H546 VanDerWaalsContact CG-ND1 3.3Å; K529-H546 WeakPolarHBondContact CG-ND1 3.28Å; V530-H546 PolarHBondContact O-ND1 3.44Å; D531-H546 WeakPolarHBondContact OD1-CA 3.5Å; D531-H546 WeakPolarHBondContact OD1-CB 3.34Å; D531-H546 IonicContact OD1-CG 3.31Å; D531-H546 IonicContact OD1-ND1 3.22Å; D531-H546 PolarHBondContact OD1-ND1 3.13Å; D531-H546 VanDerWaalsContact OD1-ND1 3.16Å; H546-F548 PolarHBondContact CE1-O 2.55Å; H546-F548 VanDerWaalsContact CE1-O 3.24Å; H546-D549 IonicContact CE1-OD1 3.63Å; H546-D549 PolarHBondContact CE1-OD1 2.92Å; H546-D549 VanDerWaalsContact CE1-OD1 3.3Å; H546-D549 IonicContact NE2-OD1 2.85Å; H546-D549 IonicContact NE2-OD2 3.63Å
547	M	95.7	Very high	88.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	-54.4	-171.2	-60.2	178.4	66.5	0	0	111.4	L435 T440 Y441 I460 L462 V530 L532 W545	L435-M547 HydrophobicContact CD1-CB 4.24Å; L435-M547 HydrophobicContact CD1-CE 3.34Å; T440-M547 WeakPolarHBondContact CA-O 3.38Å; Y441-M547 PolarHBondContact N-O 2.85Å; I460-M547 HydrophobicContact CG2-CE 3.76Å; L462-M547 HydrophobicContact CD2-CE 3.83Å; V530-M547 PolarHBondContact O-N 3.24Å; L532-M547 HydrophobicContact CB-CG 3.99Å; L532-M547 HydrophobicContact CB-SD 3.69Å; W545-M547 HydrophobicContact CD2-CG 3.8Å; W545-M547 HydrophobicContact CE3-CG 3.76Å; W545-M547 HydrophobicContact CG-CG 4.31Å; W545-M547 HydrophobicContact CH2-CE 4.41Å; W545-M547 HydrophobicContact CH2-CG 4.37Å; W545-M547 HydrophobicContact CZ2-CG 4.39Å; W545-M547 HydrophobicContact CZ3-CE 4.11Å; W545-M547 HydrophobicContact CZ3-CG 4.05Å; W545-M547 PolarHBondContact O-N 2.84Å; W545-M547 VanDerWaalsContact O-N 3.14Å
548	F	96.6	Very high	88.4	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	171	-177.6	55.3	-90.1	0	0	0	111.1	V419 L435 Y441 I450 I458 I460 V530 H546 L550	V419-F548 HydrophobicContact CG2-CD1 4.23Å; V419-F548 HydrophobicContact CG2-CE1 3.55Å; V419-F548 HydrophobicContact CG2-CZ 4.05Å; L435-F548 HydrophobicContact CD1-CD1 3.92Å; L435-F548 HydrophobicContact CD1-CE1 4.11Å; L435-F548 HydrophobicContact CD2-CD1 4.32Å; Y441-F548 HydrophobicContact CD1-CB 4.39Å; I450-F548 HydrophobicContact CD1-CB 4.26Å; I450-F548 HydrophobicContact CD1-CD2 3.7Å; I450-F548 HydrophobicContact CD1-CE2 4.11Å; I450-F548 HydrophobicContact CD1-CG 3.92Å; I450-F548 HydrophobicContact CG1-CD2 4.39Å; I458-F548 HydrophobicContact CD1-CE2 4.03Å; I458-F548 HydrophobicContact CD1-CZ 3.92Å; I460-F548 HydrophobicContact CD1-CE1 4.28Å; I460-F548 HydrophobicContact CD1-CZ 3.9Å; I460-F548 HydrophobicContact CG1-CZ 4.45Å; V530-F548 HydrophobicContact CB-CD2 4.19Å; V530-F548 HydrophobicContact CB-CE1 4.47Å; V530-F548 HydrophobicContact CB-CE2 4.03Å; V530-F548 HydrophobicContact CB-CZ 4.17Å; V530-F548 WeakPolarHBondContact CB-O 3.34Å; V530-F548 HydrophobicContact CG1-CE1 4.23Å; V530-F548 HydrophobicContact CG1-CE2 4.31Å; V530-F548 HydrophobicContact CG1-CZ 3.97Å; V530-F548 HydrophobicContact CG2-CD2 3.99Å; V530-F548 HydrophobicContact CG2-CE2 3.66Å; V530-F548 HydrophobicContact CG2-CZ 4.17Å; V530-F548 PolarHBondContact N-O 3.28Å; H546-F548 PolarHBondContact CE1-O 2.55Å; H546-F548 VanDerWaalsContact CE1-O 3.24Å; F548-L550 HydrophobicContact CD2-CB 4.25Å; F548-L550 HydrophobicContact CE2-CB 4.02Å; F548-L550 HydrophobicContact CE2-CD1 4.24Å
549	D	96.6	Very high	88.2	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.043	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	138.5	167.5	-64.7	-51.3	0	0	0	109.5	K442 A449 I450 Q484 I527 Y528 H546	K442-D549 IonicContact NZ-OD2 2.72Å; K442-D549 PolarHBondContact NZ-OD2 3.3Å; A449-D549 CarbonylContact C-O 3.05Å; A449-D549 VanDerWaalsContact CA-O 3.28Å; A449-D549 WeakPolarHBondContact CA-O 3.41Å; A449-D549 HydrophobicContact CB-CB 3.81Å; A449-D549 WeakPolarHBondContact CB-O 3.45Å; I450-D549 PolarHBondContact N-O 3.4Å; Q484-D549 PolarHBondContact NE2-OD1 3.03Å; I527-D549 HydrophobicContact CG2-CB 3.89Å; Y528-D549 CarbonylContact O-C 3.6Å; Y528-D549 WeakPolarHBondContact O-CA 3.4Å; H546-D549 IonicContact CE1-OD1 3.63Å; H546-D549 PolarHBondContact CE1-OD1 2.92Å; H546-D549 VanDerWaalsContact CE1-OD1 3.3Å; H546-D549 IonicContact NE2-OD1 2.85Å; H546-D549 IonicContact NE2-OD2 3.63Å
550	L	95.4	Very high	87.6	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.2	-177.6	-173.7	65.4	0	0	0	109.8	I450 L452 I458 L481 I527 Y528 V530 F548 L552	I450-L550 HydrophobicContact CB-CD1 4.08Å; I450-L550 HydrophobicContact CG2-CD1 4.09Å; I450-L550 CarbonylContact O-C 3.54Å; I450-L550 WeakPolarHBondContact O-CA 3.33Å; L452-L550 HydrophobicContact CB-CD1 4.22Å; I458-L550 HydrophobicContact CD1-CD1 3.96Å; I458-L550 HydrophobicContact CD1-CD2 4.32Å; L481-L550 HydrophobicContact CD2-CD2 4.14Å; I527-L550 CarbonylContact C-O 3.59Å; I527-L550 WeakPolarHBondContact CA-O 3.34Å; Y528-L550 PolarHBondContact N-O 2.97Å; Y528-L550 PolarHBondContact O-N 3.4Å; V530-L550 HydrophobicContact CG2-CB 3.83Å; V530-L550 HydrophobicContact CG2-CD2 4.48Å; F548-L550 HydrophobicContact CD2-CB 4.25Å; F548-L550 HydrophobicContact CE2-CB 4.02Å; F548-L550 HydrophobicContact CE2-CD1 4.24Å; L550-L552 HydrophobicContact CD2-CD1 4.22Å; L550-L552 HydrophobicContact CD2-CD2 3.64Å; L550-L552 HydrophobicContact CD2-CG 3.92Å; L550-L552 HydrophobicContact CG-CD2 3.87Å; L550-L552 HydrophobicContact CG-CG 3.98Å
551	D	94.9	Very high	86.9	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.112	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	105.3	173.6	-176.7	21.9	0	0	0	109.2	A449 I450 L452 I527 R553	A449-D551 HydrophobicContact CB-CB 4.26Å; I450-D551 PolarHBondContact O-N 2.69Å; L452-D551 PolarHBondContact N-O 2.93Å; L452-D551 VanDerWaalsContact N-O 3.15Å; I527-D551 HydrophobicContact CG1-CB 4.31Å; D551-R553 IonicContact OD2-CZ 3.3Å; D551-R553 IonicContact OD2-NH2 2.82Å; D551-R553 PolarHBondContact OD2-NH2 3.35Å
552	L	91.8	Very high	86.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.6	-178.9	-68.9	177.5	0	0	0	110.7	L452 L481 P514 F521 S525 G526 Y528 L550 F554	L452-L552 HydrophobicContact CB-CD2 4.28Å; L452-L552 HydrophobicContact CD2-CD2 3.82Å; L481-L552 HydrophobicContact CD2-CD1 4.24Å; P514-L552 HydrophobicContact CB-CD2 4.28Å; P514-L552 HydrophobicContact CG-CD2 3.89Å; F521-L552 HydrophobicContact CD1-CD1 4.46Å; F521-L552 HydrophobicContact CE1-CD1 4.05Å; F521-L552 HydrophobicContact CZ-CD1 4.27Å; S525-L552 CarbonylContact C-O 3.52Å; S525-L552 WeakPolarHBondContact CA-O 3.29Å; S525-L552 WeakPolarHBondContact CB-O 3.07Å; G526-L552 PolarHBondContact N-O 2.99Å; G526-L552 PolarHBondContact O-N 3.25Å; Y528-L552 HydrophobicContact CD2-CB 4.11Å; Y528-L552 HydrophobicContact CD2-CD1 3.81Å; Y528-L552 HydrophobicContact CD2-CG 4.14Å; Y528-L552 HydrophobicContact CE2-CB 4.18Å; Y528-L552 HydrophobicContact CE2-CD1 4.11Å; Y528-L552 HydrophobicContact CG-CD1 4.26Å; L550-L552 HydrophobicContact CD2-CD1 4.22Å; L550-L552 HydrophobicContact CD2-CD2 3.64Å; L550-L552 HydrophobicContact CD2-CG 3.92Å; L550-L552 HydrophobicContact CG-CD2 3.87Å; L550-L552 HydrophobicContact CG-CG 3.98Å; L552-F554 HydrophobicContact CB-CE2 4.05Å; L552-F554 HydrophobicContact CB-CZ 4.15Å; L552-F554 HydrophobicContact CD1-CE2 4.39Å; L552-F554 HydrophobicContact CD1-CZ 3.95Å
553	R	88.9	Confident	85.8	Confident	118 Å²	118	46.1 Å²	46.1	45%	0.445	25%	0.247	S	C	.	.			trans	-124.3	117.2	174.4	-63.4	-168.6	178	105.4	15.5	110.2	D551	D551-R553 IonicContact OD2-CZ 3.3Å; D551-R553 IonicContact OD2-NH2 2.82Å; D551-R553 PolarHBondContact OD2-NH2 3.35Å
554	F	87.6	Confident	84.9	Confident	14 Å²	14	51.9 Å²	51.9	6%	0.061	27%	0.267	C	S	.	.			trans	-103.1	144.9	175.7	-57.7	-71.4	0	0	0	110.4	P514 A518 F521 Y523 L524 S525 L552	P514-F554 HydrophobicContact CB-CD1 4.24Å; P514-F554 HydrophobicContact CB-CE1 3.66Å; P514-F554 HydrophobicContact CB-CZ 4.47Å; P514-F554 WeakPolarHBondContact O-CD1 3.47Å; P514-F554 WeakPolarHBondContact O-CE1 3.48Å; A518-F554 HydrophobicContact CB-CB 4.49Å; A518-F554 HydrophobicContact CB-CD1 3.54Å; A518-F554 HydrophobicContact CB-CE1 4.08Å; A518-F554 HydrophobicContact CB-CG 4.25Å; F521-F554 HydrophobicContact CB-CD2 4.41Å; F521-F554 HydrophobicContact CB-CE1 4.42Å; F521-F554 HydrophobicContact CB-CE2 3.57Å; F521-F554 HydrophobicContact CB-CZ 3.57Å; F521-F554 HydrophobicContact CD1-CE2 4.36Å; F521-F554 HydrophobicContact CD1-CZ 4.09Å; F521-F554 HydrophobicContact CD2-CE1 4.05Å; F521-F554 HydrophobicContact CD2-CE2 4.36Å; F521-F554 AromaticContact CD2-CZ 3.5Å; F521-F554 HydrophobicContact CD2-CZ 3.5Å; F521-F554 HydrophobicContact CE2-CZ 4.19Å; F521-F554 HydrophobicContact CG-CE1 4.37Å; F521-F554 AromaticContact CG-CE2 3.87Å; F521-F554 HydrophobicContact CG-CE2 3.87Å; F521-F554 AromaticContact CG-CZ 3.45Å; F521-F554 HydrophobicContact CG-CZ 3.45Å; F521-F554 VanDerWaalsContact CG-CZ 3.45Å; Y523-F554 HydrophobicContact CD1-CB 4.47Å; L524-F554 WeakPolarHBondContact O-CD2 3.1Å; L524-F554 WeakPolarHBondContact O-CE2 3.45Å; S525-F554 PolarHBondContact OG-N 3.16Å; L552-F554 HydrophobicContact CB-CE2 4.05Å; L552-F554 HydrophobicContact CB-CZ 4.15Å; L552-F554 HydrophobicContact CD1-CE2 4.39Å; L552-F554 HydrophobicContact CD1-CZ 3.95Å
555	V	80.9	Confident	83.9	Confident	107 Å²	107	48.2 Å²	48.2	65%	0.648	25%	0.245	S	C	*	.	S	Bend	trans	-86.4	112	169.9	-176.4	0	0	0	0	108.3	I454	I454-V555 HydrophobicContact CD1-CG2 3.95Å; I454-V555 HydrophobicContact CG2-CG2 4.33Å
556	G	77.9	Confident	82.8	Confident	52 Å²	52	51.3 Å²	51.3	54%	0.536	26%	0.262	S	S	.	.	S	Bend	trans	147	166.2	-179.7	0	0	0	0	0	112.5
557	E	75.9	Confident	81.7	Confident	151 Å²	151	52.2 Å²	52.2	71%	0.706	28%	0.276	S	S	*	.			trans	-81.4	142.3	168.1	-75.8	-166.4	-176.5	0	0	110.6	Y523 G559 K563	Y523-E557 WeakPolarHBondContact CB-O 3.34Å; E557-G559 PolarHBondContact O-N 3.44Å; E557-K563 IonicContact OE2-NZ 3.6Å; E557-K563 PolarHBondContact OE2-NZ 3.28Å
558	A	74	Confident	80.3	Confident	27 Å²	27	55.8 Å²	55.8	22%	0.223	29%	0.293	C	S	.	.			trans	-54.4	134.2	170.8	0	0	0	0	0	110.5	D522 T562 K563	D522-A558 WeakPolarHBondContact O-CA 3.4Å; A558-T562 HydrophobicContact CB-CG2 3.86Å; A558-K563 WeakPolarHBondContact O-CD 3.29Å; A558-K563 WeakPolarHBondContact O-CE 3.17Å; A558-K563 PolarHBondContact O-NZ 3.49Å
559	G	77.1	Confident	78.7	Confident	16 Å²	16	58.4 Å²	58.4	17%	0.165	32%	0.315	C	S	.	.			trans	-74.6	178.3	-178.4	0	0	0	0	0	113.9	D522 E557 E561 T562 K563	D522-G559 PolarHBondContact O-N 3.22Å; D522-G559 WeakPolarHBondContact OD1-CA 3.21Å; D522-G559 VanDerWaalsContact OD2-C 3.29Å; D522-G559 WeakPolarHBondContact OD2-CA 3.15Å; E557-G559 PolarHBondContact O-N 3.44Å; G559-E561 VanDerWaalsContact C-N 3.32Å; G559-E561 PolarHBondContact O-N 2.94Å; G559-T562 PolarHBondContact O-N 2.92Å; G559-K563 WeakPolarHBondContact O-CG 3.41Å; G559-K563 PolarHBondContact O-N 3.42Å
560	D	75	Confident	77.2	Confident	132 Å²	132	63 Å²	63	71%	0.706	34%	0.344	S	S	*	.	H	α-helix	trans	-65.7	-32.5	-166.4	-71	-23.9	0	0	0	113.1	K563 R564	D560-K563 PolarHBondContact O-N 2.92Å; D560-R564 WeakPolarHBondContact O-CB 3.42Å; D560-R564 PolarHBondContact O-N 3.11Å
561	E	69.3	Low	75.6	Confident	28 Å²	28	66.1 Å²	66.1	13%	0.131	36%	0.36	C	S	.	.	H	α-helix	trans	-70.3	-42.3	178.7	-177.6	161.1	167.5	0	0	111.3	G559 R564 R565 T598	G559-E561 VanDerWaalsContact C-N 3.32Å; G559-E561 PolarHBondContact O-N 2.94Å; E561-R564 WeakPolarHBondContact O-CB 3.41Å; E561-R564 PolarHBondContact O-N 3.41Å; E561-R565 WeakPolarHBondContact O-CG 3.39Å; E561-R565 PolarHBondContact O-N 3.3Å; E561-R565 IonicContact OE1-CZ 3.16Å; E561-R565 IonicContact OE1-NE 3.3Å; E561-R565 PolarHBondContact OE1-NE 3.15Å; E561-R565 IonicContact OE1-NH2 3.47Å; E561-R565 PolarHBondContact OE1-NH2 3.05Å; E561-T598 PolarHBondContact OE1-OG1 2.93Å; E561-T598 WeakPolarHBondContact OE2-CA 3.32Å; E561-T598 PolarHBondContact OE2-N 3.32Å; E561-T598 PolarHBondContact OE2-OG1 3.44Å
562	T	75.6	Confident	73.8	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-46.2	173.4	-64	0	0	0	0	111.4	Q488 D522 L524 A558 G559 R564 R565 I566	Q488-T562 PolarHBondContact NE2-OG1 2.94Å; Q488-T562 PolarHBondContact OE1-OG1 3.46Å; D522-T562 WeakPolarHBondContact CB-OG1 3.27Å; D522-T562 WeakPolarHBondContact OD2-CB 3.4Å; D522-T562 PolarHBondContact OD2-N 3.48Å; D522-T562 PolarHBondContact OD2-OG1 3.34Å; L524-T562 HydrophobicContact CB-CG2 4.03Å; L524-T562 HydrophobicContact CD1-CG2 3.73Å; L524-T562 HydrophobicContact CD2-CG2 3.74Å; L524-T562 HydrophobicContact CG-CG2 4.02Å; A558-T562 HydrophobicContact CB-CG2 3.86Å; G559-T562 PolarHBondContact O-N 2.92Å; T562-R564 VanDerWaalsContact C-N 3.29Å; T562-R564 PolarHBondContact O-N 3.21Å; T562-R565 PolarHBondContact O-N 3.5Å; T562-I566 HydrophobicContact CG2-CD1 3.71Å; T562-I566 HydrophobicContact CG2-CG1 4.28Å; T562-I566 WeakPolarHBondContact O-CB 3.5Å; T562-I566 VanDerWaalsContact O-CG1 3.3Å; T562-I566 WeakPolarHBondContact O-CG1 3.28Å; T562-I566 PolarHBondContact O-N 3.38Å
563	K	76.4	Confident	72.2	Confident	91 Å²	91	74.6 Å²	74.6	40%	0.396	41%	0.411	S	S	.	.	H	α-helix	trans	-55.1	-45.8	173.4	-74.9	169.2	170.9	162.1	0	111.1	E557 A558 G559 D560 R565 A567	E557-K563 IonicContact OE2-NZ 3.6Å; E557-K563 PolarHBondContact OE2-NZ 3.28Å; A558-K563 WeakPolarHBondContact O-CD 3.29Å; A558-K563 WeakPolarHBondContact O-CE 3.17Å; A558-K563 PolarHBondContact O-NZ 3.49Å; G559-K563 WeakPolarHBondContact O-CG 3.41Å; G559-K563 PolarHBondContact O-N 3.42Å; D560-K563 PolarHBondContact O-N 2.92Å; K563-R565 PolarHBondContact O-N 2.93Å; K563-A567 WeakPolarHBondContact O-CB 3.24Å; K563-A567 PolarHBondContact O-N 3.38Å
564	R	72.5	Confident	70.2	Confident	146 Å²	146	74.3 Å²	74.3	55%	0.551	41%	0.41	S	S	*	.	H	α-helix	trans	-62	-43.1	177.4	-165.3	-176.3	85.7	158.3	0.5	112.4	D560 E561 T562 A567 Q568	D560-R564 WeakPolarHBondContact O-CB 3.42Å; D560-R564 PolarHBondContact O-N 3.11Å; E561-R564 WeakPolarHBondContact O-CB 3.41Å; E561-R564 PolarHBondContact O-N 3.41Å; T562-R564 VanDerWaalsContact C-N 3.29Å; T562-R564 PolarHBondContact O-N 3.21Å; R564-A567 PolarHBondContact O-N 2.92Å; R564-Q568 WeakPolarHBondContact O-CB 3.37Å; R564-Q568 VanDerWaalsContact O-CG 3.24Å; R564-Q568 WeakPolarHBondContact O-CG 3.35Å; R564-Q568 PolarHBondContact O-N 2.86Å
565	R	69.5	Low	68.5	Low	45 Å²	45	80.7 Å²	80.7	17%	0.17	44%	0.44	C	S	.	.	H	α-helix	trans	-72.9	-39.2	-179	-73.5	-173.1	-170.5	-128	8.3	112.9	E561 T562 K563 A567 Q568 A569 S595 G596	E561-R565 WeakPolarHBondContact O-CG 3.39Å; E561-R565 PolarHBondContact O-N 3.3Å; E561-R565 IonicContact OE1-CZ 3.16Å; E561-R565 IonicContact OE1-NE 3.3Å; E561-R565 PolarHBondContact OE1-NE 3.15Å; E561-R565 IonicContact OE1-NH2 3.47Å; E561-R565 PolarHBondContact OE1-NH2 3.05Å; T562-R565 PolarHBondContact O-N 3.5Å; K563-R565 PolarHBondContact O-N 2.93Å; R565-A567 VanDerWaalsContact C-N 3.31Å; R565-Q568 PolarHBondContact O-N 3.02Å; R565-A569 WeakPolarHBondContact O-CB 3.48Å; R565-A569 PolarHBondContact O-N 2.89Å; R565-S595 PolarHBondContact NH1-O 2.91Å; R565-S595 PolarHBondContact NH1-OG 2.64Å; R565-S595 PolarHBondContact NH2-O 2.97Å; R565-G596 PolarHBondContact NH2-O 3.35Å
566	I	71.7	Confident	67	Low	79 Å²	79	83 Å²	83	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-57.6	-50.7	171.8	-68.9	170.1	0	0	0	108.5	T486 T562 Q568 A569 T570	T486-I566 HydrophobicContact CG2-CD1 4.47Å; T486-I566 HydrophobicContact CG2-CG1 3.76Å; T562-I566 HydrophobicContact CG2-CD1 3.71Å; T562-I566 HydrophobicContact CG2-CG1 4.28Å; T562-I566 WeakPolarHBondContact O-CB 3.5Å; T562-I566 VanDerWaalsContact O-CG1 3.3Å; T562-I566 WeakPolarHBondContact O-CG1 3.28Å; T562-I566 PolarHBondContact O-N 3.38Å; I566-Q568 VanDerWaalsContact C-N 3.3Å; I566-Q568 PolarHBondContact O-N 3.43Å; I566-A569 PolarHBondContact O-N 3.31Å; I566-T570 PolarHBondContact O-N 2.94Å; I566-T570 PolarHBondContact O-OG1 3.24Å
567	A	72.4	Confident	65.7	Low	59 Å²	59	83.1 Å²	83.1	49%	0.488	44%	0.436	S	S	.	.	H	α-helix	trans	-58.6	-38.7	176.8	0	0	0	0	0	113.2	K563 R564 R565 D571	K563-A567 WeakPolarHBondContact O-CB 3.24Å; K563-A567 PolarHBondContact O-N 3.38Å; R564-A567 PolarHBondContact O-N 2.92Å; R565-A567 VanDerWaalsContact C-N 3.31Å; A567-D571 PolarHBondContact O-N 2.98Å
568	Q	66.2	Low	64.5	Low	75 Å²	75	82 Å²	82	35%	0.35	45%	0.445	S	S	.	.	H	α-helix	trans	-67.9	-32.8	175.1	-76	173.3	-1.6	0	0	113.3	R564 R565 I566	R564-Q568 WeakPolarHBondContact O-CB 3.37Å; R564-Q568 VanDerWaalsContact O-CG 3.24Å; R564-Q568 WeakPolarHBondContact O-CG 3.35Å; R564-Q568 PolarHBondContact O-N 2.86Å; R565-Q568 PolarHBondContact O-N 3.02Å; I566-Q568 VanDerWaalsContact C-N 3.3Å; I566-Q568 PolarHBondContact O-N 3.43Å
569	A	63.4	Low	63.8	Low	57 Å²	57	83.4 Å²	83.4	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-75.9	-32.3	178.8	0	0	0	0	0	112.4	R565 I566	R565-A569 WeakPolarHBondContact O-CB 3.48Å; R565-A569 PolarHBondContact O-N 2.89Å; I566-A569 PolarHBondContact O-N 3.31Å
570	T	65.3	Low	62.6	Low	105 Å²	105	87.3 Å²	87.3	64%	0.644	48%	0.476	S	S	*	.	H	α-helix	trans	-81.7	-14.3	174.7	10.5	0	0	0	0	114.3	I566 I572	I566-T570 PolarHBondContact O-N 2.94Å; I566-T570 PolarHBondContact O-OG1 3.24Å; T570-I572 PolarHBondContact O-N 3.19Å
571	D	62.1	Low	61.6	Low	65 Å²	65	83.6 Å²	83.6	35%	0.348	46%	0.463	S	S	.	.			trans	-70.7	89.9	178.1	-175.1	4.6	0	0	0	111.3	A567 S573 R574	A567-D571 PolarHBondContact O-N 2.98Å; D571-S573 PolarHBondContact O-N 3.33Å; D571-S573 VanDerWaalsContact O-N 3.14Å; D571-S573 WeakPolarHBondContact OD1-CB 3.43Å; D571-S573 PolarHBondContact OD1-N 3.08Å; D571-S573 PolarHBondContact OD1-OG 2.91Å; D571-S573 PolarHBondContact OD2-OG 3.42Å; D571-R574 PolarHBondContact O-N 3.07Å; D571-R574 VanDerWaalsContact O-N 3.11Å
572	I	56.8	Low	60.7	Low	113 Å²	113	82.8 Å²	82.8	58%	0.579	46%	0.462	S	S	*	.	H	α-helix	trans	-53.1	-33.7	179.4	-60.6	167.5	0	0	0	111.3	T570 R574 Q575 E576	T570-I572 PolarHBondContact O-N 3.19Å; I572-R574 PolarHBondContact O-N 3.34Å; I572-R574 VanDerWaalsContact O-N 3.14Å; I572-Q575 PolarHBondContact O-N 2.59Å; I572-E576 PolarHBondContact O-N 3.46Å
573	S	57.6	Low	59.5	Low	86 Å²	86	86.8 Å²	86.8	60%	0.601	49%	0.49	S	S	*	.	H	α-helix	trans	-62.5	-24.9	-177.3	76.8	0	0	0	0	113.3	D571	D571-S573 PolarHBondContact O-N 3.33Å; D571-S573 VanDerWaalsContact O-N 3.14Å; D571-S573 WeakPolarHBondContact OD1-CB 3.43Å; D571-S573 PolarHBondContact OD1-N 3.08Å; D571-S573 PolarHBondContact OD1-OG 2.91Å; D571-S573 PolarHBondContact OD2-OG 3.42Å
574	R	47.7	Very low	58.2	Low	113 Å²	113	92.9 Å²	92.9	43%	0.426	51%	0.511	S	S	.	.	H	α-helix	trans	-84.7	-27	174.7	-72.1	-178.9	78.3	134.2	-5	113.3	D571 I572 S577	D571-R574 PolarHBondContact O-N 3.07Å; D571-R574 VanDerWaalsContact O-N 3.11Å; I572-R574 PolarHBondContact O-N 3.34Å; I572-R574 VanDerWaalsContact O-N 3.14Å; R574-S577 PolarHBondContact O-OG 2.9Å
575	Q	51.2	Low	57	Low	147 Å²	147	94 Å²	94	69%	0.687	52%	0.515	S	S	*	.	H	α-helix	trans	-72.3	-33.5	-180	-68.1	-165.3	-24.1	0	0	112.4	I572	I572-Q575 PolarHBondContact O-N 2.59Å
576	E	50.7	Low	56	Low	157 Å²	157	94.6 Å²	94.6	73%	0.734	53%	0.529	S	S	*	.	S	Bend	trans	-88.3	-1	-175	-65.2	-164.7	161.8	0	0	115	I572 S578	I572-E576 PolarHBondContact O-N 3.46Å; E576-S578 PolarHBondContact O-N 2.92Å
577	S	50.3	Low	54.9	Low	54 Å²	54	99.4 Å²	99.4	38%	0.378	55%	0.547	S	S	.	.			trans	-75	94.6	178.9	73.2	0	0	0	0	111.5	R574 S579 G582	R574-S577 PolarHBondContact O-OG 2.9Å; S577-S579 PolarHBondContact O-N 2.74Å; S577-G582 VanDerWaalsContact OG-CA 3.28Å; S577-G582 WeakPolarHBondContact OG-CA 3.34Å
578	S	50.1	Low	53.7	Low	128 Å²	128	102.6 Å²	102.6	90%	0.895	56%	0.561	S	S	*	*			trans	-67.5	12.7	173.4	45.4	0	0	0	0	114.5	E576	E576-S578 PolarHBondContact O-N 2.92Å
579	S	59.2	Low	52.9	Low	55 Å²	55	101.7 Å²	101.7	39%	0.385	56%	0.562	S	S	.	*	S	Bend	trans	-78.2	141.3	175.2	166.1	0	0	0	0	111.1	S577 A581 G582 S583	S577-S579 PolarHBondContact O-N 2.74Å; S579-A581 PolarHBondContact O-N 3.43Å; S579-A581 VanDerWaalsContact O-N 3.12Å; S579-A581 WeakPolarHBondContact OG-CB 3.31Å; S579-A581 PolarHBondContact OG-N 2.84Å; S579-G582 VanDerWaalsContact O-CA 3.31Å; S579-G582 WeakPolarHBondContact O-CA 3.3Å; S579-G582 PolarHBondContact O-N 2.93Å; S579-S583 PolarHBondContact O-N 3.42Å
580	P	51.9	Low	52.3	Low	99 Å²	99	103.5 Å²	103.5	64%	0.643	56%	0.563	S	S	*	*	H	α-helix	trans	-54.2	-29.5	168	-23.5	32	0	0	0	113.2	R584	P580-R584 PolarHBondContact O-N 3.18Å
581	A	53	Low	51.6	Low	54 Å²	54	102.3 Å²	102.3	45%	0.446	57%	0.565	S	S	.	*	H	α-helix	trans	-72.9	-33.7	174.2	0	0	0	0	0	112	S579 R585	S579-A581 PolarHBondContact O-N 3.43Å; S579-A581 VanDerWaalsContact O-N 3.12Å; S579-A581 WeakPolarHBondContact OG-CB 3.31Å; S579-A581 PolarHBondContact OG-N 2.84Å; A581-R585 WeakPolarHBondContact O-CB 3.39Å; A581-R585 VanDerWaalsContact O-CG 3.3Å; A581-R585 WeakPolarHBondContact O-CG 3.42Å; A581-R585 PolarHBondContact O-N 3.37Å; A581-R585 VanDerWaalsContact O-N 3.07Å
582	G	51.9	Low	51	Low	10 Å²	10	104.9 Å²	104.9	10%	0.103	58%	0.577	C	S	.	*	H	α-helix	trans	-63.4	-47.5	170.7	0	0	0	0	0	111.8	S577 S579 R584 R585 A586	S577-G582 VanDerWaalsContact OG-CA 3.28Å; S577-G582 WeakPolarHBondContact OG-CA 3.34Å; S579-G582 VanDerWaalsContact O-CA 3.31Å; S579-G582 WeakPolarHBondContact O-CA 3.3Å; S579-G582 PolarHBondContact O-N 2.93Å; G582-R584 PolarHBondContact O-N 3.09Å; G582-R585 CarbonylContact O-C 3.6Å; G582-R585 WeakPolarHBondContact O-CA 3.43Å; G582-R585 WeakPolarHBondContact O-CB 3.22Å; G582-R585 PolarHBondContact O-N 3.46Å; G582-A586 PolarHBondContact O-N 3.47Å
583	S	49	Very low	50.9	Low	85 Å²	85	105.3 Å²	105.3	59%	0.594	58%	0.579	S	S	*	*	H	α-helix	trans	-58.4	-43.6	173.6	160.2	0	0	0	0	113.1	S579 R585 A586	S579-S583 PolarHBondContact O-N 3.42Å; S583-R585 VanDerWaalsContact C-N 3.27Å; S583-R585 PolarHBondContact O-N 3.27Å; S583-A586 WeakPolarHBondContact O-CB 3.49Å; S583-A586 PolarHBondContact O-N 2.85Å
584	R	49.3	Very low	50.8	Low	218 Å²	218	102.2 Å²	102.2	82%	0.823	56%	0.561	S	S	*	*	H	α-helix	trans	-67.2	-27.7	174.3	-74.9	-171.5	-149.8	166	6.5	113.5	P580 G582	P580-R584 PolarHBondContact O-N 3.18Å; G582-R584 PolarHBondContact O-N 3.09Å
585	R	47.6	Very low	51.3	Low	171 Å²	171	98.3 Å²	98.3	65%	0.645	55%	0.551	S	S	*	*	H	α-helix	trans	-82	-22.6	176.5	-79.7	177.4	177.4	-174.5	0.5	112.8	A581 G582 S583 F587	A581-R585 WeakPolarHBondContact O-CB 3.39Å; A581-R585 VanDerWaalsContact O-CG 3.3Å; A581-R585 WeakPolarHBondContact O-CG 3.42Å; A581-R585 PolarHBondContact O-N 3.37Å; A581-R585 VanDerWaalsContact O-N 3.07Å; G582-R585 CarbonylContact O-C 3.6Å; G582-R585 WeakPolarHBondContact O-CA 3.43Å; G582-R585 WeakPolarHBondContact O-CB 3.22Å; G582-R585 PolarHBondContact O-N 3.46Å; S583-R585 VanDerWaalsContact C-N 3.27Å; S583-R585 PolarHBondContact O-N 3.27Å; R585-F587 VanDerWaalsContact C-N 3.28Å; R585-F587 PolarHBondContact O-N 3.4Å
586	A	48.5	Very low	51.7	Low	57 Å²	57	92.1 Å²	92.1	47%	0.471	53%	0.527	S	S	.	.	S	Bend	trans	-66.9	95.8	164.7	0	0	0	0	0	106.1	G582 S583 T588	G582-A586 PolarHBondContact O-N 3.47Å; S583-A586 WeakPolarHBondContact O-CB 3.49Å; S583-A586 PolarHBondContact O-N 2.85Å; A586-T588 VanDerWaalsContact C-N 3.25Å; A586-T588 PolarHBondContact O-N 3.05Å
587	F	48.5	Very low	52	Low	179 Å²	179	86 Å²	86	79%	0.785	50%	0.501	S	S	*	.			trans	-57.8	94.2	170.6	-86.5	-99.6	0	0	0	107.2	R585 P589	R585-F587 VanDerWaalsContact C-N 3.28Å; R585-F587 PolarHBondContact O-N 3.4Å; F587-P589 WeakPolarHBondContact O-CD 3.44Å
588	T	47.5	Very low	52.2	Low	127 Å²	127	88.3 Å²	88.3	78%	0.779	51%	0.512	S	S	*	.			trans	-75.1	104.9	156.2	44.8	0	0	0	0	105.2	A586 N590	A586-T588 VanDerWaalsContact C-N 3.25Å; A586-T588 PolarHBondContact O-N 3.05Å; T588-N590 PolarHBondContact O-N 3.19Å
589	P	50.3	Low	52.5	Low	55 Å²	55	87.7 Å²	87.7	36%	0.357	50%	0.503	S	S	.	.			trans	-56.1	139.3	176.2	22.2	-30.6	0	0	0	108.7	Q487 F587 A591	Q487-P589 HydrophobicContact CB-CG 4.41Å; F587-P589 WeakPolarHBondContact O-CD 3.44Å; P589-A591 PolarHBondContact O-N 3.23Å
590	N	50.6	Low	52.4	Low	95 Å²	95	89.7 Å²	89.7	51%	0.508	52%	0.523	S	S	.	.			trans	-63.1	122.2	171.7	-173.6	-17.8	0	0	0	107	T588 I592 I593	T588-N590 PolarHBondContact O-N 3.19Å; N590-I592 PolarHBondContact O-N 3.39Å; N590-I592 PolarHBondContact OD1-N 2.65Å; N590-I593 HydrophobicContact CB-CB 4.33Å; N590-I593 CarbonylContact O-C 3.53Å; N590-I593 PolarHBondContact O-N 3.29Å; N590-I593 VanDerWaalsContact O-N 3.15Å
591	A	49.7	Very low	52.9	Low	81 Å²	81	93.7 Å²	93.7	67%	0.669	53%	0.531	S	S	*	.	S	Bend	trans	-56.4	-22.7	-174.7	0	0	0	0	0	113.3	Q480 P589	Q480-A591 PolarHBondContact OE1-O 3.1Å; P589-A591 PolarHBondContact O-N 3.23Å
592	I	49.4	Very low	53.5	Low	119 Å²	119	96.8 Å²	96.8	61%	0.61	55%	0.546	S	S	*	.	S	Bend	trans	-92.3	-41.4	-180	-53.9	-179.5	0	0	0	111.7	Q480 N590 G594	Q480-I592 PolarHBondContact NE2-O 3.23Å; N590-I592 PolarHBondContact O-N 3.39Å; N590-I592 PolarHBondContact OD1-N 2.65Å; I592-G594 PolarHBondContact O-N 2.86Å
593	I	55.9	Low	54.4	Low	122 Å²	122	104.4 Å²	104.4	63%	0.626	58%	0.579	S	S	*	*	S	Bend	trans	-99.1	89.1	-179.6	-51.6	175.7	0	0	0	107.1	N590 S595	N590-I593 HydrophobicContact CB-CB 4.33Å; N590-I593 CarbonylContact O-C 3.53Å; N590-I593 PolarHBondContact O-N 3.29Å; N590-I593 VanDerWaalsContact O-N 3.15Å; I593-S595 PolarHBondContact O-N 3.34Å
594	G	54.3	Low	55.6	Low	21 Å²	21	106.6 Å²	106.6	22%	0.216	58%	0.582	C	S	.	*			trans	-51.9	139.8	175.9	0	0	0	0	0	111.8	A489 I592 G596	A489-G594 VanDerWaalsContact CB-CA 3.44Å; I592-G594 PolarHBondContact O-N 2.86Å; G594-G596 PolarHBondContact O-N 3.08Å
595	S	58.7	Low	56.5	Low	31 Å²	31	102 Å²	102	22%	0.217	57%	0.574	C	S	.	*			trans	-92.5	76.7	172	64.2	0	0	0	0	109.1	R565 I593	R565-S595 PolarHBondContact NH1-O 2.91Å; R565-S595 PolarHBondContact NH1-OG 2.64Å; R565-S595 PolarHBondContact NH2-O 2.97Å; I593-S595 PolarHBondContact O-N 3.34Å
596	G	59.6	Low	57.6	Low	17 Å²	17	102 Å²	102	18%	0.175	58%	0.581	C	S	.	*			trans	-71.1	-179.4	174.7	0	0	0	0	0	112.6	A489 R565 G594 T598	A489-G596 WeakPolarHBondContact O-CA 3.22Å; A489-G596 PolarHBondContact O-N 3.33Å; A489-G596 VanDerWaalsContact O-N 3.14Å; R565-G596 PolarHBondContact NH2-O 3.35Å; G594-G596 PolarHBondContact O-N 3.08Å; G596-T598 PolarHBondContact O-N 3.01Å; G596-T598 VanDerWaalsContact O-N 3.15Å
597	P	57.5	Low	58.7	Low	29 Å²	29	105.1 Å²	105.1	19%	0.188	59%	0.594	C	S	.	*			trans	-58.2	116.3	171	-19.1	32.1	0	0	0	109.8	E520 D522 T599	E520-P597 WeakPolarHBondContact O-CG 3.17Å; D522-P597 HydrophobicContact CB-CB 4.12Å; D522-P597 HydrophobicContact CB-CG 3.71Å; P597-T599 PolarHBondContact O-N 3.27Å; P597-T599 VanDerWaalsContact O-N 3.13Å
598	T	54.7	Low	59.8	Low	101 Å²	101	105.7 Å²	105.7	62%	0.62	60%	0.597	S	S	*	*			trans	-82.7	67	171.2	55.7	0	0	0	0	109.5	E561 G596 A600	E561-T598 PolarHBondContact OE1-OG1 2.93Å; E561-T598 WeakPolarHBondContact OE2-CA 3.32Å; E561-T598 PolarHBondContact OE2-N 3.32Å; E561-T598 PolarHBondContact OE2-OG1 3.44Å; G596-T598 PolarHBondContact O-N 3.01Å; G596-T598 VanDerWaalsContact O-N 3.15Å; T598-A600 PolarHBondContact O-N 2.88Å; T598-A600 VanDerWaalsContact O-N 3.08Å
599	T	54.9	Low	60.7	Low	115 Å²	115	111.1 Å²	111.1	71%	0.706	60%	0.603	S	S	*	*			trans	-60.1	118.9	153	47.1	0	0	0	0	105.7	P597 K601	P597-T599 PolarHBondContact O-N 3.27Å; P597-T599 VanDerWaalsContact O-N 3.13Å; T599-K601 PolarHBondContact O-N 3.38Å
600	A	57.1	Low	61.7	Low	97 Å²	97	112.5 Å²	112.5	80%	0.802	62%	0.619	S	S	*	*			trans	-54.1	113.1	174.7	0	0	0	0	0	106.1	T598	T598-A600 PolarHBondContact O-N 2.88Å; T598-A600 VanDerWaalsContact O-N 3.08Å
601	K	63	Low	62.7	Low	184 Å²	184	112.9 Å²	112.9	80%	0.8	63%	0.626	S	S	*	*			trans	-53.9	144.1	172.7	-70.8	-173.6	178.2	-174.5	0	106.7	T599 E603	T599-K601 PolarHBondContact O-N 3.38Å; K601-E603 PolarHBondContact O-N 3.11Å
602	P	65.8	Low	64	Low	118 Å²	118	117.5 Å²	117.5	77%	0.766	63%	0.634	S	S	*	*			trans	-44.9	134.6	176.6	-25.3	31.8	0	0	0	109.2	I604	P602-I604 PolarHBondContact O-N 3.35Å
603	E	70.6	Confident	65.1	Low	171 Å²	171	122 Å²	122	80%	0.799	65%	0.65	S	S	*	*			trans	-49.4	122.1	178.8	-175	167.8	-178	0	0	108	K601 D605	K601-E603 PolarHBondContact O-N 3.11Å; E603-D605 PolarHBondContact O-N 3.47Å
604	I	73.3	Confident	66.1	Low	130 Å²	130	126.5 Å²	126.5	67%	0.667	66%	0.659	S	S	*	*			trans	-70.9	93.1	174.9	-58.6	173.6	0	0	0	104.6	P602 H606	P602-I604 PolarHBondContact O-N 3.35Å; I604-H606 VanDerWaalsContact C-N 3.3Å; I604-H606 PolarHBondContact O-N 2.92Å
605	D	68.8	Low	67.2	Low	123 Å²	123	128.5 Å²	128.5	66%	0.658	67%	0.673	S	S	*	*			trans	-57.9	104	164.1	-76.2	-36.3	0	0	0	106	E603 V607	E603-D605 PolarHBondContact O-N 3.47Å; D605-V607 HydrophobicContact CB-CG2 3.98Å; D605-V607 PolarHBondContact O-N 3.45Å
606	H	70.6	Confident	68.4	Low	170 Å²	170	131 Å²	131	79%	0.787	69%	0.689	S	S	*	*			trans	-67.7	75.7	170.1	-79.3	-79.1	0	0	0	107.7	I604 F608	I604-H606 VanDerWaalsContact C-N 3.3Å; I604-H606 PolarHBondContact O-N 2.92Å; H606-F608 PolarHBondContact O-N 3.21Å; H606-F608 VanDerWaalsContact O-N 3.12Å
607	V	71.8	Confident	69.6	Low	122 Å²	122	135.7 Å²	135.7	74%	0.739	72%	0.716	S	S	*	*			trans	-71.5	109	170.3	-170.6	0	0	0	0	105.1	D605 R609	D605-V607 HydrophobicContact CB-CG2 3.98Å; D605-V607 PolarHBondContact O-N 3.45Å; V607-R609 PolarHBondContact O-N 3.38Å
608	F	71.5	Confident	71.1	Confident	192 Å²	192	141.7 Å²	141.7	84%	0.842	74%	0.739	S	S	*	*			trans	-47.7	137.7	167.1	-78.3	-81.8	0	0	0	108.2	H606 A610	H606-F608 PolarHBondContact O-N 3.21Å; H606-F608 VanDerWaalsContact O-N 3.12Å; F608-A610 PolarHBondContact O-N 3.17Å
609	R	67.2	Low	72.7	Confident	241 Å²	241	140.8 Å²	140.8	91%	0.909	73%	0.73	S	S	*	*			trans	-42.1	125.6	175.2	-72.6	-176.9	178	-174.4	-0.8	108	V607	V607-R609 PolarHBondContact O-N 3.38Å
610	A	71.6	Confident	74.3	Confident	84 Å²	84	138.1 Å²	138.1	69%	0.694	72%	0.719	S	S	*	*			trans	-48.6	136.8	172.4	0	0	0	0	0	107.5	F608 E612	F608-A610 PolarHBondContact O-N 3.17Å; A610-E612 PolarHBondContact O-N 3.07Å
611	P	71.2	Confident	76	Confident	102 Å²	102	138.3 Å²	138.3	66%	0.662	71%	0.707	S	S	*	*			trans	-46.3	136.4	179	-26	31.9	0	0	0	109.5	K613	P611-K613 PolarHBondContact O-N 3.31Å
612	E	76.4	Confident	77.5	Confident	179 Å²	179	131.9 Å²	131.9	84%	0.836	68%	0.683	S	S	*	*			trans	-44.2	138.7	176.9	-70.9	-179.9	170.8	0	0	110	A610 R614	A610-E612 PolarHBondContact O-N 3.07Å; E612-R614 PolarHBondContact O-N 2.92Å
613	K	73.7	Confident	78.8	Confident	214 Å²	214	132.3 Å²	132.3	93%	0.93	67%	0.673	S	S	*	*			trans	-51.3	108.1	178.6	-89.1	-174.9	176.7	178.9	0	108.3	P611	P611-K613 PolarHBondContact O-N 3.31Å
614	R	75.2	Confident	79.9	Confident	216 Å²	216	128 Å²	128	82%	0.815	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.2	152.4	174.9	-59.6	-176.1	-176.1	179.5	1.1	108.1	E612	E612-R614 PolarHBondContact O-N 2.92Å
615	A	77.5	Confident	80.9	Confident	63 Å²	63	126.1 Å²	126.1	52%	0.521	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-49.5	145.1	169.4	0	0	0	0	0	109.6	L619	A615-L619 HydrophobicContact CB-CD2 4.37Å
616	P	84.1	Confident	82.2	Confident	84 Å²	84	124.5 Å²	124.5	55%	0.545	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-49.9	134.7	-179.6	-25.5	32.6	0	0	0	110.3	F618 L619 A620	P616-F618 PolarHBondContact O-N 2.9Å; P616-L619 PolarHBondContact O-N 2.91Å; P616-A620 PolarHBondContact O-N 3.26Å
617	P	84.7	Confident	83.3	Confident	114 Å²	114	121.3 Å²	121.3	74%	0.74	64%	0.635	S	S	*	*	H	α-helix	trans	-52.5	-31.1	-180	-26.9	33.3	0	0	0	112.8	A620 L621	P617-A620 PolarHBondContact O-N 3.34Å; P617-L621 VanDerWaalsContact O-CB 3.31Å; P617-L621 WeakPolarHBondContact O-CB 3.39Å; P617-L621 PolarHBondContact O-N 2.92Å
618	F	89.7	Confident	84.4	Confident	155 Å²	155	120 Å²	120	68%	0.68	62%	0.623	S	S	*	*	H	α-helix	trans	-55.9	-49	173.4	178.8	-102.9	0	0	0	112.9	P616 A620 L621 T622	P616-F618 PolarHBondContact O-N 2.9Å; F618-A620 PolarHBondContact O-N 3.08Å; F618-L621 PolarHBondContact O-N 3.32Å; F618-T622 PolarHBondContact O-N 3.46Å; F618-T622 PolarHBondContact O-OG1 3.37Å
619	L	88.3	Confident	85.5	Confident	83 Å²	83	115 Å²	115	44%	0.435	61%	0.605	S	S	.	*	H	α-helix	trans	-63.4	-45.3	-178.1	-170.8	69.6	0	0	0	110.8	A615 P616 L621 T622 F623	A615-L619 HydrophobicContact CB-CD2 4.37Å; P616-L619 PolarHBondContact O-N 2.91Å; L619-L621 VanDerWaalsContact C-N 3.35Å; L619-L621 PolarHBondContact O-N 3.45Å; L619-T622 PolarHBondContact O-N 3.43Å; L619-F623 HydrophobicContact CD1-CD2 4.39Å; L619-F623 HydrophobicContact CD1-CE2 3.85Å; L619-F623 HydrophobicContact CG-CD2 4.23Å; L619-F623 HydrophobicContact CG-CE2 4Å; L619-F623 VanDerWaalsContact O-CD2 3.26Å; L619-F623 WeakPolarHBondContact O-CD2 3.37Å; L619-F623 PolarHBondContact O-N 3.49Å
620	A	89.1	Confident	86.9	Confident	58 Å²	58	108 Å²	108	48%	0.479	59%	0.591	S	S	.	*	H	α-helix	trans	-59.7	-46	176.2	0	0	0	0	0	111.4	P616 P617 F618 T622 F623 T624	P616-A620 PolarHBondContact O-N 3.26Å; P617-A620 PolarHBondContact O-N 3.34Å; F618-A620 PolarHBondContact O-N 3.08Å; A620-T622 PolarHBondContact O-N 2.84Å; A620-F623 PolarHBondContact O-N 3.04Å; A620-T624 PolarHBondContact O-N 3.11Å; A620-T624 PolarHBondContact O-OG1 3.02Å
621	L	92.1	Very high	87.8	Confident	102 Å²	102	108.4 Å²	108.4	53%	0.534	58%	0.581	S	S	.	*	H	α-helix	trans	-62.5	-39.8	178.2	-172.1	68	0	0	0	112.2	P617 F618 L619 F623 T624 I625	P617-L621 VanDerWaalsContact O-CB 3.31Å; P617-L621 WeakPolarHBondContact O-CB 3.39Å; P617-L621 PolarHBondContact O-N 2.92Å; F618-L621 PolarHBondContact O-N 3.32Å; L619-L621 VanDerWaalsContact C-N 3.35Å; L619-L621 PolarHBondContact O-N 3.45Å; L621-F623 PolarHBondContact O-N 3.21Å; L621-T624 PolarHBondContact O-N 2.96Å; L621-I625 HydrophobicContact CG-CD1 4.15Å; L621-I625 WeakPolarHBondContact O-CG1 3.47Å; L621-I625 PolarHBondContact O-N 3.28Å
622	T	95	Very high	88.9	Confident	48 Å²	48	108 Å²	108	29%	0.294	57%	0.573	S	S	.	*	H	α-helix	trans	-57.8	-48.4	175.4	-55.1	0	0	0	0	111.2	F618 L619 A620 T624 I625 L626	F618-T622 PolarHBondContact O-N 3.46Å; F618-T622 PolarHBondContact O-OG1 3.37Å; L619-T622 PolarHBondContact O-N 3.43Å; A620-T622 PolarHBondContact O-N 2.84Å; T622-T624 PolarHBondContact O-N 3.45Å; T622-I625 PolarHBondContact O-N 3.49Å; T622-L626 HydrophobicContact CG2-CD1 4.23Å; T622-L626 WeakPolarHBondContact O-CG 3.29Å; T622-L626 PolarHBondContact O-N 2.84Å
623	F	93.1	Very high	89.8	Confident	128 Å²	128	101.3 Å²	101.3	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-67.9	-34.8	178.4	-77.7	-73.4	0	0	0	112.6	L619 A620 L621 L626 C627	L619-F623 HydrophobicContact CD1-CD2 4.39Å; L619-F623 HydrophobicContact CD1-CE2 3.85Å; L619-F623 HydrophobicContact CG-CD2 4.23Å; L619-F623 HydrophobicContact CG-CE2 4Å; L619-F623 VanDerWaalsContact O-CD2 3.26Å; L619-F623 WeakPolarHBondContact O-CD2 3.37Å; L619-F623 PolarHBondContact O-N 3.49Å; A620-F623 PolarHBondContact O-N 3.04Å; L621-F623 PolarHBondContact O-N 3.21Å; F623-L626 HydrophobicContact CD1-CD1 4.21Å; F623-L626 HydrophobicContact CE1-CD1 4.48Å; F623-L626 PolarHBondContact O-N 3.33Å; F623-C627 WeakPolarHBondContact O-CB 3.46Å; F623-C627 PolarHBondContact O-N 2.94Å
624	T	92.5	Very high	90.6	Very high	79 Å²	79	94.6 Å²	94.6	49%	0.485	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-45.6	171.9	-55.6	0	0	0	0	111.2	A620 L621 T622 C627 L628	A620-T624 PolarHBondContact O-N 3.11Å; A620-T624 PolarHBondContact O-OG1 3.02Å; L621-T624 PolarHBondContact O-N 2.96Å; T622-T624 PolarHBondContact O-N 3.45Å; T624-C627 PolarHBondContact O-N 2.79Å; T624-L628 HydrophobicContact CG2-CD1 4.36Å; T624-L628 WeakPolarHBondContact O-CG 3.38Å; T624-L628 PolarHBondContact O-N 3.25Å; T624-L628 VanDerWaalsContact O-N 3.11Å
625	I	95.5	Very high	91.5	Very high	91 Å²	91	88.6 Å²	88.6	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-47.5	177.1	-67.9	166.4	0	0	0	110.7	L621 T622 C627 L628 L629	L621-I625 HydrophobicContact CG-CD1 4.15Å; L621-I625 WeakPolarHBondContact O-CG1 3.47Å; L621-I625 PolarHBondContact O-N 3.28Å; T622-I625 PolarHBondContact O-N 3.49Å; I625-C627 PolarHBondContact O-N 3.25Å; I625-L628 WeakPolarHBondContact O-CA 3.26Å; I625-L628 WeakPolarHBondContact O-CB 3.46Å; I625-L628 PolarHBondContact O-N 3.46Å; I625-L629 PolarHBondContact O-N 3.31Å; I625-L629 VanDerWaalsContact O-N 3.08Å
626	L	95.2	Very high	92.2	Very high	90 Å²	90	90.1 Å²	90.1	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-56.8	-38.8	176.9	-74.4	171.9	0	0	0	111.9	T622 F623 L628 L629 P630	T622-L626 HydrophobicContact CG2-CD1 4.23Å; T622-L626 WeakPolarHBondContact O-CG 3.29Å; T622-L626 PolarHBondContact O-N 2.84Å; F623-L626 HydrophobicContact CD1-CD1 4.21Å; F623-L626 HydrophobicContact CE1-CD1 4.48Å; F623-L626 PolarHBondContact O-N 3.33Å; L626-L628 VanDerWaalsContact C-N 3.29Å; L626-L628 PolarHBondContact O-N 3.02Å; L626-L629 HydrophobicContact CD2-CD1 3.86Å; L626-L629 PolarHBondContact O-N 3.46Å; L626-P630 WeakPolarHBondContact O-CD 3.36Å
627	C	93.9	Very high	92.6	Very high	103 Å²	103	87.8 Å²	87.8	70%	0.696	49%	0.494	S	S	*	.	H	α-helix	trans	-70.7	-23.9	177.1	-160.5	0	0	0	0	113.1	F623 T624 I625	F623-C627 WeakPolarHBondContact O-CB 3.46Å; F623-C627 PolarHBondContact O-N 2.94Å; T624-C627 PolarHBondContact O-N 2.79Å; I625-C627 PolarHBondContact O-N 3.25Å
628	L	95.1	Very high	92.9	Very high	94 Å²	94	87.9 Å²	87.9	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-83.8	-19.5	174.6	-70.4	170.2	0	0	0	113.1	T624 I625 L626 L631 L632	T624-L628 HydrophobicContact CG2-CD1 4.36Å; T624-L628 WeakPolarHBondContact O-CG 3.38Å; T624-L628 PolarHBondContact O-N 3.25Å; T624-L628 VanDerWaalsContact O-N 3.11Å; I625-L628 WeakPolarHBondContact O-CA 3.26Å; I625-L628 WeakPolarHBondContact O-CB 3.46Å; I625-L628 PolarHBondContact O-N 3.46Å; L626-L628 VanDerWaalsContact C-N 3.29Å; L626-L628 PolarHBondContact O-N 3.02Å; L628-L631 HydrophobicContact CD2-CD2 4.35Å; L628-L631 WeakPolarHBondContact O-CB 3.27Å; L628-L631 PolarHBondContact O-N 3.34Å; L628-L631 VanDerWaalsContact O-N 3.11Å; L628-L632 PolarHBondContact O-N 3.36Å
629	L	95.1	Very high	92.8	Very high	88 Å²	88	85.5 Å²	85.5	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-58.5	-42.8	-179.4	-70.9	177.9	0	0	0	113.9	I625 L626 L631 L632 G633	I625-L629 PolarHBondContact O-N 3.31Å; I625-L629 VanDerWaalsContact O-N 3.08Å; L626-L629 HydrophobicContact CD2-CD1 3.86Å; L626-L629 PolarHBondContact O-N 3.46Å; L629-L631 VanDerWaalsContact C-N 3.27Å; L629-L631 PolarHBondContact O-N 3.28Å; L629-L632 WeakPolarHBondContact O-CB 3.35Å; L629-L632 PolarHBondContact O-N 2.91Å; L629-G633 PolarHBondContact O-N 3.33Å
630	P	95.6	Very high	92.9	Very high	93 Å²	93	87.2 Å²	87.2	60%	0.604	50%	0.496	S	S	*	.	H	α-helix	trans	-61	-35	174.8	-25	34.9	0	0	0	113.2	L626 G633 L634	L626-P630 WeakPolarHBondContact O-CD 3.36Å; P630-G633 PolarHBondContact O-N 2.84Å; P630-L634 PolarHBondContact O-N 3.29Å
631	L	91.7	Very high	92.9	Very high	92 Å²	92	91.3 Å²	91.3	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-67.2	-42.6	175.7	179.2	64.2	0	0	0	110.9	L628 L629 G633 L634 I635	L628-L631 HydrophobicContact CD2-CD2 4.35Å; L628-L631 WeakPolarHBondContact O-CB 3.27Å; L628-L631 PolarHBondContact O-N 3.34Å; L628-L631 VanDerWaalsContact O-N 3.11Å; L629-L631 VanDerWaalsContact C-N 3.27Å; L629-L631 PolarHBondContact O-N 3.28Å; L631-G633 VanDerWaalsContact C-N 3.34Å; L631-L634 WeakPolarHBondContact O-CB 3.44Å; L631-L634 PolarHBondContact O-N 3.16Å; L631-I635 HydrophobicContact CG-CD1 4.38Å; L631-I635 WeakPolarHBondContact O-CG1 3.48Å; L631-I635 PolarHBondContact O-N 3.48Å
632	L	93.7	Very high	92.4	Very high	95 Å²	95	88.5 Å²	88.5	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-60.4	-44.7	173.2	-178.1	64.2	0	0	0	111.3	L628 L629 L634 I635 I636	L628-L632 PolarHBondContact O-N 3.36Å; L629-L632 WeakPolarHBondContact O-CB 3.35Å; L629-L632 PolarHBondContact O-N 2.91Å; L632-L634 VanDerWaalsContact C-N 3.3Å; L632-L634 PolarHBondContact O-N 3.03Å; L632-I635 PolarHBondContact O-N 3.09Å; L632-I636 HydrophobicContact CD1-CD1 4.49Å; L632-I636 HydrophobicContact CG-CD1 4.11Å; L632-I636 WeakPolarHBondContact O-CG1 3.36Å; L632-I636 PolarHBondContact O-N 3.32Å
633	G	94.3	Very high	91.6	Very high	37 Å²	37	92.5 Å²	92.5	38%	0.381	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-39.9	175.1	0	0	0	0	0	112.9	L629 P630 L631 I636 A637	L629-G633 PolarHBondContact O-N 3.33Å; P630-G633 PolarHBondContact O-N 2.84Å; L631-G633 VanDerWaalsContact C-N 3.34Å; G633-I636 PolarHBondContact O-N 2.95Å; G633-A637 WeakPolarHBondContact O-CB 3.35Å; G633-A637 PolarHBondContact O-N 3.14Å
634	L	92	Very high	90.8	Very high	73 Å²	73	91.5 Å²	91.5	38%	0.382	52%	0.518	S	S	.	.	H	α-helix	trans	-63.9	-43.4	175	-178.8	65.4	0	0	0	112.2	P630 L631 L632 I636 A637 W638	P630-L634 PolarHBondContact O-N 3.29Å; L631-L634 WeakPolarHBondContact O-CB 3.44Å; L631-L634 PolarHBondContact O-N 3.16Å; L632-L634 VanDerWaalsContact C-N 3.3Å; L632-L634 PolarHBondContact O-N 3.03Å; L634-I636 VanDerWaalsContact C-N 3.35Å; L634-A637 PolarHBondContact O-N 3.13Å; L634-W638 HydrophobicContact CD1-CD2 4.42Å; L634-W638 HydrophobicContact CD1-CZ2 3.97Å; L634-W638 HydrophobicContact CD2-CH2 3.76Å; L634-W638 HydrophobicContact CD2-CZ2 3.76Å; L634-W638 HydrophobicContact CD2-CZ3 4.33Å; L634-W638 HydrophobicContact CG-CD2 4.19Å; L634-W638 HydrophobicContact CG-CE3 4.4Å; L634-W638 HydrophobicContact CG-CH2 4.08Å; L634-W638 HydrophobicContact CG-CZ2 3.84Å; L634-W638 HydrophobicContact CG-CZ3 4.35Å; L634-W638 PolarHBondContact O-N 3.11Å
635	I	92.8	Very high	89.8	Confident	90 Å²	90	93.5 Å²	93.5	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-43.4	177.3	-66.8	166.5	0	0	0	110.6	L631 L632 W638 S639	L631-I635 HydrophobicContact CG-CD1 4.38Å; L631-I635 WeakPolarHBondContact O-CG1 3.48Å; L631-I635 PolarHBondContact O-N 3.48Å; L632-I635 PolarHBondContact O-N 3.09Å; I635-W638 PolarHBondContact O-N 2.99Å; I635-S639 PolarHBondContact O-N 3.15Å
636	I	93.6	Very high	88.8	Confident	95 Å²	95	93.7 Å²	93.7	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-62.2	-45.9	175.3	-66	167.2	0	0	0	110.4	L632 G633 L634 W638 S639 V640	L632-I636 HydrophobicContact CD1-CD1 4.49Å; L632-I636 HydrophobicContact CG-CD1 4.11Å; L632-I636 WeakPolarHBondContact O-CG1 3.36Å; L632-I636 PolarHBondContact O-N 3.32Å; G633-I636 PolarHBondContact O-N 2.95Å; L634-I636 VanDerWaalsContact C-N 3.35Å; I636-W638 VanDerWaalsContact C-N 3.32Å; I636-W638 PolarHBondContact O-N 3.49Å; I636-S639 WeakPolarHBondContact O-CB 3.21Å; I636-S639 PolarHBondContact O-N 3.31Å; I636-V640 PolarHBondContact O-N 2.76Å; I636-V640 VanDerWaalsContact O-N 3.1Å
637	A	91.7	Very high	87.7	Confident	35 Å²	35	95.4 Å²	95.4	29%	0.289	54%	0.544	S	S	.	.	H	α-helix	trans	-59.4	-42.3	178.1	0	0	0	0	0	111.9	G633 L634 S639 V640 I641	G633-A637 WeakPolarHBondContact O-CB 3.35Å; G633-A637 PolarHBondContact O-N 3.14Å; L634-A637 PolarHBondContact O-N 3.13Å; A637-S639 VanDerWaalsContact C-N 3.33Å; A637-S639 PolarHBondContact O-N 3.02Å; A637-V640 PolarHBondContact O-N 3.07Å; A637-I641 HydrophobicContact CB-CD1 4.37Å; A637-I641 VanDerWaalsContact O-CB 3.31Å; A637-I641 WeakPolarHBondContact O-CB 3.2Å; A637-I641 WeakPolarHBondContact O-CG1 3.36Å; A637-I641 PolarHBondContact O-N 3.38Å
638	W	90.7	Very high	86.7	Confident	117 Å²	117	94.2 Å²	94.2	44%	0.443	53%	0.527	S	S	.	.	H	α-helix	trans	-64.3	-34.6	173.6	-72.6	-22	0	0	0	113.3	L634 I635 I636 V640 G642 F643	L634-W638 HydrophobicContact CD1-CD2 4.42Å; L634-W638 HydrophobicContact CD1-CZ2 3.97Å; L634-W638 HydrophobicContact CD2-CH2 3.76Å; L634-W638 HydrophobicContact CD2-CZ2 3.76Å; L634-W638 HydrophobicContact CD2-CZ3 4.33Å; L634-W638 HydrophobicContact CG-CD2 4.19Å; L634-W638 HydrophobicContact CG-CE3 4.4Å; L634-W638 HydrophobicContact CG-CH2 4.08Å; L634-W638 HydrophobicContact CG-CZ2 3.84Å; L634-W638 HydrophobicContact CG-CZ3 4.35Å; L634-W638 PolarHBondContact O-N 3.11Å; I635-W638 PolarHBondContact O-N 2.99Å; I636-W638 VanDerWaalsContact C-N 3.32Å; I636-W638 PolarHBondContact O-N 3.49Å; W638-V640 VanDerWaalsContact C-N 3.3Å; W638-V640 PolarHBondContact O-N 3.35Å; W638-G642 CarbonylContact O-C 3.33Å; W638-G642 WeakPolarHBondContact O-CA 3.48Å; W638-G642 PolarHBondContact O-N 3.23Å; W638-F643 HydrophobicContact CD2-CD2 4.07Å; W638-F643 AromaticContact CE2-CD2 3.9Å; W638-F643 HydrophobicContact CG-CD2 4.18Å; W638-F643 HydrophobicContact CZ2-CD2 4.4Å; W638-F643 HydrophobicContact CZ2-CE2 4.11Å; W638-F643 AromaticContact NE1-CD2 3.91Å
639	S	87.3	Confident	85.9	Confident	105 Å²	105	96.4 Å²	96.4	73%	0.734	53%	0.533	S	S	*	.	H	α-helix	trans	-68.1	-28.4	176.1	-171.1	0	0	0	0	113.1	I635 I636 A637	I635-S639 PolarHBondContact O-N 3.15Å; I636-S639 WeakPolarHBondContact O-CB 3.21Å; I636-S639 PolarHBondContact O-N 3.31Å; A637-S639 VanDerWaalsContact C-N 3.33Å; A637-S639 PolarHBondContact O-N 3.02Å
640	V	91.6	Very high	85.2	Confident	119 Å²	119	101 Å²	101	72%	0.721	55%	0.549	S	S	*	.	H	α-helix	trans	-92.1	-46.8	-179.2	177.5	0	0	0	0	111.8	I636 A637 W638 G642	I636-V640 PolarHBondContact O-N 2.76Å; I636-V640 VanDerWaalsContact O-N 3.1Å; A637-V640 PolarHBondContact O-N 3.07Å; W638-V640 VanDerWaalsContact C-N 3.3Å; W638-V640 PolarHBondContact O-N 3.35Å; V640-G642 VanDerWaalsContact C-N 3.35Å
641	I	88.1	Confident	84.8	Confident	143 Å²	143	98.8 Å²	98.8	73%	0.733	54%	0.536	S	S	*	.	H	α-helix	trans	-82.3	-20.4	-175.3	-58.2	170.3	0	0	0	111	A637	A637-I641 HydrophobicContact CB-CD1 4.37Å; A637-I641 VanDerWaalsContact O-CB 3.31Å; A637-I641 WeakPolarHBondContact O-CB 3.2Å; A637-I641 WeakPolarHBondContact O-CG1 3.36Å; A637-I641 PolarHBondContact O-N 3.38Å
642	G	81.2	Confident	84.6	Confident	43 Å²	43	100.9 Å²	100.9	44%	0.443	55%	0.546	S	S	.	.			trans	81.8	153	-168.1	0	0	0	0	0	111.8	W638 V640	W638-G642 CarbonylContact O-C 3.33Å; W638-G642 WeakPolarHBondContact O-CA 3.48Å; W638-G642 PolarHBondContact O-N 3.23Å; V640-G642 VanDerWaalsContact C-N 3.35Å
643	F	78.3	Confident	84.4	Confident	133 Å²	133	97.3 Å²	97.3	58%	0.583	53%	0.529	S	S	*	.			trans	-102	109.3	175.9	-176.9	-110.1	0	0	0	109.8	W638 I645	W638-F643 HydrophobicContact CD2-CD2 4.07Å; W638-F643 AromaticContact CE2-CD2 3.9Å; W638-F643 HydrophobicContact CG-CD2 4.18Å; W638-F643 HydrophobicContact CZ2-CD2 4.4Å; W638-F643 HydrophobicContact CZ2-CE2 4.11Å; W638-F643 AromaticContact NE1-CD2 3.91Å; F643-I645 HydrophobicContact CD1-CG2 3.57Å; F643-I645 HydrophobicContact CE1-CG2 3.13Å; F643-I645 HydrophobicContact CZ-CG2 3.97Å; F643-I645 PolarHBondContact O-N 2.93Å
644	N	76.5	Confident	84.1	Confident	106 Å²	106	96.4 Å²	96.4	57%	0.567	52%	0.515	S	S	*	.			trans	-92.1	101.8	-174.7	-171.5	-0.7	0	0	0	112.5	S646	N644-S646 VanDerWaalsContact OD1-CB 3.32Å; N644-S646 WeakPolarHBondContact OD1-CB 3.29Å; N644-S646 PolarHBondContact OD1-N 3.38Å; N644-S646 PolarHBondContact OD1-OG 3.39Å
645	I	72.6	Confident	84.1	Confident	122 Å²	122	97.2 Å²	97.2	63%	0.626	52%	0.519	S	S	*	.			trans	-95	-3.9	170.6	57.7	171.9	0	0	0	114.2	F643 N647 F648	F643-I645 HydrophobicContact CD1-CG2 3.57Å; F643-I645 HydrophobicContact CE1-CG2 3.13Å; F643-I645 HydrophobicContact CZ-CG2 3.97Å; F643-I645 PolarHBondContact O-N 2.93Å; I645-N647 PolarHBondContact O-N 2.98Å; I645-N647 VanDerWaalsContact O-N 3.08Å; I645-F648 WeakPolarHBondContact O-CB 3.43Å; I645-F648 PolarHBondContact O-N 3.21Å
646	S	73.5	Confident	84.1	Confident	94 Å²	94	96.7 Å²	96.7	66%	0.657	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.2	-174.1	68.5	0	0	0	0	113.8	N644 F648	N644-S646 VanDerWaalsContact OD1-CB 3.32Å; N644-S646 WeakPolarHBondContact OD1-CB 3.29Å; N644-S646 PolarHBondContact OD1-N 3.38Å; N644-S646 PolarHBondContact OD1-OG 3.39Å; S646-F648 PolarHBondContact O-N 2.88Å
647	N	71.9	Confident	84.1	Confident	126 Å²	126	94.5 Å²	94.5	67%	0.674	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-1.2	178.3	-75	-29.8	0	0	0	113.9	I645 K649	I645-N647 PolarHBondContact O-N 2.98Å; I645-N647 VanDerWaalsContact O-N 3.08Å; N647-K649 PolarHBondContact O-N 3.2Å
648	F	73.4	Confident	84.2	Confident	79 Å²	79	96.7 Å²	96.7	35%	0.346	51%	0.508	S	S	.	.			trans	-74.1	110.4	176.6	-171.6	-94	0	0	0	111	I645 S646 F650 N654 H658	I645-F648 WeakPolarHBondContact O-CB 3.43Å; I645-F648 PolarHBondContact O-N 3.21Å; S646-F648 PolarHBondContact O-N 2.88Å; F648-F650 HydrophobicContact CD1-CE2 4.41Å; F648-F650 HydrophobicContact CD1-CZ 4.47Å; F648-F650 HydrophobicContact CE1-CD1 4.17Å; F648-F650 HydrophobicContact CE1-CE1 4.21Å; F648-F650 HydrophobicContact CE1-CG 4.43Å; F648-F650 HydrophobicContact CE1-CZ 4.49Å; F648-N654 HydrophobicContact CE2-CB 4.12Å; F648-N654 HydrophobicContact CZ-CB 4.09Å; F648-H658 AromaticContact CE2-CE1 3.73Å; F648-H658 AromaticContact CE2-ND1 3.69Å
649	K	78.2	Confident	84.4	Confident	140 Å²	140	93.5 Å²	93.5	61%	0.609	51%	0.506	S	S	*	.			trans	-87.5	131.9	173.1	-61.6	-172.1	178.4	-174.9	0	110.2	N647 S651 N654	N647-K649 PolarHBondContact O-N 3.2Å; K649-S651 VanDerWaalsContact C-N 3.28Å; K649-S651 PolarHBondContact O-N 2.69Å; K649-N654 PolarHBondContact O-ND2 3.49Å
650	F	81.6	Confident	84.8	Confident	184 Å²	184	88.9 Å²	88.9	81%	0.807	48%	0.476	S	S	*	.			trans	-73.7	81.4	172.5	-75	-86.9	0	0	0	110.7	F648	F648-F650 HydrophobicContact CD1-CE2 4.41Å; F648-F650 HydrophobicContact CD1-CZ 4.47Å; F648-F650 HydrophobicContact CE1-CD1 4.17Å; F648-F650 HydrophobicContact CE1-CE1 4.21Å; F648-F650 HydrophobicContact CE1-CG 4.43Å; F648-F650 HydrophobicContact CE1-CZ 4.49Å
651	S	85.4	Confident	85	Confident	47 Å²	47	87.3 Å²	87.3	33%	0.329	46%	0.463	S	S	.	.			trans	-118.3	149.2	169.4	75.3	0	0	0	0	110	K649 S653 N654 I655	K649-S651 VanDerWaalsContact C-N 3.28Å; K649-S651 PolarHBondContact O-N 2.69Å; S651-S653 PolarHBondContact O-N 3.3Å; S651-N654 WeakPolarHBondContact O-CB 3.47Å; S651-N654 PolarHBondContact O-N 2.69Å; S651-N654 WeakPolarHBondContact OG-CB 3.49Å; S651-N654 PolarHBondContact OG-N 3.3Å; S651-N654 PolarHBondContact OG-ND2 3Å; S651-I655 PolarHBondContact O-N 2.9Å; S651-I655 VanDerWaalsContact O-N 3.08Å
652	I	88.9	Confident	85.4	Confident	135 Å²	135	86 Å²	86	69%	0.692	46%	0.456	S	S	*	.	H	α-helix	trans	-54.8	-41.7	179.6	-65.3	165	0	0	0	110.9	N654 I655 I656	I652-N654 PolarHBondContact O-N 3.46Å; I652-I655 PolarHBondContact O-N 3.02Å; I652-I656 HydrophobicContact CG2-CD1 3.77Å; I652-I656 HydrophobicContact CG2-CG1 4.44Å; I652-I656 WeakPolarHBondContact O-CG1 3.4Å; I652-I656 PolarHBondContact O-N 3.38Å
653	S	88.7	Confident	86.2	Confident	20 Å²	20	86.2 Å²	86.2	14%	0.14	45%	0.451	C	S	.	.	H	α-helix	trans	-64.3	-38.2	178.5	-157.6	0	0	0	0	112.8	S651 F657 A694 R697 V698	S651-S653 PolarHBondContact O-N 3.3Å; S653-F657 VanDerWaalsContact O-CB 3.28Å; S653-F657 WeakPolarHBondContact O-CB 3.39Å; S653-F657 PolarHBondContact O-N 3.26Å; S653-A694 PolarHBondContact OG-O 3.33Å; S653-R697 WeakPolarHBondContact OG-CB 3.28Å; S653-V698 WeakPolarHBondContact O-CG2 3.46Å
654	N	88.4	Confident	87.1	Confident	18 Å²	18	81.4 Å²	81.4	10%	0.096	43%	0.431	C	S	.	.	H	α-helix	trans	-65.2	-43.7	176.5	-74.9	-11	0	0	0	111.3	F648 K649 S651 I652 F657 H658 V698	F648-N654 HydrophobicContact CE2-CB 4.12Å; F648-N654 HydrophobicContact CZ-CB 4.09Å; K649-N654 PolarHBondContact O-ND2 3.49Å; S651-N654 WeakPolarHBondContact O-CB 3.47Å; S651-N654 PolarHBondContact O-N 2.69Å; S651-N654 WeakPolarHBondContact OG-CB 3.49Å; S651-N654 PolarHBondContact OG-N 3.3Å; S651-N654 PolarHBondContact OG-ND2 3Å; I652-N654 PolarHBondContact O-N 3.46Å; N654-F657 PolarHBondContact O-N 3.06Å; N654-H658 PolarHBondContact O-N 3.35Å; N654-H658 PolarHBondContact O-ND1 3.37Å; N654-V698 HydrophobicContact CB-CG2 4.45Å; N654-V698 WeakPolarHBondContact OD1-CB 3.44Å; N654-V698 WeakPolarHBondContact OD1-CG1 3.45Å; N654-V698 WeakPolarHBondContact OD1-CG2 3.43Å
655	I	91.2	Very high	88	Confident	90 Å²	90	79.9 Å²	79.9	46%	0.462	43%	0.427	S	S	.	.	H	α-helix	trans	-62.3	-50	179.4	-63.9	169	0	0	0	110.1	S651 I652 F657 H658 A659	S651-I655 PolarHBondContact O-N 2.9Å; S651-I655 VanDerWaalsContact O-N 3.08Å; I652-I655 PolarHBondContact O-N 3.02Å; I655-F657 VanDerWaalsContact C-N 3.33Å; I655-F657 PolarHBondContact O-N 3.04Å; I655-H658 PolarHBondContact O-N 3.03Å; I655-A659 WeakPolarHBondContact O-CB 3.36Å; I655-A659 PolarHBondContact O-N 3.4Å
656	I	93.2	Very high	89.2	Confident	80 Å²	80	81 Å²	81	41%	0.41	43%	0.425	S	S	.	.	H	α-helix	trans	-60.8	-42.9	179.4	-65.7	170.7	0	0	0	111	I652 G660 A694	I652-I656 HydrophobicContact CG2-CD1 3.77Å; I652-I656 HydrophobicContact CG2-CG1 4.44Å; I652-I656 WeakPolarHBondContact O-CG1 3.4Å; I652-I656 PolarHBondContact O-N 3.38Å; I656-G660 PolarHBondContact O-N 3.36Å; I656-A694 HydrophobicContact CB-CB 3.95Å; I656-A694 HydrophobicContact CG2-CB 3.64Å
657	F	94.3	Very high	90.3	Very high	49 Å²	49	77.3 Å²	77.3	22%	0.215	40%	0.397	C	S	.	.	H	α-helix	trans	-62.2	-49.5	180	175.6	-115.8	0	0	0	112.4	S653 N654 I655 G660 L661 T691 A694 V698	S653-F657 VanDerWaalsContact O-CB 3.28Å; S653-F657 WeakPolarHBondContact O-CB 3.39Å; S653-F657 PolarHBondContact O-N 3.26Å; N654-F657 PolarHBondContact O-N 3.06Å; I655-F657 VanDerWaalsContact C-N 3.33Å; I655-F657 PolarHBondContact O-N 3.04Å; F657-G660 PolarHBondContact O-N 2.94Å; F657-L661 HydrophobicContact CZ-CD1 4.25Å; F657-L661 WeakPolarHBondContact O-CB 3.25Å; F657-L661 PolarHBondContact O-N 3.22Å; F657-T691 HydrophobicContact CD2-CG2 4Å; F657-T691 WeakPolarHBondContact CD2-O 3.45Å; F657-T691 HydrophobicContact CE2-CG2 4.28Å; F657-A694 HydrophobicContact CB-CB 4Å; F657-V698 HydrophobicContact CB-CG2 3.9Å; F657-V698 HydrophobicContact CD1-CG2 4.39Å; F657-V698 HydrophobicContact CG-CG2 4.31Å
658	H	92.3	Very high	91.4	Very high	80 Å²	80	77.1 Å²	77.1	37%	0.37	39%	0.388	S	S	.	.	H	α-helix	trans	-72.1	-39.2	-177.9	-67.7	78.3	0	0	0	111.9	F648 N654 I655 G660 L661 I662	F648-H658 AromaticContact CE2-CE1 3.73Å; F648-H658 AromaticContact CE2-ND1 3.69Å; N654-H658 PolarHBondContact O-N 3.35Å; N654-H658 PolarHBondContact O-ND1 3.37Å; I655-H658 PolarHBondContact O-N 3.03Å; H658-G660 VanDerWaalsContact C-N 3.3Å; H658-G660 PolarHBondContact O-N 2.88Å; H658-L661 PolarHBondContact O-N 3.46Å; H658-I662 VanDerWaalsContact O-CG1 3.28Å; H658-I662 WeakPolarHBondContact O-CG1 3.39Å; H658-I662 PolarHBondContact O-N 2.86Å
659	A	95	Very high	92.4	Very high	50 Å²	50	79.6 Å²	79.6	41%	0.413	40%	0.399	S	S	.	.	H	α-helix	trans	-62	-40.2	173.3	0	0	0	0	0	111.6	I655 S663	I655-A659 WeakPolarHBondContact O-CB 3.36Å; I655-A659 PolarHBondContact O-N 3.4Å; A659-S663 WeakPolarHBondContact O-CB 3.45Å; A659-S663 PolarHBondContact O-N 3.32Å; A659-S663 PolarHBondContact O-OG 2.93Å
660	G	96.3	Very high	93.3	Very high	9 Å²	9	73.4 Å²	73.4	9%	0.093	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-45.9	174.4	0	0	0	0	0	112.7	I656 F657 H658 S663 I664 T691	I656-G660 PolarHBondContact O-N 3.36Å; F657-G660 PolarHBondContact O-N 2.94Å; H658-G660 VanDerWaalsContact C-N 3.3Å; H658-G660 PolarHBondContact O-N 2.88Å; G660-S663 WeakPolarHBondContact O-CB 3.37Å; G660-S663 PolarHBondContact O-N 2.72Å; G660-I664 WeakPolarHBondContact O-CG1 3.46Å; G660-I664 PolarHBondContact O-N 3.48Å; G660-T691 WeakPolarHBondContact CA-OG1 2.95Å
661	L	95.4	Very high	94	Very high	86 Å²	86	69 Å²	69	45%	0.45	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-43.2	176.9	-168.3	132.4	0	0	0	112.2	F657 H658 S663 I664 C665	F657-L661 HydrophobicContact CZ-CD1 4.25Å; F657-L661 WeakPolarHBondContact O-CB 3.25Å; F657-L661 PolarHBondContact O-N 3.22Å; H658-L661 PolarHBondContact O-N 3.46Å; L661-S663 VanDerWaalsContact C-N 3.31Å; L661-S663 PolarHBondContact O-N 2.86Å; L661-I664 PolarHBondContact O-N 3.37Å; L661-C665 PolarHBondContact O-N 2.57Å; L661-C665 PolarHBondContact O-SG 2.89Å; L661-C665 VanDerWaalsContact O-SG 3.35Å
662	I	96.9	Very high	94.3	Very high	115 Å²	115	77.2 Å²	77.2	59%	0.59	38%	0.375	S	S	*	.	H	α-helix	trans	-59.6	-43.1	173	-69.1	165.4	0	0	0	110.7	H658 I664 C665 Y666	H658-I662 VanDerWaalsContact O-CG1 3.28Å; H658-I662 WeakPolarHBondContact O-CG1 3.39Å; H658-I662 PolarHBondContact O-N 2.86Å; I662-I664 PolarHBondContact O-N 3.46Å; I662-C665 PolarHBondContact O-N 2.67Å; I662-Y666 WeakPolarHBondContact O-CB 3.48Å; I662-Y666 PolarHBondContact O-N 3.28Å
663	S	97.4	Very high	94.5	Very high	48 Å²	48	74.6 Å²	74.6	34%	0.336	37%	0.369	S	S	.	.	H	α-helix	trans	-64.5	-38.5	178.8	-58.1	0	0	0	0	112.2	A659 G660 L661 Y666 L667	A659-S663 WeakPolarHBondContact O-CB 3.45Å; A659-S663 PolarHBondContact O-N 3.32Å; A659-S663 PolarHBondContact O-OG 2.93Å; G660-S663 WeakPolarHBondContact O-CB 3.37Å; G660-S663 PolarHBondContact O-N 2.72Å; L661-S663 VanDerWaalsContact C-N 3.31Å; L661-S663 PolarHBondContact O-N 2.86Å; S663-Y666 PolarHBondContact O-N 3.25Å; S663-L667 WeakPolarHBondContact O-CB 3.46Å; S663-L667 PolarHBondContact O-N 3.43Å
664	I	97.5	Very high	94.7	Very high	31 Å²	31	83.2 Å²	83.2	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-67.6	-43.8	175.1	-68.5	168	0	0	0	110.7	G660 L661 I662 Y666 L667 Y668 L684 L687 T691	G660-I664 WeakPolarHBondContact O-CG1 3.46Å; G660-I664 PolarHBondContact O-N 3.48Å; L661-I664 PolarHBondContact O-N 3.37Å; I662-I664 PolarHBondContact O-N 3.46Å; I664-Y666 VanDerWaalsContact C-N 3.32Å; I664-Y666 PolarHBondContact O-N 3.19Å; I664-L667 WeakPolarHBondContact O-CB 3.36Å; I664-L667 PolarHBondContact O-N 2.94Å; I664-Y668 HydrophobicContact CG2-CD2 3.96Å; I664-Y668 HydrophobicContact CG2-CE2 3.72Å; I664-Y668 WeakPolarHBondContact O-CD2 3.24Å; I664-Y668 PolarHBondContact O-N 2.93Å; I664-L684 HydrophobicContact CD1-CD1 4.42Å; I664-L684 HydrophobicContact CG1-CD1 4.08Å; I664-L684 HydrophobicContact CG2-CD1 3.85Å; I664-L687 HydrophobicContact CG1-CB 4.05Å; I664-T691 HydrophobicContact CD1-CG2 4.04Å
665	C	96.6	Very high	94.9	Very high	74 Å²	74	83.9 Å²	83.9	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-42.6	174.5	-71	0	0	0	0	111.8	L661 I662 Y668 F669	L661-C665 PolarHBondContact O-N 2.57Å; L661-C665 PolarHBondContact O-SG 2.89Å; L661-C665 VanDerWaalsContact O-SG 3.35Å; I662-C665 PolarHBondContact O-N 2.67Å; C665-Y668 PolarHBondContact O-N 3.41Å; C665-F669 PolarHBondContact O-N 3.39Å; C665-F669 VanDerWaalsContact O-N 3.09Å
666	Y	96.9	Very high	95	Very high	147 Å²	147	83.4 Å²	83.4	58%	0.576	40%	0.4	S	S	*	.	H	α-helix	trans	-63	-44.9	174.2	-177.8	-105.2	0	0	0	111.2	I662 S663 I664 Y668 F669 V670	I662-Y666 WeakPolarHBondContact O-CB 3.48Å; I662-Y666 PolarHBondContact O-N 3.28Å; S663-Y666 PolarHBondContact O-N 3.25Å; I664-Y666 VanDerWaalsContact C-N 3.32Å; I664-Y666 PolarHBondContact O-N 3.19Å; Y666-Y668 VanDerWaalsContact C-N 3.28Å; Y666-Y668 PolarHBondContact O-N 2.84Å; Y666-F669 HydrophobicContact CE2-CD1 4.49Å; Y666-F669 WeakPolarHBondContact O-CA 3.36Å; Y666-F669 WeakPolarHBondContact O-CB 3.21Å; Y666-F669 PolarHBondContact O-N 3.38Å; Y666-V670 HydrophobicContact CD1-CG2 3.89Å; Y666-V670 HydrophobicContact CD2-CG2 4.45Å; Y666-V670 HydrophobicContact CE1-CG2 3.48Å; Y666-V670 VanDerWaalsContact CE1-CG2 3.48Å; Y666-V670 HydrophobicContact CE2-CG2 4.09Å; Y666-V670 HydrophobicContact CG-CG2 4.36Å; Y666-V670 WeakPolarHBondContact O-CG2 3.5Å; Y666-V670 PolarHBondContact O-N 2.9Å
667	L	97.3	Very high	94.9	Very high	15 Å²	15	84.4 Å²	84.4	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-57.1	-41.6	175.9	179.3	64.2	0	0	0	111.9	S663 I664 F669 V670 Y671 L675 T680 Y683 L684 L687	S663-L667 WeakPolarHBondContact O-CB 3.46Å; S663-L667 PolarHBondContact O-N 3.43Å; I664-L667 WeakPolarHBondContact O-CB 3.36Å; I664-L667 PolarHBondContact O-N 2.94Å; L667-F669 VanDerWaalsContact C-N 3.34Å; L667-F669 PolarHBondContact O-N 3.37Å; L667-V670 PolarHBondContact O-N 3.02Å; L667-Y671 WeakPolarHBondContact O-CB 3.34Å; L667-Y671 PolarHBondContact O-N 3.28Å; L667-L675 HydrophobicContact CD1-CD2 4.24Å; L667-T680 HydrophobicContact CD1-CG2 4.49Å; L667-T680 HydrophobicContact CD2-CG2 4.4Å; L667-T680 HydrophobicContact CG-CG2 4.2Å; L667-Y683 HydrophobicContact CD1-CD2 4Å; L667-Y683 HydrophobicContact CD1-CG 4.39Å; L667-L684 HydrophobicContact CD2-CB 3.9Å; L667-L684 HydrophobicContact CD2-CD1 4.45Å; L667-L687 HydrophobicContact CB-CD1 4.35Å; L667-L687 HydrophobicContact CD2-CD1 4.11Å
668	Y	94.7	Very high	95	Very high	123 Å²	123	89.5 Å²	89.5	48%	0.482	43%	0.426	S	S	.	.	H	α-helix	trans	-61.3	-41.1	173.7	-82.4	-55.6	0	0	0	112.7	I664 C665 Y666 Y671 W672	I664-Y668 HydrophobicContact CG2-CD2 3.96Å; I664-Y668 HydrophobicContact CG2-CE2 3.72Å; I664-Y668 WeakPolarHBondContact O-CD2 3.24Å; I664-Y668 PolarHBondContact O-N 2.93Å; C665-Y668 PolarHBondContact O-N 3.41Å; Y666-Y668 VanDerWaalsContact C-N 3.28Å; Y666-Y668 PolarHBondContact O-N 2.84Å; Y668-Y671 WeakPolarHBondContact O-CB 3.44Å; Y668-Y671 PolarHBondContact O-N 3.18Å; Y668-W672 PolarHBondContact O-N 2.74Å; Y668-W672 VanDerWaalsContact O-N 3.1Å
669	F	95.1	Very high	95	Very high	130 Å²	130	88 Å²	88	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-61.7	-46.5	174.1	174.7	-99.3	0	0	0	111.5	C665 Y666 L667 Y671 W672 C673	C665-F669 PolarHBondContact O-N 3.39Å; C665-F669 VanDerWaalsContact O-N 3.09Å; Y666-F669 HydrophobicContact CE2-CD1 4.49Å; Y666-F669 WeakPolarHBondContact O-CA 3.36Å; Y666-F669 WeakPolarHBondContact O-CB 3.21Å; Y666-F669 PolarHBondContact O-N 3.38Å; L667-F669 VanDerWaalsContact C-N 3.34Å; L667-F669 PolarHBondContact O-N 3.37Å; F669-Y671 VanDerWaalsContact C-N 3.3Å; F669-Y671 PolarHBondContact O-N 2.93Å; F669-W672 PolarHBondContact O-N 2.93Å; F669-C673 PolarHBondContact O-N 2.86Å; F669-C673 PolarHBondContact O-SG 2.65Å; F669-C673 VanDerWaalsContact O-SG 3.39Å
670	V	95.9	Very high	95.1	Very high	10 Å²	10	86 Å²	86	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-66.9	-32.5	179	-164.5	0	0	0	0	111.6	Y666 L667 C673 R674 L675	Y666-V670 HydrophobicContact CD1-CG2 3.89Å; Y666-V670 HydrophobicContact CD2-CG2 4.45Å; Y666-V670 HydrophobicContact CE1-CG2 3.48Å; Y666-V670 VanDerWaalsContact CE1-CG2 3.48Å; Y666-V670 HydrophobicContact CE2-CG2 4.09Å; Y666-V670 HydrophobicContact CG-CG2 4.36Å; Y666-V670 WeakPolarHBondContact O-CG2 3.5Å; Y666-V670 PolarHBondContact O-N 2.9Å; L667-V670 PolarHBondContact O-N 3.02Å; V670-C673 PolarHBondContact O-N 3.47Å; V670-R674 HydrophobicContact CG1-CG 3.82Å; V670-R674 VanDerWaalsContact CG1-NE 3.3Å; V670-R674 PolarHBondContact O-N 3.28Å; V670-L675 HydrophobicContact CB-CD1 3.82Å; V670-L675 HydrophobicContact CG1-CD1 3.2Å; V670-L675 PolarHBondContact O-N 3.1Å
671	Y	96	Very high	95.1	Very high	93 Å²	93	90.2 Å²	90.2	37%	0.365	43%	0.425	S	S	.	.	H	α-helix	trans	-56.5	-51.1	169.4	166.8	-110.1	0	0	0	111.9	L667 Y668 F669 C673 R674 L675 T680	L667-Y671 WeakPolarHBondContact O-CB 3.34Å; L667-Y671 PolarHBondContact O-N 3.28Å; Y668-Y671 WeakPolarHBondContact O-CB 3.44Å; Y668-Y671 PolarHBondContact O-N 3.18Å; F669-Y671 VanDerWaalsContact C-N 3.3Å; F669-Y671 PolarHBondContact O-N 2.93Å; Y671-C673 PolarHBondContact O-N 3.44Å; Y671-R674 PolarHBondContact O-N 3.32Å; Y671-L675 WeakPolarHBondContact CD2-O 3.47Å; Y671-L675 PolarHBondContact O-N 2.92Å; Y671-T680 HydrophobicContact CD2-CG2 4.13Å; Y671-T680 VanDerWaalsContact CD2-OG1 3.24Å; Y671-T680 WeakPolarHBondContact CD2-OG1 3.31Å; Y671-T680 HydrophobicContact CG-CG2 4.08Å
672	W	91.6	Very high	95	Very high	218 Å²	218	92.7 Å²	92.7	83%	0.826	43%	0.432	S	S	*	.	H	α-helix	trans	-61.4	-30.5	176.2	-87	98.4	0	0	0	113.7	Y668 F669	Y668-W672 PolarHBondContact O-N 2.74Å; Y668-W672 VanDerWaalsContact O-N 3.1Å; F669-W672 PolarHBondContact O-N 2.93Å
673	C	93.5	Very high	95	Very high	81 Å²	81	92.6 Å²	92.6	55%	0.547	43%	0.425	S	S	.	.	H	α-helix	trans	-82.8	-40.1	179.4	-65.9	0	0	0	0	114.1	F669 V670 Y671	F669-C673 PolarHBondContact O-N 2.86Å; F669-C673 PolarHBondContact O-SG 2.65Å; F669-C673 VanDerWaalsContact O-SG 3.39Å; V670-C673 PolarHBondContact O-N 3.47Å; Y671-C673 PolarHBondContact O-N 3.44Å
674	R	93.4	Very high	95	Very high	200 Å²	200	92.6 Å²	92.6	76%	0.755	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-162.8	-8.8	-165.8	65.7	-177.8	-179.5	134.6	-0.2	118.7	V670 Y671	V670-R674 HydrophobicContact CG1-CG 3.82Å; V670-R674 VanDerWaalsContact CG1-NE 3.3Å; V670-R674 PolarHBondContact O-N 3.28Å; Y671-R674 PolarHBondContact O-N 3.32Å
675	L	92.3	Very high	94.9	Very high	32 Å²	32	95.1 Å²	95.1	17%	0.168	44%	0.442	C	S	.	.			trans	-91.5	148.5	179.2	-79.5	81.8	0	0	0	112.2	L667 V670 Y671 T679 T680 Y683	L667-L675 HydrophobicContact CD1-CD2 4.24Å; V670-L675 HydrophobicContact CB-CD1 3.82Å; V670-L675 HydrophobicContact CG1-CD1 3.2Å; V670-L675 PolarHBondContact O-N 3.1Å; Y671-L675 WeakPolarHBondContact CD2-O 3.47Å; Y671-L675 PolarHBondContact O-N 2.92Å; L675-T679 HydrophobicContact CD2-CG2 3.8Å; L675-T679 HydrophobicContact CG-CG2 4.47Å; L675-T680 VanDerWaalsContact CB-OG1 3.28Å; L675-T680 WeakPolarHBondContact CB-OG1 3.42Å; L675-Y683 HydrophobicContact CD2-CD2 3.62Å; L675-Y683 HydrophobicContact CD2-CE2 3.7Å
676	D	93.9	Very high	94.8	Very high	80 Å²	80	96.9 Å²	96.9	43%	0.428	45%	0.445	S	S	.	.			trans	-76.2	164.5	162.2	70.6	83.2	0	0	0	112.3	F678 T679 T680	D676-F678 PolarHBondContact O-N 3.11Å; D676-F678 WeakPolarHBondContact OD1-CA 2.98Å; D676-F678 PolarHBondContact OD1-N 3.46Å; D676-T679 VanDerWaalsContact CG-OG1 3.27Å; D676-T679 PolarHBondContact OD1-N 3.06Å; D676-T679 PolarHBondContact OD1-OG1 3.39Å; D676-T679 VanDerWaalsContact OD2-CB 3.3Å; D676-T679 WeakPolarHBondContact OD2-CB 3.39Å; D676-T679 PolarHBondContact OD2-OG1 3.47Å; D676-T680 WeakPolarHBondContact O-CB 3.28Å; D676-T680 PolarHBondContact O-N 3.47Å; D676-T680 VanDerWaalsContact O-N 3.09Å; D676-T680 PolarHBondContact O-OG1 3.46Å
677	M	91.3	Very high	94.8	Very high	101 Å²	101	92.5 Å²	92.5	50%	0.498	43%	0.431	S	S	.	.	H	α-helix	trans	-60.3	-42.3	-177.1	-178.7	-178.8	70.9	0	0	113	T680 L681	M677-T680 PolarHBondContact O-N 2.96Å; M677-L681 HydrophobicContact CG-CD1 3.98Å; M677-L681 VanDerWaalsContact O-CD1 3.26Å; M677-L681 WeakPolarHBondContact O-CD1 3.16Å; M677-L681 PolarHBondContact O-N 3.38Å
678	F	94.7	Very high	94.7	Very high	156 Å²	156	92.8 Å²	92.8	68%	0.684	44%	0.438	S	S	*	.	H	α-helix	trans	-74.3	-41.1	-173.3	-66	-67.9	0	0	0	111.8	D676 T680 L681 K682	D676-F678 PolarHBondContact O-N 3.11Å; D676-F678 WeakPolarHBondContact OD1-CA 2.98Å; D676-F678 PolarHBondContact OD1-N 3.46Å; F678-T680 VanDerWaalsContact C-N 3.28Å; F678-T680 PolarHBondContact O-N 3.39Å; F678-L681 PolarHBondContact O-N 2.85Å; F678-K682 PolarHBondContact O-N 2.86Å
679	T	94	Very high	94.7	Very high	48 Å²	48	92.3 Å²	92.3	29%	0.294	44%	0.443	S	S	.	.	H	α-helix	trans	-62.7	-39.9	173.7	-55.9	0	0	0	0	110.6	L675 D676 K682 Y683	L675-T679 HydrophobicContact CD2-CG2 3.8Å; L675-T679 HydrophobicContact CG-CG2 4.47Å; D676-T679 VanDerWaalsContact CG-OG1 3.27Å; D676-T679 PolarHBondContact OD1-N 3.06Å; D676-T679 PolarHBondContact OD1-OG1 3.39Å; D676-T679 VanDerWaalsContact OD2-CB 3.3Å; D676-T679 WeakPolarHBondContact OD2-CB 3.39Å; D676-T679 PolarHBondContact OD2-OG1 3.47Å; T679-K682 PolarHBondContact O-N 2.91Å; T679-Y683 HydrophobicContact CG2-CD2 4.11Å; T679-Y683 HydrophobicContact CG2-CE2 3.51Å; T679-Y683 WeakPolarHBondContact O-CD2 3.29Å; T679-Y683 PolarHBondContact O-N 3.39Å; T679-Y683 VanDerWaalsContact O-N 3.16Å
680	T	96	Very high	94.6	Very high	9 Å²	9	89.3 Å²	89.3	6%	0.055	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-46.4	175.3	-57.7	0	0	0	0	111.4	L667 Y671 L675 D676 M677 F678 K682 Y683 L684	L667-T680 HydrophobicContact CD1-CG2 4.49Å; L667-T680 HydrophobicContact CD2-CG2 4.4Å; L667-T680 HydrophobicContact CG-CG2 4.2Å; Y671-T680 HydrophobicContact CD2-CG2 4.13Å; Y671-T680 VanDerWaalsContact CD2-OG1 3.24Å; Y671-T680 WeakPolarHBondContact CD2-OG1 3.31Å; Y671-T680 HydrophobicContact CG-CG2 4.08Å; L675-T680 VanDerWaalsContact CB-OG1 3.28Å; L675-T680 WeakPolarHBondContact CB-OG1 3.42Å; D676-T680 WeakPolarHBondContact O-CB 3.28Å; D676-T680 PolarHBondContact O-N 3.47Å; D676-T680 VanDerWaalsContact O-N 3.09Å; D676-T680 PolarHBondContact O-OG1 3.46Å; M677-T680 PolarHBondContact O-N 2.96Å; F678-T680 VanDerWaalsContact C-N 3.28Å; F678-T680 PolarHBondContact O-N 3.39Å; T680-K682 VanDerWaalsContact C-N 3.3Å; T680-K682 PolarHBondContact O-N 2.97Å; T680-Y683 PolarHBondContact O-N 2.93Å; T680-L684 VanDerWaalsContact O-CB 3.27Å; T680-L684 WeakPolarHBondContact O-CB 3.36Å; T680-L684 PolarHBondContact O-N 3.39Å
681	L	95.9	Very high	94.6	Very high	97 Å²	97	89.4 Å²	89.4	51%	0.508	44%	0.438	S	S	.	.	H	α-helix	trans	-59.5	-39.5	176.7	-103.7	79	0	0	0	112.5	M677 F678 L684 S685	M677-L681 HydrophobicContact CG-CD1 3.98Å; M677-L681 VanDerWaalsContact O-CD1 3.26Å; M677-L681 WeakPolarHBondContact O-CD1 3.16Å; M677-L681 PolarHBondContact O-N 3.38Å; F678-L681 PolarHBondContact O-N 2.85Å; L681-L684 PolarHBondContact O-N 3.05Å; L681-S685 PolarHBondContact O-N 3.41Å; L681-S685 PolarHBondContact O-OG 3.44Å
682	K	95	Very high	94.6	Very high	138 Å²	138	91.9 Å²	91.9	60%	0.6	45%	0.451	S	S	*	.	H	α-helix	trans	-60.8	-49.8	176.8	-178.7	-178.9	175.9	-179	0	111.5	F678 T679 T680 L684 S685 I686	F678-K682 PolarHBondContact O-N 2.86Å; T679-K682 PolarHBondContact O-N 2.91Å; T680-K682 VanDerWaalsContact C-N 3.3Å; T680-K682 PolarHBondContact O-N 2.97Å; K682-L684 VanDerWaalsContact C-N 3.35Å; K682-S685 PolarHBondContact O-N 2.96Å; K682-I686 PolarHBondContact O-N 2.93Å
683	Y	96.7	Very high	94.7	Very high	113 Å²	113	86.1 Å²	86.1	44%	0.443	44%	0.435	S	S	.	.	H	α-helix	trans	-66.8	-37.8	177.2	-63.8	-40.6	0	0	0	112.2	L667 L675 T679 T680 S685 I686 L687	L667-Y683 HydrophobicContact CD1-CD2 4Å; L667-Y683 HydrophobicContact CD1-CG 4.39Å; L675-Y683 HydrophobicContact CD2-CD2 3.62Å; L675-Y683 HydrophobicContact CD2-CE2 3.7Å; T679-Y683 HydrophobicContact CG2-CD2 4.11Å; T679-Y683 HydrophobicContact CG2-CE2 3.51Å; T679-Y683 WeakPolarHBondContact O-CD2 3.29Å; T679-Y683 PolarHBondContact O-N 3.39Å; T679-Y683 VanDerWaalsContact O-N 3.16Å; T680-Y683 PolarHBondContact O-N 2.93Å; Y683-S685 VanDerWaalsContact C-N 3.29Å; Y683-S685 PolarHBondContact O-N 3.23Å; Y683-I686 PolarHBondContact O-N 2.94Å; Y683-L687 WeakPolarHBondContact O-CG 3.47Å; Y683-L687 PolarHBondContact O-N 3.47Å
684	L	97.1	Very high	94.7	Very high	48 Å²	48	82.6 Å²	82.6	25%	0.251	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-35.7	176.6	-176.1	62.6	0	0	0	111.8	I664 L667 T680 L681 K682 I686 G688	I664-L684 HydrophobicContact CD1-CD1 4.42Å; I664-L684 HydrophobicContact CG1-CD1 4.08Å; I664-L684 HydrophobicContact CG2-CD1 3.85Å; L667-L684 HydrophobicContact CD2-CB 3.9Å; L667-L684 HydrophobicContact CD2-CD1 4.45Å; T680-L684 VanDerWaalsContact O-CB 3.27Å; T680-L684 WeakPolarHBondContact O-CB 3.36Å; T680-L684 PolarHBondContact O-N 3.39Å; L681-L684 PolarHBondContact O-N 3.05Å; K682-L684 VanDerWaalsContact C-N 3.35Å; L684-I686 VanDerWaalsContact C-N 3.35Å; L684-G688 VanDerWaalsContact O-CA 3.25Å; L684-G688 WeakPolarHBondContact O-CA 3.42Å; L684-G688 PolarHBondContact O-N 3.31Å
685	S	94.2	Very high	94.7	Very high	85 Å²	85	73.2 Å²	73.2	59%	0.594	38%	0.378	S	S	*	.	H	α-helix	trans	-64.1	-40.6	174.9	-67.1	0	0	0	0	112.2	L681 K682 Y683 L689	L681-S685 PolarHBondContact O-N 3.41Å; L681-S685 PolarHBondContact O-OG 3.44Å; K682-S685 PolarHBondContact O-N 2.96Å; Y683-S685 VanDerWaalsContact C-N 3.29Å; Y683-S685 PolarHBondContact O-N 3.23Å; S685-L689 PolarHBondContact O-N 3.36Å
686	I	95.5	Very high	94.8	Very high	111 Å²	111	75.9 Å²	75.9	57%	0.569	39%	0.389	S	S	*	.	H	α-helix	trans	-69.9	-44.6	179.1	-62.4	169.3	0	0	0	111.1	K682 Y683 L684 P690	K682-I686 PolarHBondContact O-N 2.93Å; Y683-I686 PolarHBondContact O-N 2.94Å; L684-I686 VanDerWaalsContact C-N 3.35Å; I686-P690 WeakPolarHBondContact O-CD 3.2Å
687	L	95.9	Very high	94.5	Very high	54 Å²	54	80.7 Å²	80.7	28%	0.283	40%	0.402	S	S	.	.	H	α-helix	trans	-74.2	-34.9	179.1	-67.1	175.9	0	0	0	112.3	I664 L667 Y683 T691	I664-L687 HydrophobicContact CG1-CB 4.05Å; L667-L687 HydrophobicContact CB-CD1 4.35Å; L667-L687 HydrophobicContact CD2-CD1 4.11Å; Y683-L687 WeakPolarHBondContact O-CG 3.47Å; Y683-L687 PolarHBondContact O-N 3.47Å; L687-T691 WeakPolarHBondContact O-CB 3.35Å; L687-T691 PolarHBondContact O-N 3Å; L687-T691 PolarHBondContact O-OG1 3.4Å
688	G	96.3	Very high	94.4	Very high	22 Å²	22	76.2 Å²	76.2	23%	0.227	38%	0.38	C	S	.	.	H	α-helix	trans	-67.7	-41.7	-173.6	0	0	0	0	0	112.9	L684 T691 F692	L684-G688 VanDerWaalsContact O-CA 3.25Å; L684-G688 WeakPolarHBondContact O-CA 3.42Å; L684-G688 PolarHBondContact O-N 3.31Å; G688-T691 PolarHBondContact O-N 3.41Å; G688-F692 VanDerWaalsContact O-CB 3.24Å; G688-F692 WeakPolarHBondContact O-CB 3.47Å; G688-F692 PolarHBondContact O-N 3.45Å
689	L	94	Very high	94.1	Very high	112 Å²	112	73.6 Å²	73.6	59%	0.586	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-50.7	-175.4	-177.6	69.9	0	0	0	113.3	S685 T691 F692 L693	S685-L689 PolarHBondContact O-N 3.36Å; L689-T691 VanDerWaalsContact C-N 3.35Å; L689-T691 PolarHBondContact O-N 3.02Å; L689-F692 PolarHBondContact O-N 3.02Å; L689-L693 WeakPolarHBondContact O-CG 3.09Å; L689-L693 PolarHBondContact O-N 3.23Å; L689-L693 VanDerWaalsContact O-N 3.11Å
690	P	93.6	Very high	93.9	Very high	67 Å²	67	78.7 Å²	78.7	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-40.6	174.8	-21.3	33.1	0	0	0	112.6	I686 F692 L693 A694	I686-P690 WeakPolarHBondContact O-CD 3.2Å; P690-F692 VanDerWaalsContact C-N 3.33Å; P690-F692 PolarHBondContact O-N 3.32Å; P690-L693 PolarHBondContact O-N 3.45Å; P690-A694 VanDerWaalsContact O-CB 3.29Å; P690-A694 WeakPolarHBondContact O-CB 3.3Å; P690-A694 PolarHBondContact O-N 3.25Å
691	T	96.4	Very high	93.4	Very high	13 Å²	13	81.1 Å²	81.1	8%	0.08	41%	0.408	C	S	.	.	H	α-helix	trans	-61.4	-43.2	178.8	-54.1	0	0	0	0	110.9	F657 G660 I664 L687 G688 L689 G695	F657-T691 HydrophobicContact CD2-CG2 4Å; F657-T691 WeakPolarHBondContact CD2-O 3.45Å; F657-T691 HydrophobicContact CE2-CG2 4.28Å; G660-T691 WeakPolarHBondContact CA-OG1 2.95Å; I664-T691 HydrophobicContact CD1-CG2 4.04Å; L687-T691 WeakPolarHBondContact O-CB 3.35Å; L687-T691 PolarHBondContact O-N 3Å; L687-T691 PolarHBondContact O-OG1 3.4Å; G688-T691 PolarHBondContact O-N 3.41Å; L689-T691 VanDerWaalsContact C-N 3.35Å; L689-T691 PolarHBondContact O-N 3.02Å; T691-G695 PolarHBondContact O-N 2.78Å
692	F	95.8	Very high	92.8	Very high	144 Å²	144	81.6 Å²	81.6	63%	0.632	41%	0.407	S	S	*	.	H	α-helix	trans	-62.2	-49.8	176.8	173.4	-102.5	0	0	0	112.2	G688 L689 P690 A694 G695 H696	G688-F692 VanDerWaalsContact O-CB 3.24Å; G688-F692 WeakPolarHBondContact O-CB 3.47Å; G688-F692 PolarHBondContact O-N 3.45Å; L689-F692 PolarHBondContact O-N 3.02Å; P690-F692 VanDerWaalsContact C-N 3.33Å; P690-F692 PolarHBondContact O-N 3.32Å; F692-A694 PolarHBondContact O-N 3.08Å; F692-G695 PolarHBondContact O-N 3.03Å; F692-H696 PolarHBondContact O-N 3.1Å
693	L	94.5	Very high	92.4	Very high	97 Å²	97	78.9 Å²	78.9	51%	0.508	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-42.2	-179.6	-68	175.8	0	0	0	112.2	L689 P690 R697	L689-L693 WeakPolarHBondContact O-CG 3.09Å; L689-L693 PolarHBondContact O-N 3.23Å; L689-L693 VanDerWaalsContact O-N 3.11Å; P690-L693 PolarHBondContact O-N 3.45Å; L693-R697 PolarHBondContact O-N 3.1Å
694	A	93.5	Very high	91.8	Very high	7 Å²	7	77.7 Å²	77.7	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-64.7	-46.3	175.4	0	0	0	0	0	110.9	S653 I656 F657 P690 F692 H696 R697 V698	S653-A694 PolarHBondContact OG-O 3.33Å; I656-A694 HydrophobicContact CB-CB 3.95Å; I656-A694 HydrophobicContact CG2-CB 3.64Å; F657-A694 HydrophobicContact CB-CB 4Å; P690-A694 VanDerWaalsContact O-CB 3.29Å; P690-A694 WeakPolarHBondContact O-CB 3.3Å; P690-A694 PolarHBondContact O-N 3.25Å; F692-A694 PolarHBondContact O-N 3.08Å; A694-H696 VanDerWaalsContact C-N 3.34Å; A694-H696 PolarHBondContact O-N 3.06Å; A694-R697 WeakPolarHBondContact O-CB 3.46Å; A694-R697 PolarHBondContact O-N 3.27Å; A694-R697 VanDerWaalsContact O-N 3.1Å; A694-V698 VanDerWaalsContact O-CG2 3.3Å; A694-V698 WeakPolarHBondContact O-CG2 3.32Å; A694-V698 PolarHBondContact O-N 3.41Å
695	G	93.1	Very high	91.1	Very high	4 Å²	4	76.5 Å²	76.5	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-58	-43.4	178.1	0	0	0	0	0	113	T691 F692 R697 V698 L699	T691-G695 PolarHBondContact O-N 2.78Å; F692-G695 PolarHBondContact O-N 3.03Å; G695-R697 VanDerWaalsContact C-N 3.31Å; G695-R697 PolarHBondContact O-N 3.03Å; G695-V698 PolarHBondContact O-N 3.05Å; G695-L699 WeakPolarHBondContact O-CG 3.2Å; G695-L699 PolarHBondContact O-N 3.33Å
696	H	92.7	Very high	90.4	Very high	87 Å²	87	79.6 Å²	79.6	40%	0.403	40%	0.402	S	S	.	.	H	α-helix	trans	-59.1	-40.9	175.3	175.3	-104.6	0	0	0	112.4	F692 A694 R700	F692-H696 PolarHBondContact O-N 3.1Å; A694-H696 VanDerWaalsContact C-N 3.34Å; A694-H696 PolarHBondContact O-N 3.06Å; H696-R700 PolarHBondContact CE1-NE 2.73Å; H696-R700 PolarHBondContact CE1-NH2 3.05Å; H696-R700 PolarHBondContact NE2-NE 2.87Å; H696-R700 PolarHBondContact NE2-NH2 3.22Å; H696-R700 WeakPolarHBondContact O-CB 3.45Å; H696-R700 WeakPolarHBondContact O-CG 3.46Å; H696-R700 PolarHBondContact O-N 3.45Å
697	R	89.5	Confident	89.8	Confident	181 Å²	181	79.8 Å²	79.8	68%	0.683	40%	0.401	S	S	*	.	H	α-helix	trans	-68.2	-42.2	175.6	-75.7	-179.6	179.3	-179.9	0.3	112.4	S653 L693 A694 G695 R700 A701	S653-R697 WeakPolarHBondContact OG-CB 3.28Å; L693-R697 PolarHBondContact O-N 3.1Å; A694-R697 WeakPolarHBondContact O-CB 3.46Å; A694-R697 PolarHBondContact O-N 3.27Å; A694-R697 VanDerWaalsContact O-N 3.1Å; G695-R697 VanDerWaalsContact C-N 3.31Å; G695-R697 PolarHBondContact O-N 3.03Å; R697-R700 PolarHBondContact O-N 3.29Å; R697-A701 WeakPolarHBondContact O-CB 3.35Å; R697-A701 PolarHBondContact O-N 2.98Å
698	V	89.2	Confident	88.9	Confident	8 Å²	8	83.3 Å²	83.3	5%	0.048	42%	0.415	C	S	.	.	H	α-helix	trans	-57.8	-50.8	176.3	172.5	0	0	0	0	110.9	S653 N654 F657 A694 G695 A701 Q702	S653-V698 WeakPolarHBondContact O-CG2 3.46Å; N654-V698 HydrophobicContact CB-CG2 4.45Å; N654-V698 WeakPolarHBondContact OD1-CB 3.44Å; N654-V698 WeakPolarHBondContact OD1-CG1 3.45Å; N654-V698 WeakPolarHBondContact OD1-CG2 3.43Å; F657-V698 HydrophobicContact CB-CG2 3.9Å; F657-V698 HydrophobicContact CD1-CG2 4.39Å; F657-V698 HydrophobicContact CG-CG2 4.31Å; A694-V698 VanDerWaalsContact O-CG2 3.3Å; A694-V698 WeakPolarHBondContact O-CG2 3.32Å; A694-V698 PolarHBondContact O-N 3.41Å; G695-V698 PolarHBondContact O-N 3.05Å; V698-A701 PolarHBondContact O-N 3.23Å; V698-Q702 PolarHBondContact O-N 3.08Å; V698-Q702 VanDerWaalsContact O-N 3.1Å
699	L	87.8	Confident	87.8	Confident	101 Å²	101	88.8 Å²	88.8	53%	0.529	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-41.5	-178	-66.9	173.1	0	0	0	111.6	G695 A701 Q702 V703	G695-L699 WeakPolarHBondContact O-CG 3.2Å; G695-L699 PolarHBondContact O-N 3.33Å; L699-A701 PolarHBondContact O-N 2.58Å; L699-Q702 PolarHBondContact O-N 3.37Å; L699-V703 WeakPolarHBondContact O-CG2 3.36Å; L699-V703 PolarHBondContact O-N 2.94Å
700	R	88.9	Confident	86.6	Confident	155 Å²	155	87.4 Å²	87.4	59%	0.585	43%	0.432	S	S	*	.	H	α-helix	trans	-60.1	-43.8	173.6	-81.7	-164.1	-177.9	-167.5	2.6	112.4	H696 R697 Q702 V703 I704	H696-R700 PolarHBondContact CE1-NE 2.73Å; H696-R700 PolarHBondContact CE1-NH2 3.05Å; H696-R700 PolarHBondContact NE2-NE 2.87Å; H696-R700 PolarHBondContact NE2-NH2 3.22Å; H696-R700 WeakPolarHBondContact O-CB 3.45Å; H696-R700 WeakPolarHBondContact O-CG 3.46Å; H696-R700 PolarHBondContact O-N 3.45Å; R697-R700 PolarHBondContact O-N 3.29Å; R700-Q702 VanDerWaalsContact C-N 3.26Å; R700-Q702 PolarHBondContact O-N 3.01Å; R700-V703 PolarHBondContact O-N 3.45Å; R700-I704 WeakPolarHBondContact O-CG1 3.38Å; R700-I704 PolarHBondContact O-N 3.43Å
701	A	85.5	Confident	85.3	Confident	60 Å²	60	88.7 Å²	88.7	50%	0.496	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-35.8	178.3	0	0	0	0	0	112	R697 V698 L699 A705	R697-A701 WeakPolarHBondContact O-CB 3.35Å; R697-A701 PolarHBondContact O-N 2.98Å; V698-A701 PolarHBondContact O-N 3.23Å; L699-A701 PolarHBondContact O-N 2.58Å; A701-A705 WeakPolarHBondContact O-CB 3.43Å; A701-A705 PolarHBondContact O-N 3.38Å
702	Q	83.4	Confident	83.5	Confident	107 Å²	107	91.9 Å²	91.9	50%	0.5	46%	0.461	S	S	.	.	H	α-helix	trans	-68.6	-40.9	174.4	-72.2	-172.4	-22.3	0	0	112.9	V698 L699 R700 A705 K706	V698-Q702 PolarHBondContact O-N 3.08Å; V698-Q702 VanDerWaalsContact O-N 3.1Å; L699-Q702 PolarHBondContact O-N 3.37Å; R700-Q702 VanDerWaalsContact C-N 3.26Å; R700-Q702 PolarHBondContact O-N 3.01Å; Q702-A705 PolarHBondContact O-N 2.99Å; Q702-K706 PolarHBondContact O-N 3.07Å
703	V	85.9	Confident	81.6	Confident	80 Å²	80	89.4 Å²	89.4	49%	0.485	46%	0.461	S	S	.	.	H	α-helix	trans	-62.1	-46.6	176.5	172.5	0	0	0	0	110.9	L699 R700 A705 K706 Q707	L699-V703 WeakPolarHBondContact O-CG2 3.36Å; L699-V703 PolarHBondContact O-N 2.94Å; R700-V703 PolarHBondContact O-N 3.45Å; V703-A705 VanDerWaalsContact C-N 3.34Å; V703-A705 PolarHBondContact O-N 3.25Å; V703-K706 PolarHBondContact O-N 3.22Å; V703-Q707 WeakPolarHBondContact O-CG 3.4Å; V703-Q707 PolarHBondContact O-N 2.99Å
704	I	85.5	Confident	79.9	Confident	88 Å²	88	90 Å²	90	45%	0.451	47%	0.469	S	S	.	.	H	α-helix	trans	-61.3	-44	177.9	-66	166.9	0	0	0	110.6	R700 K706 Q707 Q708	R700-I704 WeakPolarHBondContact O-CG1 3.38Å; R700-I704 PolarHBondContact O-N 3.43Å; I704-K706 VanDerWaalsContact C-N 3.35Å; I704-K706 PolarHBondContact O-N 3.36Å; I704-Q707 PolarHBondContact O-N 3.09Å; I704-Q708 WeakPolarHBondContact O-CG 3.36Å; I704-Q708 PolarHBondContact O-N 3.05Å
705	A	81.3	Confident	77.8	Confident	23 Å²	23	96.5 Å²	96.5	19%	0.19	50%	0.498	C	S	.	.	H	α-helix	trans	-62.5	-39.5	177.9	0	0	0	0	0	112.6	A701 Q702 V703 Q708 Q709	A701-A705 WeakPolarHBondContact O-CB 3.43Å; A701-A705 PolarHBondContact O-N 3.38Å; Q702-A705 PolarHBondContact O-N 2.99Å; V703-A705 VanDerWaalsContact C-N 3.34Å; V703-A705 PolarHBondContact O-N 3.25Å; A705-Q708 PolarHBondContact O-N 3.48Å; A705-Q709 WeakPolarHBondContact O-CG 3.4Å; A705-Q709 PolarHBondContact O-N 3.4Å; A705-Q709 VanDerWaalsContact O-N 3.1Å
706	K	80.4	Confident	75.6	Confident	150 Å²	150	101.9 Å²	101.9	65%	0.652	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-39.9	175.4	-79	-174.5	175.7	-176.3	0	112.5	Q702 V703 I704 Q709 T710	Q702-K706 PolarHBondContact O-N 3.07Å; V703-K706 PolarHBondContact O-N 3.22Å; I704-K706 VanDerWaalsContact C-N 3.35Å; I704-K706 PolarHBondContact O-N 3.36Å; K706-Q709 PolarHBondContact O-N 2.72Å; K706-T710 PolarHBondContact O-N 3.01Å; K706-T710 PolarHBondContact O-OG1 3.06Å
707	Q	82.2	Confident	73.5	Confident	116 Å²	116	105.8 Å²	105.8	54%	0.542	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-40.7	176.3	-73.7	175.1	-14.5	0	0	111.7	V703 I704 T710 V711	V703-Q707 WeakPolarHBondContact O-CG 3.4Å; V703-Q707 PolarHBondContact O-N 2.99Å; I704-Q707 PolarHBondContact O-N 3.09Å; Q707-T710 WeakPolarHBondContact CA-OG1 3.47Å; Q707-T710 PolarHBondContact O-N 3.46Å; Q707-T710 PolarHBondContact O-OG1 3.05Å; Q707-T710 VanDerWaalsContact O-OG1 3.09Å; Q707-V711 WeakPolarHBondContact O-CG2 3.33Å; Q707-V711 PolarHBondContact O-N 3.16Å; Q707-V711 VanDerWaalsContact O-N 3.14Å
708	Q	78.1	Confident	71.6	Confident	127 Å²	127	104.6 Å²	104.6	59%	0.593	56%	0.563	S	S	*	*	H	α-helix	trans	-64.9	-42.1	175.8	-71.5	174.6	-13.6	0	0	112.1	I704 A705 T710 V711 S712	I704-Q708 WeakPolarHBondContact O-CG 3.36Å; I704-Q708 PolarHBondContact O-N 3.05Å; A705-Q708 PolarHBondContact O-N 3.48Å; Q708-T710 PolarHBondContact O-N 3.28Å; Q708-V711 PolarHBondContact O-N 3.42Å; Q708-S712 PolarHBondContact O-N 3.18Å; Q708-S712 VanDerWaalsContact O-N 3.1Å; Q708-S712 PolarHBondContact O-OG 3.48Å
709	Q	71.9	Confident	69.5	Low	138 Å²	138	110.1 Å²	110.1	65%	0.645	60%	0.596	S	S	*	*	H	α-helix	trans	-63.4	-39	176.1	-76.6	177.3	-19.3	0	0	112.8	A705 K706 S712 S713	A705-Q709 WeakPolarHBondContact O-CG 3.4Å; A705-Q709 PolarHBondContact O-N 3.4Å; A705-Q709 VanDerWaalsContact O-N 3.1Å; K706-Q709 PolarHBondContact O-N 2.72Å; Q709-S712 PolarHBondContact O-N 3.07Å; Q709-S713 PolarHBondContact O-N 3.1Å; Q709-S713 PolarHBondContact O-OG 3.38Å
710	T	70.4	Confident	67.5	Low	83 Å²	83	115 Å²	115	51%	0.509	61%	0.613	S	S	.	*	H	α-helix	trans	-65.3	-45.7	177.8	15.5	0	0	0	0	111.1	K706 Q707 Q708 S712 S713 T714	K706-T710 PolarHBondContact O-N 3.01Å; K706-T710 PolarHBondContact O-OG1 3.06Å; Q707-T710 WeakPolarHBondContact CA-OG1 3.47Å; Q707-T710 PolarHBondContact O-N 3.46Å; Q707-T710 PolarHBondContact O-OG1 3.05Å; Q707-T710 VanDerWaalsContact O-OG1 3.09Å; Q708-T710 PolarHBondContact O-N 3.28Å; T710-S712 PolarHBondContact O-N 3.41Å; T710-S713 PolarHBondContact O-N 3.42Å; T710-S713 PolarHBondContact O-OG 3.1Å; T710-T714 PolarHBondContact O-N 3.14Å; T710-T714 VanDerWaalsContact O-N 3.16Å; T710-T714 PolarHBondContact O-OG1 3.41Å; T710-T714 VanDerWaalsContact O-OG1 3.06Å
711	V	65.8	Low	65	Low	93 Å²	93	120.4 Å²	120.4	56%	0.564	64%	0.641	S	S	*	*	H	α-helix	trans	-60.4	-42.4	177.7	175.1	0	0	0	0	111.9	Q707 Q708 T714 Q715	Q707-V711 WeakPolarHBondContact O-CG2 3.33Å; Q707-V711 PolarHBondContact O-N 3.16Å; Q707-V711 VanDerWaalsContact O-N 3.14Å; Q708-V711 PolarHBondContact O-N 3.42Å; V711-T714 PolarHBondContact O-N 2.78Å; V711-T714 PolarHBondContact O-OG1 3.18Å; V711-T714 VanDerWaalsContact O-OG1 3.05Å; V711-Q715 PolarHBondContact O-N 3.49Å
712	S	57.7	Low	64	Low	80 Å²	80	123.4 Å²	123.4	56%	0.559	65%	0.648	S	S	*	*	H	α-helix	trans	-66.6	-33.8	176.7	-60.3	0	0	0	0	113.3	Q708 Q709 T710 Q715	Q708-S712 PolarHBondContact O-N 3.18Å; Q708-S712 VanDerWaalsContact O-N 3.1Å; Q708-S712 PolarHBondContact O-OG 3.48Å; Q709-S712 PolarHBondContact O-N 3.07Å; T710-S712 PolarHBondContact O-N 3.41Å; S712-Q715 PolarHBondContact O-N 3.46Å
713	S	57.2	Low	63	Low	92 Å²	92	124.3 Å²	124.3	64%	0.643	66%	0.656	S	S	*	*	H	α-helix	trans	-74.2	-24.8	178.2	68.5	0	0	0	0	114	Q709 T710	Q709-S713 PolarHBondContact O-N 3.1Å; Q709-S713 PolarHBondContact O-OG 3.38Å; T710-S713 PolarHBondContact O-N 3.42Å; T710-S713 PolarHBondContact O-OG 3.1Å
714	T	57.5	Low	61.7	Low	110 Å²	110	126.7 Å²	126.7	68%	0.675	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-0.4	175.1	43.4	0	0	0	0	114.1	T710 V711 P716	T710-T714 PolarHBondContact O-N 3.14Å; T710-T714 VanDerWaalsContact O-N 3.16Å; T710-T714 PolarHBondContact O-OG1 3.41Å; T710-T714 VanDerWaalsContact O-OG1 3.06Å; V711-T714 PolarHBondContact O-N 2.78Å; V711-T714 PolarHBondContact O-OG1 3.18Å; V711-T714 VanDerWaalsContact O-OG1 3.05Å; T714-P716 WeakPolarHBondContact O-CD 3.49Å
715	Q	49.9	Very low	60.3	Low	144 Å²	144	129 Å²	129	67%	0.673	68%	0.678	S	S	*	*	S	Bend	trans	-71.9	120.9	170.5	-81.7	-173.5	-26.8	0	0	109.5	V711 S712 L717	V711-Q715 PolarHBondContact O-N 3.49Å; S712-Q715 PolarHBondContact O-N 3.46Å; Q715-L717 PolarHBondContact O-N 2.9Å
716	P	48	Very low	59	Low	116 Å²	116	135.6 Å²	135.6	75%	0.753	71%	0.708	S	S	*	*			trans	-60.6	136.5	-175.6	24.4	-32.2	0	0	0	109.8	T714 N718	T714-P716 WeakPolarHBondContact O-CD 3.49Å; P716-N718 PolarHBondContact O-N 2.83Å
717	L	48	Very low	57.6	Low	170 Å²	170	134.7 Å²	134.7	89%	0.89	71%	0.712	S	S	*	*			trans	-49.1	105.1	167.8	-104.5	114.7	0	0	0	107.8	Q715 V719	Q715-L717 PolarHBondContact O-N 2.9Å; L717-V719 VanDerWaalsContact C-N 3.33Å; L717-V719 PolarHBondContact O-N 3.44Å
718	N	48.6	Very low	55.8	Low	156 Å²	156	136 Å²	136	83%	0.834	72%	0.724	S	S	*	*			trans	-67.3	101.5	174	-152.5	-5.7	0	0	0	105.6	P716 K720	P716-N718 PolarHBondContact O-N 2.83Å; N718-K720 VanDerWaalsContact C-N 3.35Å; N718-K720 PolarHBondContact O-N 3.06Å
719	V	44.7	Very low	54.1	Low	123 Å²	123	136.7 Å²	136.7	75%	0.745	73%	0.734	S	S	*	*			trans	-53.8	101.1	173.5	175.3	0	0	0	0	106.5	L717 K721	L717-V719 VanDerWaalsContact C-N 3.33Å; L717-V719 PolarHBondContact O-N 3.44Å; V719-K721 PolarHBondContact O-N 2.88Å
720	K	46.1	Very low	52.7	Low	204 Å²	204	136.6 Å²	136.6	89%	0.887	74%	0.742	S	S	*	*			trans	-61.7	109	161.4	-84.3	-174.8	173.9	-177.9	0	106.5	N718	N718-K720 VanDerWaalsContact C-N 3.35Å; N718-K720 PolarHBondContact O-N 3.06Å
721	K	38	Very low	51	Low	268 Å²	268	141.5 Å²	141.5	100%	1.165	76%	0.763	S	S	*	*			trans	-60.5	0	147.4	-95.3	-177.2	172.7	-179.9	0	109.7	V719	V719-K721 PolarHBondContact O-N 2.88Å

Retrieved 721 of 721 residues in 315.9 ms (Link to these results)

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