A0A087XU30_POEFO Loading...

DNA topoisomerase (ATP-hydrolyzing)

AlphaFold DB , UniProt , Accession A0A087XU30, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 390 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	50.5	Low	71.3	Confident	204 Å²	204	76.2 Å²	76.2	100%	1.005	43%	0.425	S	S	*	.				0	110.7	0	-94.6	163	39.3	0	0	109.2	E5	M1-E5 WeakPolarHBondContact CA-OE2 3.18Å
2	S	55.1	Low	73.3	Confident	60 Å²	60	69.8 Å²	69.8	42%	0.42	39%	0.389	S	S	.	.			trans	-71.9	156.8	174.3	71.1	0	0	0	0	110.4	F4 E5 A6	S2-F4 PolarHBondContact O-N 3.45Å; S2-F4 VanDerWaalsContact O-N 3.1Å; S2-E5 PolarHBondContact N-OE2 3.32Å; S2-E5 PolarHBondContact O-N 3.16Å; S2-E5 VanDerWaalsContact O-N 3.14Å; S2-E5 PolarHBondContact OG-N 2.89Å; S2-A6 PolarHBondContact O-N 3.43Å
3	A	59.4	Low	74.9	Confident	84 Å²	84	68.8 Å²	68.8	69%	0.694	38%	0.382	S	S	*	.	H	α-helix	trans	-59	-22.5	176.4	0	0	0	0	0	113.1
4	F	59	Low	76.3	Confident	123 Å²	123	71.8 Å²	71.8	54%	0.539	39%	0.39	S	S	.	.	H	α-helix	trans	-73.1	-44.2	175.5	-176.9	-98.8	0	0	0	112.3	S2 A6 Q7 L8	S2-F4 PolarHBondContact O-N 3.45Å; S2-F4 VanDerWaalsContact O-N 3.1Å; F4-A6 PolarHBondContact O-N 3.3Å; F4-Q7 PolarHBondContact O-N 2.6Å; F4-L8 PolarHBondContact O-N 2.94Å; F4-L8 VanDerWaalsContact O-N 3.1Å
5	E	59.8	Low	77.5	Confident	84 Å²	84	68.3 Å²	68.3	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.9	-73.5	166.9	170.9	0	0	111.8	M1 S2 Q7 L8 F9	M1-E5 WeakPolarHBondContact CA-OE2 3.18Å; S2-E5 PolarHBondContact N-OE2 3.32Å; S2-E5 PolarHBondContact O-N 3.16Å; S2-E5 VanDerWaalsContact O-N 3.14Å; S2-E5 PolarHBondContact OG-N 2.89Å; E5-Q7 PolarHBondContact O-N 3.26Å; E5-L8 PolarHBondContact O-N 2.95Å; E5-F9 VanDerWaalsContact O-CD2 3.3Å; E5-F9 WeakPolarHBondContact O-CD2 3.45Å; E5-F9 PolarHBondContact O-N 2.72Å
6	A	63.4	Low	78.6	Confident	54 Å²	54	68.6 Å²	68.6	45%	0.446	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-30.5	178.6	0	0	0	0	0	112.8	S2 F4	S2-A6 PolarHBondContact O-N 3.43Å; F4-A6 PolarHBondContact O-N 3.3Å
7	Q	74	Confident	79.4	Confident	102 Å²	102	69.5 Å²	69.5	48%	0.477	37%	0.373	S	S	.	.	H	α-helix	trans	-82.3	-33.9	177.7	-74.1	-176	-2.4	0	0	113.1	F4 E5 F9	F4-Q7 PolarHBondContact O-N 2.6Å; E5-Q7 PolarHBondContact O-N 3.26Å; Q7-F9 VanDerWaalsContact C-N 3.34Å; Q7-F9 PolarHBondContact O-N 2.9Å
8	L	82.9	Confident	80	Confident	8 Å²	8	72.1 Å²	72.1	4%	0.042	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-42	179.6	179.8	63	0	0	0	111.8	F4 E5 L235 L384 R385	F4-L8 PolarHBondContact O-N 2.94Å; F4-L8 VanDerWaalsContact O-N 3.1Å; E5-L8 PolarHBondContact O-N 2.95Å; L8-L235 HydrophobicContact CD2-CD2 3.91Å; L8-L384 HydrophobicContact CD1-CB 4.2Å; L8-R385 HydrophobicContact CD1-CB 4.05Å
9	F	91.2	Very high	80.4	Confident	14 Å²	14	69.7 Å²	69.7	6%	0.061	37%	0.369	C	S	.	.	S	Bend	trans	-91.7	-2.7	-174.1	-63.7	-65.7	0	0	0	114.7	E5 Q7 E11 I12 D13 K212 F213 S236	E5-F9 VanDerWaalsContact O-CD2 3.3Å; E5-F9 WeakPolarHBondContact O-CD2 3.45Å; E5-F9 PolarHBondContact O-N 2.72Å; Q7-F9 VanDerWaalsContact C-N 3.34Å; Q7-F9 PolarHBondContact O-N 2.9Å; F9-E11 PolarHBondContact O-N 3.33Å; F9-I12 HydrophobicContact CD1-CD1 3.84Å; F9-I12 HydrophobicContact CE1-CD1 4.33Å; F9-I12 PolarHBondContact O-N 3.17Å; F9-I12 VanDerWaalsContact O-N 3.12Å; F9-D13 WeakPolarHBondContact O-CB 3.44Å; F9-D13 PolarHBondContact O-N 3.21Å; F9-K212 HydrophobicContact CD1-CB 3.67Å; F9-K212 HydrophobicContact CD1-CG 3.75Å; F9-K212 HydrophobicContact CE1-CB 3.73Å; F9-K212 HydrophobicContact CE1-CG 3.89Å; F9-K212 HydrophobicContact CG-CB 4.48Å; F9-K212 HydrophobicContact CG-CG 4.1Å; F9-K212 HydrophobicContact CZ-CG 4.36Å; F9-F213 HydrophobicContact CE1-CD1 4.15Å; F9-F213 AromaticContact CE1-CE1 3.92Å; F9-F213 HydrophobicContact CE1-CE1 3.92Å; F9-S236 WeakPolarHBondContact CE2-O 3.33Å; F9-S236 VanDerWaalsContact CZ-O 3.22Å; F9-S236 WeakPolarHBondContact CZ-O 3.32Å
10	S	92.9	Very high	80.7	Confident	45 Å²	45	69.6 Å²	69.6	32%	0.315	37%	0.369	S	S	.	.	H	α-helix	trans	-53.3	-52.1	-176.2	167.9	0	0	0	0	112.9	I12 K14	S10-I12 VanDerWaalsContact C-N 3.35Å; S10-K14 WeakPolarHBondContact O-CG 3.36Å; S10-K14 PolarHBondContact O-N 3.38Å; S10-K14 VanDerWaalsContact O-N 3.09Å
11	E	95.7	Very high	80.7	Confident	60 Å²	60	71 Å²	71	28%	0.28	38%	0.377	S	S	.	.	H	α-helix	trans	-70.6	-32.3	-179.9	-62.6	-50	121.5	0	0	112.4	F9 K14 L15 W389	F9-E11 PolarHBondContact O-N 3.33Å; E11-K14 IonicContact OE1-NZ 2.79Å; E11-K14 PolarHBondContact OE1-NZ 2.87Å; E11-K14 IonicContact OE2-NZ 3.67Å; E11-L15 WeakPolarHBondContact O-CB 3.26Å; E11-L15 PolarHBondContact O-N 3.43Å; E11-W389 HydrophobicContact CB-CH2 3.69Å; E11-W389 HydrophobicContact CB-CZ2 4.3Å
12	I	95.6	Very high	81.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-67.7	-43.5	177.1	-62.9	171.3	0	0	0	110.6	F9 S10 L15 R16 K212 F213 P265 F267 L384 W389	F9-I12 HydrophobicContact CD1-CD1 3.84Å; F9-I12 HydrophobicContact CE1-CD1 4.33Å; F9-I12 PolarHBondContact O-N 3.17Å; F9-I12 VanDerWaalsContact O-N 3.12Å; S10-I12 VanDerWaalsContact C-N 3.35Å; I12-L15 PolarHBondContact O-N 3.49Å; I12-R16 PolarHBondContact O-N 3.33Å; I12-K212 HydrophobicContact CG2-CB 4.33Å; I12-K212 WeakPolarHBondContact CG2-O 3.3Å; I12-F213 HydrophobicContact CD1-CD1 3.8Å; I12-F213 HydrophobicContact CD1-CE1 4.21Å; I12-F213 HydrophobicContact CD1-CG 4.5Å; I12-F213 HydrophobicContact CG2-CB 4.24Å; I12-P265 HydrophobicContact CG2-CG 4.04Å; I12-F267 HydrophobicContact CD1-CE2 4.48Å; I12-F267 HydrophobicContact CG1-CE2 4.3Å; I12-F267 HydrophobicContact CG1-CZ 4.4Å; I12-L384 HydrophobicContact CD1-CB 4.18Å; I12-L384 HydrophobicContact CD1-CD2 4.07Å; I12-W389 HydrophobicContact CG1-CH2 3.98Å; I12-W389 HydrophobicContact CG1-CZ3 4.23Å
13	D	94.8	Very high	82.4	Confident	56 Å²	56	64 Å²	64	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	-67	-39.8	178.3	-77.2	-27.1	0	0	0	110.7	F9 L15 R16 V17 K212	F9-D13 WeakPolarHBondContact O-CB 3.44Å; F9-D13 PolarHBondContact O-N 3.21Å; D13-L15 VanDerWaalsContact C-N 3.35Å; D13-L15 PolarHBondContact O-N 2.91Å; D13-R16 WeakPolarHBondContact O-CB 3.44Å; D13-R16 PolarHBondContact O-N 3.35Å; D13-V17 WeakPolarHBondContact O-CG2 3.31Å; D13-V17 PolarHBondContact O-N 3.02Å; D13-V17 VanDerWaalsContact O-N 3.09Å; D13-K212 IonicContact OD1-NZ 2.69Å; D13-K212 PolarHBondContact OD1-NZ 3.2Å; D13-K212 IonicContact OD2-NZ 3.33Å; D13-K212 PolarHBondContact OD2-NZ 3.29Å
14	K	94.4	Very high	82.2	Confident	111 Å²	111	65.8 Å²	65.8	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-46.4	171.9	-73.4	173.1	-171.9	172.2	0	111.8	S10 E11 R16 V17 Q18	S10-K14 WeakPolarHBondContact O-CG 3.36Å; S10-K14 PolarHBondContact O-N 3.38Å; S10-K14 VanDerWaalsContact O-N 3.09Å; E11-K14 IonicContact OE1-NZ 2.79Å; E11-K14 PolarHBondContact OE1-NZ 2.87Å; E11-K14 IonicContact OE2-NZ 3.67Å; K14-R16 VanDerWaalsContact C-N 3.34Å; K14-V17 PolarHBondContact O-N 2.76Å; K14-Q18 WeakPolarHBondContact O-CG 3.43Å; K14-Q18 PolarHBondContact O-N 3.36Å; K14-Q18 VanDerWaalsContact O-N 3.13Å
15	L	94.3	Very high	81.8	Confident	19 Å²	19	65.1 Å²	65.1	10%	0.099	34%	0.338	C	S	.	.	H	α-helix	trans	-63.9	-40.1	177.9	176.9	67.9	0	0	0	111.8	E11 I12 D13 V17 Q18 L19 P265 F267 M303 W389	E11-L15 WeakPolarHBondContact O-CB 3.26Å; E11-L15 PolarHBondContact O-N 3.43Å; I12-L15 PolarHBondContact O-N 3.49Å; D13-L15 VanDerWaalsContact C-N 3.35Å; D13-L15 PolarHBondContact O-N 2.91Å; L15-V17 VanDerWaalsContact C-N 3.3Å; L15-V17 PolarHBondContact O-N 2.84Å; L15-Q18 WeakPolarHBondContact O-CB 3.35Å; L15-Q18 PolarHBondContact O-N 3.45Å; L15-Q18 VanDerWaalsContact O-N 3.16Å; L15-L19 HydrophobicContact CG-CD1 4.41Å; L15-L19 WeakPolarHBondContact O-CG 3.44Å; L15-L19 PolarHBondContact O-N 3.33Å; L15-P265 HydrophobicContact CB-CG 4.31Å; L15-P265 HydrophobicContact CD2-CB 3.66Å; L15-P265 HydrophobicContact CD2-CG 3.71Å; L15-P265 HydrophobicContact CG-CB 4.41Å; L15-P265 HydrophobicContact CG-CG 3.97Å; L15-F267 HydrophobicContact CD2-CE1 4.28Å; L15-F267 HydrophobicContact CD2-CZ 4.05Å; L15-M303 HydrophobicContact CD1-SD 4.06Å; L15-M303 HydrophobicContact CD2-CE 3.28Å; L15-M303 HydrophobicContact CD2-SD 3.42Å; L15-M303 WeakPolarHBondContact CD2-SD 3.44Å; L15-M303 HydrophobicContact CG-CE 4.43Å; L15-M303 HydrophobicContact CG-SD 4.36Å; L15-W389 HydrophobicContact CB-CZ2 4.38Å; L15-W389 HydrophobicContact CD2-CZ2 3.87Å
16	R	93.9	Very high	81.4	Confident	74 Å²	74	63 Å²	63	28%	0.279	33%	0.329	S	S	.	.	H	α-helix	trans	-57.8	-43.7	175	-173	-179.9	-175.2	172.4	4	111.7	I12 D13 K14 Q18 L19 L20 L262 H263 I264 P265	I12-R16 PolarHBondContact O-N 3.33Å; D13-R16 WeakPolarHBondContact O-CB 3.44Å; D13-R16 PolarHBondContact O-N 3.35Å; K14-R16 VanDerWaalsContact C-N 3.34Å; R16-Q18 VanDerWaalsContact C-N 3.33Å; R16-Q18 PolarHBondContact O-N 3.46Å; R16-L19 PolarHBondContact O-N 3.39Å; R16-L20 HydrophobicContact CG-CD1 4.29Å; R16-L20 WeakPolarHBondContact O-CG 3.45Å; R16-L20 PolarHBondContact O-N 3.43Å; R16-L262 PolarHBondContact NH2-O 2.82Å; R16-H263 WeakPolarHBondContact CG-O 3.33Å; R16-H263 PolarHBondContact NE-O 3.21Å; R16-I264 VanDerWaalsContact CZ-CG2 3.48Å; R16-P265 HydrophobicContact CB-CG 4.29Å
17	V	92.8	Very high	80.7	Confident	84 Å²	84	63.5 Å²	63.5	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-61.6	-42.4	176.5	173.1	0	0	0	0	111.2	D13 K14 L15 L19 L20 N21	D13-V17 WeakPolarHBondContact O-CG2 3.31Å; D13-V17 PolarHBondContact O-N 3.02Å; D13-V17 VanDerWaalsContact O-N 3.09Å; K14-V17 PolarHBondContact O-N 2.76Å; L15-V17 VanDerWaalsContact C-N 3.3Å; L15-V17 PolarHBondContact O-N 2.84Å; V17-L19 VanDerWaalsContact C-N 3.33Å; V17-L19 PolarHBondContact O-N 3.19Å; V17-L20 PolarHBondContact O-N 3Å; V17-N21 VanDerWaalsContact O-CG 3.3Å; V17-N21 PolarHBondContact O-N 2.74Å; V17-N21 VanDerWaalsContact O-N 3.14Å; V17-N21 PolarHBondContact O-ND2 3.5Å
18	Q	90.4	Very high	79.1	Confident	116 Å²	116	66.9 Å²	66.9	54%	0.542	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-41	175.4	-67.9	173.5	-8.3	0	0	112.3	K14 L15 R16 N22	K14-Q18 WeakPolarHBondContact O-CG 3.43Å; K14-Q18 PolarHBondContact O-N 3.36Å; K14-Q18 VanDerWaalsContact O-N 3.13Å; L15-Q18 WeakPolarHBondContact O-CB 3.35Å; L15-Q18 PolarHBondContact O-N 3.45Å; L15-Q18 VanDerWaalsContact O-N 3.16Å; R16-Q18 VanDerWaalsContact C-N 3.33Å; R16-Q18 PolarHBondContact O-N 3.46Å; Q18-N22 PolarHBondContact O-N 3.3Å; Q18-N22 PolarHBondContact O-ND2 3.35Å
19	L	86.9	Confident	77.1	Confident	26 Å²	26	73.1 Å²	73.1	14%	0.136	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-45.7	177.2	-69.8	174.3	0	0	0	111.7	L15 R16 V17 N21 N22 V23 P265	L15-L19 HydrophobicContact CG-CD1 4.41Å; L15-L19 WeakPolarHBondContact O-CG 3.44Å; L15-L19 PolarHBondContact O-N 3.33Å; R16-L19 PolarHBondContact O-N 3.39Å; V17-L19 VanDerWaalsContact C-N 3.33Å; V17-L19 PolarHBondContact O-N 3.19Å; L19-N21 VanDerWaalsContact C-N 3.34Å; L19-N21 PolarHBondContact O-N 2.85Å; L19-N22 PolarHBondContact O-N 3.04Å; L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 3.49Å; L19-V23 PolarHBondContact O-N 3.41Å; L19-P265 HydrophobicContact CD1-CB 4.45Å; L19-P265 HydrophobicContact CD1-CG 4.1Å
20	L	87.1	Confident	75	Confident	68 Å²	68	77.1 Å²	77.1	36%	0.356	40%	0.401	S	S	.	.	H	α-helix	trans	-60.1	-42.6	178.9	-73.4	169.6	0	0	0	112.1	R16 V17 N22 V23 D24 H263	R16-L20 HydrophobicContact CG-CD1 4.29Å; R16-L20 WeakPolarHBondContact O-CG 3.45Å; R16-L20 PolarHBondContact O-N 3.43Å; V17-L20 PolarHBondContact O-N 3Å; L20-N22 PolarHBondContact O-N 3.4Å; L20-V23 PolarHBondContact O-N 2.91Å; L20-V23 VanDerWaalsContact O-N 3.1Å; L20-D24 PolarHBondContact O-N 3.32Å; L20-H263 HydrophobicContact CD2-CB 3.6Å
21	N	81.8	Confident	72.5	Confident	100 Å²	100	86.2 Å²	86.2	54%	0.535	43%	0.429	S	S	.	.	H	α-helix	trans	-61.8	-28.6	176.2	-67.3	-15.7	0	0	0	113	V17 L19	V17-N21 VanDerWaalsContact O-CG 3.3Å; V17-N21 PolarHBondContact O-N 2.74Å; V17-N21 VanDerWaalsContact O-N 3.14Å; V17-N21 PolarHBondContact O-ND2 3.5Å; L19-N21 VanDerWaalsContact C-N 3.34Å; L19-N21 PolarHBondContact O-N 2.85Å
22	N	72.9	Confident	70	Confident	88 Å²	88	87.5 Å²	87.5	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-84.1	-25.6	177.1	-67.6	-20.9	0	0	0	112.6	Q18 L19 L20 I25 I26	Q18-N22 PolarHBondContact O-N 3.3Å; Q18-N22 PolarHBondContact O-ND2 3.35Å; L19-N22 PolarHBondContact O-N 3.04Å; L20-N22 PolarHBondContact O-N 3.4Å; N22-I25 WeakPolarHBondContact O-CB 3.19Å; N22-I25 PolarHBondContact O-N 3.06Å; N22-I26 WeakPolarHBondContact O-CG1 3.42Å; N22-I26 PolarHBondContact O-N 2.7Å
23	V	67.8	Low	67.9	Low	29 Å²	29	92.7 Å²	92.7	18%	0.176	48%	0.481	C	S	.	.	H	α-helix	trans	-66.7	-38.1	179.4	170.2	0	0	0	0	111.2	L19 L20 I25 I26 A27	L19-V23 VanDerWaalsContact O-CG2 3.26Å; L19-V23 WeakPolarHBondContact O-CG2 3.49Å; L19-V23 PolarHBondContact O-N 3.41Å; L20-V23 PolarHBondContact O-N 2.91Å; L20-V23 VanDerWaalsContact O-N 3.1Å; V23-I25 PolarHBondContact O-N 3.21Å; V23-I25 VanDerWaalsContact O-N 3.12Å; V23-I26 PolarHBondContact O-N 3.28Å; V23-A27 PolarHBondContact O-N 3.34Å
24	D	54.7	Low	66	Low	120 Å²	120	98.1 Å²	98.1	64%	0.642	51%	0.505	S	S	*	.	H	α-helix	trans	-58	-27.2	175.8	-69.8	-26.7	0	0	0	112.4	L20	L20-D24 PolarHBondContact O-N 3.32Å
25	I	51.3	Low	64.7	Low	109 Å²	109	100.9 Å²	100.9	56%	0.559	52%	0.519	S	S	*	.	H	α-helix	trans	-84.2	-30.5	176.8	-57.4	170.4	0	0	0	111.6	N22 V23	N22-I25 WeakPolarHBondContact O-CB 3.19Å; N22-I25 PolarHBondContact O-N 3.06Å; V23-I25 PolarHBondContact O-N 3.21Å; V23-I25 VanDerWaalsContact O-N 3.12Å
26	I	51.2	Low	64.2	Low	41 Å²	41	102.3 Å²	102.3	21%	0.21	53%	0.526	C	S	.	.	H	α-helix	trans	-82.3	-33.5	-178	-65.6	166.2	0	0	0	111.3	N22 V23 E28 N29 Q30	N22-I26 WeakPolarHBondContact O-CG1 3.42Å; N22-I26 PolarHBondContact O-N 2.7Å; V23-I26 PolarHBondContact O-N 3.28Å; I26-E28 PolarHBondContact O-N 3.48Å; I26-N29 PolarHBondContact O-N 3.43Å; I26-Q30 HydrophobicContact CG2-CG 4.15Å; I26-Q30 PolarHBondContact O-N 3Å
27	A	48.3	Very low	64	Low	63 Å²	63	101.3 Å²	101.3	52%	0.521	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.6	178.7	0	0	0	0	0	112.8	V23 N29	V23-A27 PolarHBondContact O-N 3.34Å; A27-N29 VanDerWaalsContact C-N 3.28Å; A27-N29 PolarHBondContact O-N 2.84Å
28	E	41	Very low	64	Low	173 Å²	173	101 Å²	101	81%	0.808	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-20.6	173.9	-70.9	-172.3	156.6	0	0	113.4	I26	I26-E28 PolarHBondContact O-N 3.48Å
29	N	40.2	Very low	64.2	Low	140 Å²	140	101.2 Å²	101.2	75%	0.749	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-9.5	-176.9	-80.6	-36.3	0	0	0	114.6	I26 A27 R31	I26-N29 PolarHBondContact O-N 3.43Å; A27-N29 VanDerWaalsContact C-N 3.28Å; A27-N29 PolarHBondContact O-N 2.84Å; N29-R31 PolarHBondContact O-N 3.35Å; N29-R31 VanDerWaalsContact O-N 3.16Å
30	Q	46.5	Very low	64.5	Low	98 Å²	98	104.8 Å²	104.8	46%	0.458	54%	0.544	S	S	.	.			trans	-83.2	92.1	176.2	-72.8	-177.2	1.2	0	0	110.2	I26 A32	I26-Q30 HydrophobicContact CG2-CG 4.15Å; I26-Q30 PolarHBondContact O-N 3Å; Q30-A32 PolarHBondContact O-N 2.95Å; Q30-A32 VanDerWaalsContact O-N 3.14Å
31	R	41	Very low	64.9	Low	236 Å²	236	101.7 Å²	101.7	89%	0.891	53%	0.528	S	S	*	.			trans	-59.3	118.3	156.7	-73.6	-176.9	-178.4	178.3	0.5	107	N29 V33	N29-R31 PolarHBondContact O-N 3.35Å; N29-R31 VanDerWaalsContact O-N 3.16Å; R31-V33 PolarHBondContact O-N 3.2Å; R31-V33 VanDerWaalsContact O-N 3.07Å
32	A	42.7	Very low	65.6	Low	87 Å²	87	97.8 Å²	97.8	72%	0.719	51%	0.507	S	S	*	.			trans	-48.7	120.9	164	0	0	0	0	0	107.1	Q30 E34	Q30-A32 PolarHBondContact O-N 2.95Å; Q30-A32 VanDerWaalsContact O-N 3.14Å; A32-E34 VanDerWaalsContact C-N 3.27Å; A32-E34 PolarHBondContact O-N 3.33Å
33	V	51.8	Low	66.8	Low	108 Å²	108	97.9 Å²	97.9	66%	0.655	51%	0.511	S	S	*	.			trans	-64.8	100.3	169.5	178.1	0	0	0	0	104.5	R31 E35	R31-V33 PolarHBondContact O-N 3.2Å; R31-V33 VanDerWaalsContact O-N 3.07Å; V33-E35 PolarHBondContact O-N 2.91Å
34	E	54.8	Low	68.1	Low	171 Å²	171	99.7 Å²	99.7	80%	0.799	52%	0.518	S	S	*	.			trans	-53.6	128.7	176.6	-75.3	178	164.1	0	0	108.1	A32 I36	A32-E34 VanDerWaalsContact C-N 3.27Å; A32-E34 PolarHBondContact O-N 3.33Å; E34-I36 PolarHBondContact O-N 3.08Å
35	E	67.3	Low	70.2	Confident	169 Å²	169	94.1 Å²	94.1	79%	0.79	49%	0.488	S	S	*	.			trans	-64.4	105	174.6	-78.1	-172.5	151.6	0	0	107.9	V33 S37	V33-E35 PolarHBondContact O-N 2.91Å; E35-S37 PolarHBondContact O-N 3.08Å
36	I	83.1	Confident	72.4	Confident	49 Å²	49	93 Å²	93	25%	0.251	48%	0.48	S	S	.	.			trans	-54	129.8	172.1	-80.2	175.2	0	0	0	108.7	E34 E40 I41 V157	E34-I36 PolarHBondContact O-N 3.08Å; I36-E40 HydrophobicContact CG2-CB 3.89Å; I36-I41 HydrophobicContact CG2-CD1 4.05Å; I36-I41 HydrophobicContact CG2-CG1 3.38Å; I36-V157 HydrophobicContact CD1-CG2 3.91Å; I36-V157 HydrophobicContact CG2-CG2 4.46Å
37	S	90.9	Very high	74.6	Confident	52 Å²	52	93.1 Å²	93.1	36%	0.364	49%	0.492	S	S	.	.			trans	-70.2	155	-179.2	66.1	0	0	0	0	111.9	E35 D39 E40 I41	E35-S37 PolarHBondContact O-N 3.08Å; S37-D39 PolarHBondContact O-N 2.89Å; S37-E40 PolarHBondContact N-OE2 3.3Å; S37-E40 PolarHBondContact O-N 3.19Å; S37-E40 VanDerWaalsContact O-N 3.16Å; S37-E40 WeakPolarHBondContact OG-CB 3.32Å; S37-E40 VanDerWaalsContact OG-CD 3.22Å; S37-E40 WeakPolarHBondContact OG-CG 3.42Å; S37-E40 PolarHBondContact OG-N 3.27Å; S37-E40 PolarHBondContact OG-OE2 2.73Å; S37-I41 WeakPolarHBondContact O-CG1 3.38Å; S37-I41 PolarHBondContact O-N 3.14Å
38	Q	92.2	Very high	76.9	Confident	78 Å²	78	91.6 Å²	91.6	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-57	-41.4	177.8	-68.1	-178.8	-17.7	0	0	111.7	E40 I41 L42 V119 N122 H163	Q38-E40 VanDerWaalsContact C-N 3.34Å; Q38-E40 PolarHBondContact O-N 2.6Å; Q38-I41 PolarHBondContact O-N 3.16Å; Q38-L42 WeakPolarHBondContact O-CG 3.4Å; Q38-L42 PolarHBondContact O-N 3.07Å; Q38-V119 HydrophobicContact CB-CG1 3.93Å; Q38-V119 HydrophobicContact CG-CG1 4.21Å; Q38-N122 PolarHBondContact NE2-OD1 3.48Å; Q38-H163 PolarHBondContact NE2-CE1 2.97Å
39	D	93.9	Very high	79.6	Confident	120 Å²	120	86.3 Å²	86.3	64%	0.642	45%	0.452	S	S	*	.	H	α-helix	trans	-63.3	-38.2	179.1	-69.1	-18	0	0	0	112.4	S37 L42 T43	S37-D39 PolarHBondContact O-N 2.89Å; D39-L42 PolarHBondContact O-N 2.88Å; D39-T43 WeakPolarHBondContact O-CB 3.31Å; D39-T43 PolarHBondContact O-N 3.49Å; D39-T43 PolarHBondContact O-OG1 3.43Å
40	E	94.9	Very high	82.3	Confident	101 Å²	101	85.1 Å²	85.1	47%	0.472	45%	0.445	S	S	.	.	H	α-helix	trans	-65.4	-41.2	175	-76.2	166.6	153.2	0	0	111.8	I36 S37 Q38 T43 Q44	I36-E40 HydrophobicContact CG2-CB 3.89Å; S37-E40 PolarHBondContact N-OE2 3.3Å; S37-E40 PolarHBondContact O-N 3.19Å; S37-E40 VanDerWaalsContact O-N 3.16Å; S37-E40 WeakPolarHBondContact OG-CB 3.32Å; S37-E40 VanDerWaalsContact OG-CD 3.22Å; S37-E40 WeakPolarHBondContact OG-CG 3.42Å; S37-E40 PolarHBondContact OG-N 3.27Å; S37-E40 PolarHBondContact OG-OE2 2.73Å; Q38-E40 VanDerWaalsContact C-N 3.34Å; Q38-E40 PolarHBondContact O-N 2.6Å; E40-T43 PolarHBondContact O-N 3.26Å; E40-Q44 VanDerWaalsContact O-CG 3.3Å; E40-Q44 WeakPolarHBondContact O-CG 3.26Å; E40-Q44 PolarHBondContact O-N 3.26Å
41	I	95	Very high	84.7	Confident	3 Å²	3	82.2 Å²	82.2	2%	0.015	44%	0.441	C	S	.	.	H	α-helix	trans	-63.1	-46	177	-56.7	174.9	0	0	0	110.2	I36 S37 Q38 T43 Q44 I45 V119 V157 S161 L162	I36-I41 HydrophobicContact CG2-CD1 4.05Å; I36-I41 HydrophobicContact CG2-CG1 3.38Å; S37-I41 WeakPolarHBondContact O-CG1 3.38Å; S37-I41 PolarHBondContact O-N 3.14Å; Q38-I41 PolarHBondContact O-N 3.16Å; I41-T43 VanDerWaalsContact C-N 3.34Å; I41-T43 PolarHBondContact O-N 2.87Å; I41-Q44 PolarHBondContact O-N 3.13Å; I41-I45 HydrophobicContact CG2-CD1 4.06Å; I41-I45 WeakPolarHBondContact O-CG1 3.16Å; I41-I45 PolarHBondContact O-N 3.06Å; I41-V119 HydrophobicContact CB-CG1 4.34Å; I41-V119 HydrophobicContact CG2-CG1 4.49Å; I41-V119 HydrophobicContact CG2-CG2 4.17Å; I41-V157 HydrophobicContact CD1-CG1 3.99Å; I41-V157 HydrophobicContact CG1-CG1 4.18Å; I41-V157 HydrophobicContact CG1-CG2 4.39Å; I41-S161 WeakPolarHBondContact CD1-O 3.42Å; I41-L162 HydrophobicContact CG2-CD2 4.3Å
42	L	96.9	Very high	87.4	Confident	19 Å²	19	71.6 Å²	71.6	10%	0.099	40%	0.402	C	S	.	.	H	α-helix	trans	-60.4	-46.1	177.4	-66.1	174.1	0	0	0	110.7	Q38 D39 Q44 I45 E46 Y116 V119 Q120	Q38-L42 WeakPolarHBondContact O-CG 3.4Å; Q38-L42 PolarHBondContact O-N 3.07Å; D39-L42 PolarHBondContact O-N 2.88Å; L42-Q44 VanDerWaalsContact C-N 3.32Å; L42-Q44 PolarHBondContact O-N 3.22Å; L42-I45 PolarHBondContact O-N 3.37Å; L42-E46 WeakPolarHBondContact O-CB 3.44Å; L42-E46 VanDerWaalsContact O-CG 3.31Å; L42-E46 WeakPolarHBondContact O-CG 3.49Å; L42-E46 PolarHBondContact O-N 3.02Å; L42-Y116 HydrophobicContact CB-CE2 4.04Å; L42-Y116 HydrophobicContact CD2-CD1 4.41Å; L42-Y116 HydrophobicContact CD2-CD2 3.51Å; L42-Y116 HydrophobicContact CD2-CE1 4.43Å; L42-Y116 HydrophobicContact CD2-CE2 3.54Å; L42-Y116 HydrophobicContact CD2-CG 3.98Å; L42-Y116 HydrophobicContact CG-CE2 4.35Å; L42-V119 HydrophobicContact CD1-CG1 4.42Å; L42-V119 HydrophobicContact CD2-CB 3.95Å; L42-V119 HydrophobicContact CD2-CG1 3.83Å; L42-V119 HydrophobicContact CG-CG1 3.84Å; L42-Q120 HydrophobicContact CD1-CB 4.43Å; L42-Q120 HydrophobicContact CD2-CB 4.18Å
43	T	97	Very high	90	Very high	90 Å²	90	72.8 Å²	72.8	55%	0.552	39%	0.394	S	S	*	.	H	α-helix	trans	-59.7	-41	177.3	-57.7	0	0	0	0	111.9	D39 E40 I41 E46 G47	D39-T43 WeakPolarHBondContact O-CB 3.31Å; D39-T43 PolarHBondContact O-N 3.49Å; D39-T43 PolarHBondContact O-OG1 3.43Å; E40-T43 PolarHBondContact O-N 3.26Å; I41-T43 VanDerWaalsContact C-N 3.34Å; I41-T43 PolarHBondContact O-N 2.87Å; T43-E46 PolarHBondContact O-N 2.91Å; T43-G47 PolarHBondContact O-N 3.48Å
44	Q	96.3	Very high	92.1	Very high	66 Å²	66	69.9 Å²	69.9	31%	0.308	38%	0.376	S	S	.	.	H	α-helix	trans	-65.9	-42.4	176.9	-73.3	178.9	4.2	0	0	112.2	E40 I41 L42 G47 V48 L155	E40-Q44 VanDerWaalsContact O-CG 3.3Å; E40-Q44 WeakPolarHBondContact O-CG 3.26Å; E40-Q44 PolarHBondContact O-N 3.26Å; I41-Q44 PolarHBondContact O-N 3.13Å; L42-Q44 VanDerWaalsContact C-N 3.32Å; L42-Q44 PolarHBondContact O-N 3.22Å; Q44-G47 PolarHBondContact O-N 3.12Å; Q44-V48 PolarHBondContact O-N 3.19Å; Q44-L155 HydrophobicContact CB-CD2 4.18Å; Q44-L155 PolarHBondContact OE1-O 3.14Å
45	I	97.3	Very high	94.1	Very high	3 Å²	3	63 Å²	63	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-44.7	175.7	-64.7	169.2	0	0	0	110	I41 L42 G47 V48 I49 L112 I115 Y116 L155	I41-I45 HydrophobicContact CG2-CD1 4.06Å; I41-I45 WeakPolarHBondContact O-CG1 3.16Å; I41-I45 PolarHBondContact O-N 3.06Å; L42-I45 PolarHBondContact O-N 3.37Å; I45-G47 VanDerWaalsContact C-N 3.29Å; I45-G47 PolarHBondContact O-N 3.47Å; I45-V48 WeakPolarHBondContact O-CB 3.39Å; I45-V48 PolarHBondContact O-N 2.83Å; I45-V48 VanDerWaalsContact O-N 3.13Å; I45-I49 WeakPolarHBondContact O-CG1 3.47Å; I45-I49 PolarHBondContact O-N 3.45Å; I45-L112 HydrophobicContact CG1-CD2 4.23Å; I45-L112 HydrophobicContact CG2-CB 4.4Å; I45-L112 HydrophobicContact CG2-CD2 4.37Å; I45-I115 HydrophobicContact CD1-CB 4.44Å; I45-I115 HydrophobicContact CD1-CG2 3.71Å; I45-Y116 HydrophobicContact CB-CD2 4.12Å; I45-Y116 HydrophobicContact CD1-CD2 4.44Å; I45-Y116 HydrophobicContact CG2-CD2 3.87Å; I45-Y116 HydrophobicContact CG2-CG 4.5Å; I45-L155 HydrophobicContact CD1-CD1 4.48Å; I45-L155 HydrophobicContact CG1-CD1 3.81Å
46	E	97.8	Very high	95.5	Very high	87 Å²	87	59.3 Å²	59.3	41%	0.407	33%	0.332	S	S	.	.	H	α-helix	trans	-59	-39.9	175.6	-75.4	167.7	-171.2	0	0	111.9	L42 T43 V48 I49 L50 Y116	L42-E46 WeakPolarHBondContact O-CB 3.44Å; L42-E46 VanDerWaalsContact O-CG 3.31Å; L42-E46 WeakPolarHBondContact O-CG 3.49Å; L42-E46 PolarHBondContact O-N 3.02Å; T43-E46 PolarHBondContact O-N 2.91Å; E46-V48 VanDerWaalsContact C-N 3.33Å; E46-V48 PolarHBondContact O-N 2.88Å; E46-I49 PolarHBondContact O-N 3.19Å; E46-L50 VanDerWaalsContact O-CB 3.26Å; E46-L50 WeakPolarHBondContact O-CB 3.49Å; E46-L50 PolarHBondContact O-N 3.36Å; E46-Y116 HydrophobicContact CG-CE2 3.75Å; E46-Y116 WeakPolarHBondContact OE1-CE2 3.41Å; E46-Y116 PolarHBondContact OE1-OH 3.35Å
47	G	97.4	Very high	96.2	Very high	43 Å²	43	61.4 Å²	61.4	44%	0.443	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-41.7	173.7	0	0	0	0	0	113	T43 Q44 I45 L50 G51	T43-G47 PolarHBondContact O-N 3.48Å; Q44-G47 PolarHBondContact O-N 3.12Å; I45-G47 VanDerWaalsContact C-N 3.29Å; I45-G47 PolarHBondContact O-N 3.47Å; G47-L50 PolarHBondContact O-N 3.02Å; G47-G51 PolarHBondContact O-N 3.02Å
48	V	97.1	Very high	96.5	Very high	30 Å²	30	66.6 Å²	66.6	18%	0.182	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-45.8	174.5	175.5	0	0	0	0	111	Q44 I45 E46 G51 I52 L64 L112 M154 L155	Q44-V48 PolarHBondContact O-N 3.19Å; I45-V48 WeakPolarHBondContact O-CB 3.39Å; I45-V48 PolarHBondContact O-N 2.83Å; I45-V48 VanDerWaalsContact O-N 3.13Å; E46-V48 VanDerWaalsContact C-N 3.33Å; E46-V48 PolarHBondContact O-N 2.88Å; V48-G51 PolarHBondContact O-N 3.35Å; V48-I52 HydrophobicContact CG1-CD1 4.5Å; V48-I52 WeakPolarHBondContact O-CG1 3.48Å; V48-I52 PolarHBondContact O-N 3.46Å; V48-L64 HydrophobicContact CG1-CD2 3.6Å; V48-L112 HydrophobicContact CG1-CD1 4.06Å; V48-M154 HydrophobicContact CG1-CE 4.42Å; V48-M154 HydrophobicContact CG2-CE 4.07Å; V48-L155 HydrophobicContact CG2-CD2 4.01Å
49	I	97.4	Very high	96.6	Very high	63 Å²	63	70.6 Å²	70.6	32%	0.323	39%	0.387	S	S	.	.	H	α-helix	trans	-66.9	-40.6	179.5	-59.5	-54.8	0	0	0	111.5	I45 E46 G51 I52 M53 L109	I45-I49 WeakPolarHBondContact O-CG1 3.47Å; I45-I49 PolarHBondContact O-N 3.45Å; E46-I49 PolarHBondContact O-N 3.19Å; I49-G51 VanDerWaalsContact C-N 3.31Å; I49-G51 PolarHBondContact O-N 3.16Å; I49-I52 HydrophobicContact CD1-CD1 4.47Å; I49-I52 WeakPolarHBondContact O-CB 3.43Å; I49-I52 PolarHBondContact O-N 3.12Å; I49-M53 HydrophobicContact CG2-CE 4.5Å; I49-M53 HydrophobicContact CG2-CG 4.45Å; I49-M53 WeakPolarHBondContact O-CG 3.33Å; I49-M53 PolarHBondContact O-N 3.33Å; I49-L109 HydrophobicContact CD1-CD2 4Å
50	L	97.4	Very high	96.7	Very high	115 Å²	115	69.6 Å²	69.6	60%	0.602	38%	0.379	S	S	*	.	H	α-helix	trans	-61.4	-40.3	175.8	179.6	62	0	0	0	111.3	E46 G47 I52 M53 T54	E46-L50 VanDerWaalsContact O-CB 3.26Å; E46-L50 WeakPolarHBondContact O-CB 3.49Å; E46-L50 PolarHBondContact O-N 3.36Å; G47-L50 PolarHBondContact O-N 3.02Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 3.42Å; L50-M53 PolarHBondContact O-N 2.67Å; L50-T54 WeakPolarHBondContact O-CB 3.4Å; L50-T54 PolarHBondContact O-N 3.32Å; L50-T54 PolarHBondContact O-OG1 3.21Å
51	G	97	Very high	96.7	Very high	36 Å²	36	67.3 Å²	67.3	37%	0.371	37%	0.371	S	S	.	.	H	α-helix	trans	-57.7	-45.4	173.5	0	0	0	0	0	112.2	G47 V48 I49 T54 S55	G47-G51 PolarHBondContact O-N 3.02Å; V48-G51 PolarHBondContact O-N 3.35Å; I49-G51 VanDerWaalsContact C-N 3.31Å; I49-G51 PolarHBondContact O-N 3.16Å; G51-T54 PolarHBondContact O-N 2.64Å; G51-S55 PolarHBondContact O-N 2.99Å; G51-S55 PolarHBondContact O-OG 3.34Å
52	I	96.7	Very high	96.8	Very high	14 Å²	14	67.4 Å²	67.4	7%	0.072	37%	0.372	C	S	.	.	H	α-helix	trans	-62.1	-48.2	176.4	-67.1	167.9	0	0	0	111.3	V48 I49 L50 T54 S55 L56 P62 L64 F105 L109	V48-I52 HydrophobicContact CG1-CD1 4.5Å; V48-I52 WeakPolarHBondContact O-CG1 3.48Å; V48-I52 PolarHBondContact O-N 3.46Å; I49-I52 HydrophobicContact CD1-CD1 4.47Å; I49-I52 WeakPolarHBondContact O-CB 3.43Å; I49-I52 PolarHBondContact O-N 3.12Å; L50-I52 VanDerWaalsContact C-N 3.33Å; L50-I52 PolarHBondContact O-N 3.42Å; I52-T54 VanDerWaalsContact C-N 3.27Å; I52-T54 PolarHBondContact O-N 3.07Å; I52-S55 PolarHBondContact O-N 3.45Å; I52-L56 HydrophobicContact CG2-CD1 4.11Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 3.27Å; I52-P62 HydrophobicContact CB-CB 4.46Å; I52-P62 HydrophobicContact CG1-CB 4.32Å; I52-P62 HydrophobicContact CG2-CB 3.96Å; I52-P62 HydrophobicContact CG2-CG 3.98Å; I52-L64 HydrophobicContact CD1-CD2 4.21Å; I52-F105 HydrophobicContact CD1-CZ 4.13Å; I52-F105 HydrophobicContact CG1-CZ 4.4Å; I52-L109 HydrophobicContact CD1-CD1 4.49Å; I52-L109 HydrophobicContact CD1-CD2 3.41Å; I52-L109 VanDerWaalsContact CD1-CD2 3.41Å
53	M	97.1	Very high	96.8	Very high	112 Å²	112	69.9 Å²	69.9	55%	0.552	39%	0.385	S	S	*	.	H	α-helix	trans	-63.3	-36.3	179.6	-68.6	-62.3	169.2	0	0	111.8	I49 L50 L56 S57	I49-M53 HydrophobicContact CG2-CE 4.5Å; I49-M53 HydrophobicContact CG2-CG 4.45Å; I49-M53 WeakPolarHBondContact O-CG 3.33Å; I49-M53 PolarHBondContact O-N 3.33Å; L50-M53 PolarHBondContact O-N 2.67Å; M53-L56 PolarHBondContact O-N 3.04Å; M53-L56 HydrophobicContact SD-CD1 4.38Å; M53-S57 WeakPolarHBondContact O-CB 3.41Å; M53-S57 PolarHBondContact O-N 3.3Å
54	T	97.5	Very high	96.7	Very high	46 Å²	46	65.9 Å²	65.9	28%	0.282	36%	0.36	S	S	.	.	H	α-helix	trans	-64.5	-46.5	176.3	-57.2	0	0	0	0	111	L50 G51 I52 L56 S57 R58	L50-T54 WeakPolarHBondContact O-CB 3.4Å; L50-T54 PolarHBondContact O-N 3.32Å; L50-T54 PolarHBondContact O-OG1 3.21Å; G51-T54 PolarHBondContact O-N 2.64Å; I52-T54 VanDerWaalsContact C-N 3.27Å; I52-T54 PolarHBondContact O-N 3.07Å; T54-L56 PolarHBondContact O-N 3.05Å; T54-S57 PolarHBondContact O-N 2.85Å; T54-S57 PolarHBondContact O-OG 3.1Å; T54-R58 WeakPolarHBondContact O-CG 3.11Å; T54-R58 PolarHBondContact O-N 3.07Å
55	S	96.8	Very high	96.6	Very high	26 Å²	26	66.3 Å²	66.3	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-58.5	-47.8	174.6	-65.5	0	0	0	0	111.5	G51 I52 S57 R58 D59 E60	G51-S55 PolarHBondContact O-N 2.99Å; G51-S55 PolarHBondContact O-OG 3.34Å; I52-S55 PolarHBondContact O-N 3.45Å; S55-S57 VanDerWaalsContact C-N 3.32Å; S55-S57 PolarHBondContact O-N 3.43Å; S55-R58 CarbonylContact O-C 3.43Å; S55-R58 PolarHBondContact O-N 3.42Å; S55-D59 PolarHBondContact O-N 2.83Å; S55-E60 CarbonylContact C-O 3.59Å; S55-E60 WeakPolarHBondContact O-CA 3.48Å; S55-E60 WeakPolarHBondContact O-CB 3.35Å; S55-E60 PolarHBondContact O-N 3Å
56	L	96.3	Very high	96.3	Very high	92 Å²	92	66.4 Å²	66.4	48%	0.482	37%	0.367	S	S	.	.	H	α-helix	trans	-59.8	-40	178	-69.2	173.5	0	0	0	112.7	I52 M53 T54 R58 D59 P62	I52-L56 HydrophobicContact CG2-CD1 4.11Å; I52-L56 WeakPolarHBondContact O-CG 3.32Å; I52-L56 PolarHBondContact O-N 3.27Å; M53-L56 PolarHBondContact O-N 3.04Å; M53-L56 HydrophobicContact SD-CD1 4.38Å; T54-L56 PolarHBondContact O-N 3.05Å; L56-R58 PolarHBondContact O-N 2.94Å; L56-D59 PolarHBondContact O-N 3.39Å; L56-D59 VanDerWaalsContact O-N 3.12Å; L56-P62 HydrophobicContact CD1-CG 4.39Å; L56-P62 HydrophobicContact CD2-CG 3.58Å; L56-P62 HydrophobicContact CG-CG 3.67Å
57	S	97.2	Very high	95.8	Very high	93 Å²	93	63.2 Å²	63.2	65%	0.65	35%	0.354	S	S	*	.	H	α-helix	trans	-65.8	-17.9	178.3	73.8	0	0	0	0	114.2	M53 T54 S55	M53-S57 WeakPolarHBondContact O-CB 3.41Å; M53-S57 PolarHBondContact O-N 3.3Å; T54-S57 PolarHBondContact O-N 2.85Å; T54-S57 PolarHBondContact O-OG 3.1Å; S55-S57 VanDerWaalsContact C-N 3.32Å; S55-S57 PolarHBondContact O-N 3.43Å
58	R	97.3	Very high	95.3	Very high	161 Å²	161	63.3 Å²	63.3	61%	0.608	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	8.8	178.2	-64.2	175.7	-177.3	177.2	1.4	112.5	T54 S55 L56 E60	T54-R58 WeakPolarHBondContact O-CG 3.11Å; T54-R58 PolarHBondContact O-N 3.07Å; S55-R58 CarbonylContact O-C 3.43Å; S55-R58 PolarHBondContact O-N 3.42Å; L56-R58 PolarHBondContact O-N 2.94Å; R58-E60 HydrophobicContact CB-CG 3.98Å; R58-E60 PolarHBondContact O-N 2.89Å
59	D	95	Very high	94.7	Very high	162 Å²	162	62.4 Å²	62.4	87%	0.866	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	26	-170.3	-64.1	-50	0	0	0	113.4	S55 L56	S55-D59 PolarHBondContact O-N 2.83Å; L56-D59 PolarHBondContact O-N 3.39Å; L56-D59 VanDerWaalsContact O-N 3.12Å
60	E	96.1	Very high	93.8	Very high	100 Å²	100	63.5 Å²	63.5	47%	0.467	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-92.8	148.3	174.6	-66.1	174.6	178.7	0	0	110.7	S55 R58 P62	S55-E60 CarbonylContact C-O 3.59Å; S55-E60 WeakPolarHBondContact O-CA 3.48Å; S55-E60 WeakPolarHBondContact O-CB 3.35Å; S55-E60 PolarHBondContact O-N 3Å; R58-E60 HydrophobicContact CB-CG 3.98Å; R58-E60 PolarHBondContact O-N 2.89Å; E60-P62 VanDerWaalsContact O-CD 3.26Å; E60-P62 WeakPolarHBondContact O-CD 3.28Å
61	V	95	Very high	93.2	Very high	52 Å²	52	59.9 Å²	59.9	32%	0.315	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-71.9	124.3	177.8	175.7	0	0	0	0	110.2	I63 D97	V61-I63 PolarHBondContact O-N 3.42Å; V61-D97 HydrophobicContact CG1-CB 3.79Å; V61-D97 VanDerWaalsContact CG1-CG 3.42Å; V61-D97 WeakPolarHBondContact CG1-OD1 3.22Å; V61-D97 HydrophobicContact CG2-CB 4.15Å; V61-D97 WeakPolarHBondContact CG2-OD2 3.49Å
62	P	96.9	Very high	92.5	Very high	5 Å²	5	62.4 Å²	62.4	3%	0.032	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61.7	133.2	171	-28	37.2	0	0	0	113.6	I52 L56 E60 S96 F105	I52-P62 HydrophobicContact CB-CB 4.46Å; I52-P62 HydrophobicContact CG1-CB 4.32Å; I52-P62 HydrophobicContact CG2-CB 3.96Å; I52-P62 HydrophobicContact CG2-CG 3.98Å; L56-P62 HydrophobicContact CD1-CG 4.39Å; L56-P62 HydrophobicContact CD2-CG 3.58Å; L56-P62 HydrophobicContact CG-CG 3.67Å; E60-P62 VanDerWaalsContact O-CD 3.26Å; E60-P62 WeakPolarHBondContact O-CD 3.28Å; P62-S96 WeakPolarHBondContact CD-OG 3.3Å; P62-S96 PolarHBondContact O-N 2.85Å; P62-S96 VanDerWaalsContact O-N 3.11Å; P62-S96 PolarHBondContact O-OG 3.26Å; P62-F105 HydrophobicContact CB-CE2 4.22Å; P62-F105 HydrophobicContact CB-CZ 3.67Å
63	I	95.8	Very high	92	Very high	71 Å²	71	65.7 Å²	65.7	36%	0.364	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.6	178.4	-54.4	-178.2	0	0	0	109.2	V61 V65 I94 R95	V61-I63 PolarHBondContact O-N 3.42Å; I63-V65 HydrophobicContact CG2-CG2 4.45Å; I63-I94 WeakPolarHBondContact CA-O 3.45Å; I63-R95 HydrophobicContact CD1-CG 4.2Å; I63-R95 HydrophobicContact CG1-CG 4.11Å; I63-R95 HydrophobicContact CG2-CG 4.47Å
64	L	95.8	Very high	91.4	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.037	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	168.1	-69.3	170.1	0	0	0	109.3	V48 I52 I94 F105 I108	V48-L64 HydrophobicContact CG1-CD2 3.6Å; I52-L64 HydrophobicContact CD1-CD2 4.21Å; L64-I94 HydrophobicContact CB-CB 4.27Å; L64-I94 PolarHBondContact N-O 2.97Å; L64-I94 PolarHBondContact O-N 3.26Å; L64-F105 HydrophobicContact CB-CD2 4.42Å; L64-F105 HydrophobicContact CB-CE2 4.29Å; L64-F105 HydrophobicContact CD1-CD2 3.76Å; L64-F105 HydrophobicContact CD1-CE2 3.77Å; L64-F105 HydrophobicContact CD1-CG 4.36Å; L64-F105 HydrophobicContact CD1-CZ 4.34Å; L64-F105 HydrophobicContact CG-CD2 3.96Å; L64-F105 HydrophobicContact CG-CE2 3.58Å; L64-F105 HydrophobicContact CG-CZ 4.28Å; L64-I108 HydrophobicContact CD1-CB 4.04Å; L64-I108 HydrophobicContact CD1-CD1 4.16Å; L64-I108 HydrophobicContact CD1-CG2 3.71Å
65	V	93.5	Very high	90.8	Very high	75 Å²	75	59.4 Å²	59.4	46%	0.455	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.1	179.6	-177.5	0	0	0	0	108.6	I63 V91	I63-V65 HydrophobicContact CG2-CG2 4.45Å; V65-V91 HydrophobicContact CG1-CB 3.59Å; V65-V91 HydrophobicContact CG1-CG1 3.89Å; V65-V91 HydrophobicContact CG1-CG2 3.75Å
66	L	91.3	Very high	90.3	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.5	-177.4	-59	177.9	0	0	0	111.1	N68 V91 T92 I94 I108 D150 M154	L66-N68 PolarHBondContact O-N 3.24Å; L66-V91 CarbonylContact O-C 3.5Å; L66-V91 VanDerWaalsContact O-CA 3.29Å; L66-V91 WeakPolarHBondContact O-CA 3.37Å; L66-T92 PolarHBondContact N-O 2.88Å; L66-T92 PolarHBondContact O-N 2.94Å; L66-I94 HydrophobicContact CD1-CD1 4.42Å; L66-I94 HydrophobicContact CD1-CG1 3.68Å; L66-I94 HydrophobicContact CG-CG1 4.22Å; L66-I108 HydrophobicContact CD1-CD1 3.83Å; L66-D150 HydrophobicContact CD1-CB 4.13Å; L66-D150 HydrophobicContact CD2-CB 4.4Å; L66-M154 HydrophobicContact CD2-CB 4.05Å; L66-M154 HydrophobicContact CD2-CG 4.15Å; L66-M154 HydrophobicContact CD2-SD 3.63Å
67	P	87.7	Confident	90	Very high	20 Å²	20	58.6 Å²	58.6	13%	0.13	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	133	168.5	-25.1	35.7	0	0	0	111.7	R69 M85 C153	P67-R69 PolarHBondContact O-N 2.93Å; P67-M85 HydrophobicContact CB-CE 4.08Å; P67-C153 HydrophobicContact CB-CB 4.46Å; P67-C153 HydrophobicContact CG-CB 4.27Å
68	N	85.8	Confident	89.5	Confident	46 Å²	46	57 Å²	57	25%	0.246	31%	0.309	C	S	.	.			trans	-80.4	89.2	176	179.7	-0.6	0	0	0	110.7	L66 S70 N74 S90	L66-N68 PolarHBondContact O-N 3.24Å; N68-S70 VanDerWaalsContact C-N 3.33Å; N68-S70 PolarHBondContact O-N 2.72Å; N68-S70 PolarHBondContact OD1-N 2.99Å; N68-N74 WeakPolarHBondContact CB-ND2 3.26Å; N68-N74 WeakPolarHBondContact O-CB 3.4Å; N68-N74 PolarHBondContact O-ND2 2.74Å; N68-S90 VanDerWaalsContact CB-O 3.25Å; N68-S90 WeakPolarHBondContact CB-O 3.41Å; N68-S90 PolarHBondContact N-O 2.84Å
69	R	84.3	Confident	88.9	Confident	10 Å²	10	53.7 Å²	53.7	4%	0.038	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-2	179.7	69.3	-173.8	177.7	89.8	8.6	115.4	P67 M85 S146 D149 D150 V288 S289	P67-R69 PolarHBondContact O-N 2.93Å; R69-M85 HydrophobicContact CB-CE 4.34Å; R69-M85 HydrophobicContact CB-SD 3.92Å; R69-S146 PolarHBondContact NH2-O 3.27Å; R69-S146 PolarHBondContact NH2-OG 2.87Å; R69-S146 VanDerWaalsContact NH2-OG 3.17Å; R69-D149 IonicContact CZ-OD2 3.54Å; R69-D149 VanDerWaalsContact NH1-CB 3.3Å; R69-D149 IonicContact NH1-OD2 2.76Å; R69-D149 PolarHBondContact NH1-OD2 3.24Å; R69-D149 IonicContact NH2-OD2 2.77Å; R69-D150 IonicContact CZ-OD1 2.63Å; R69-D150 IonicContact NE-OD1 3.79Å; R69-D150 PolarHBondContact NE-OD1 3.41Å; R69-D150 IonicContact NH2-OD1 3.82Å; R69-D150 PolarHBondContact NH2-OD1 3.05Å; R69-V288 CarbonylContact O-C 3.55Å; R69-V288 WeakPolarHBondContact O-CG1 3.31Å; R69-S289 PolarHBondContact NH1-O 2.96Å
70	S	80.5	Confident	88.3	Confident	86 Å²	86	48 Å²	48	60%	0.601	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-7.7	-172.9	-62.5	0	0	0	0	113.5	N68	N68-S70 VanDerWaalsContact C-N 3.33Å; N68-S70 PolarHBondContact O-N 2.72Å; N68-S70 PolarHBondContact OD1-N 2.99Å
71	S	84.2	Confident	87.6	Confident	39 Å²	39	44.3 Å²	44.3	27%	0.273	27%	0.27	S	S	.	.			trans	-105.1	130.1	-175.1	-177.9	0	0	0	0	111.5	A73 N74 I75	S71-A73 PolarHBondContact O-N 3.28Å; S71-A73 VanDerWaalsContact O-N 3.14Å; S71-A73 WeakPolarHBondContact OG-CB 3.32Å; S71-A73 PolarHBondContact OG-N 2.82Å; S71-N74 PolarHBondContact O-N 3.3Å; S71-I75 WeakPolarHBondContact O-CG1 3.47Å
72	W	82.8	Confident	87.2	Confident	90 Å²	90	41.9 Å²	41.9	34%	0.341	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-55.2	-26.8	169.5	-81.3	95.9	0	0	0	113.5	N74 I75 L83 V288 P340 Y341	W72-N74 PolarHBondContact O-N 2.87Å; W72-I75 HydrophobicContact CZ3-CG2 4.47Å; W72-I75 PolarHBondContact O-N 3.2Å; W72-L83 HydrophobicContact CH2-CD1 3.6Å; W72-L83 HydrophobicContact CH2-CD2 3.87Å; W72-L83 HydrophobicContact CH2-CG 4.4Å; W72-L83 HydrophobicContact CZ2-CD1 4.42Å; W72-L83 HydrophobicContact CZ3-CD1 4.17Å; W72-L83 HydrophobicContact CZ3-CD2 3.64Å; W72-V288 HydrophobicContact CD2-CG2 3.84Å; W72-V288 HydrophobicContact CE3-CG2 4.25Å; W72-V288 HydrophobicContact CG-CG2 4.41Å; W72-V288 HydrophobicContact CH2-CG2 3.67Å; W72-V288 HydrophobicContact CZ2-CG2 3.13Å; W72-V288 HydrophobicContact CZ3-CG2 4.21Å; W72-P340 HydrophobicContact CZ3-CG 4.01Å; W72-Y341 HydrophobicContact CH2-CE1 4.14Å
73	A	84.5	Confident	86.9	Confident	82 Å²	82	41.8 Å²	41.8	68%	0.678	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-65.8	-21.6	178	0	0	0	0	0	113.3	S71	S71-A73 PolarHBondContact O-N 3.28Å; S71-A73 VanDerWaalsContact O-N 3.14Å; S71-A73 WeakPolarHBondContact OG-CB 3.32Å; S71-A73 PolarHBondContact OG-N 2.82Å
74	N	84.4	Confident	86.4	Confident	9 Å²	9	40.4 Å²	40.4	5%	0.048	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-101.3	11.6	178.9	-57.1	-41.6	0	0	0	112.3	N68 S71 W72 M85 S86 H89 S90	N68-N74 WeakPolarHBondContact CB-ND2 3.26Å; N68-N74 WeakPolarHBondContact O-CB 3.4Å; N68-N74 PolarHBondContact O-ND2 2.74Å; S71-N74 PolarHBondContact O-N 3.3Å; W72-N74 PolarHBondContact O-N 2.87Å; N74-M85 HydrophobicContact CB-CE 4.41Å; N74-S86 WeakPolarHBondContact O-CB 3.36Å; N74-S86 PolarHBondContact O-N 2.87Å; N74-S86 PolarHBondContact O-OG 3.21Å; N74-H89 HydrophobicContact CB-CB 3.92Å; N74-S90 VanDerWaalsContact CG-OG 3.29Å; N74-S90 PolarHBondContact ND2-OG 2.84Å; N74-S90 PolarHBondContact OD1-N 3.34Å; N74-S90 PolarHBondContact OD1-OG 3.42Å
75	I	85.4	Confident	85.8	Confident	18 Å²	18	41.8 Å²	41.8	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.1	-176.4	-56.7	-61.2	0	0	0	109.2	S71 W72 L83 Q84 M85 V288 S291	S71-I75 WeakPolarHBondContact O-CG1 3.47Å; W72-I75 HydrophobicContact CZ3-CG2 4.47Å; W72-I75 PolarHBondContact O-N 3.2Å; I75-L83 HydrophobicContact CG2-CB 3.83Å; I75-L83 HydrophobicContact CG2-CD2 3.8Å; I75-L83 HydrophobicContact CG2-CG 4.3Å; I75-Q84 CarbonylContact C-O 3.59Å; I75-Q84 WeakPolarHBondContact CA-O 3.06Å; I75-M85 HydrophobicContact CD1-SD 3.63Å; I75-V288 HydrophobicContact CD1-CG1 4.21Å; I75-V288 HydrophobicContact CG1-CB 4.46Å; I75-V288 HydrophobicContact CG1-CG1 3.89Å; I75-V288 HydrophobicContact CG1-CG2 4.35Å; I75-S291 WeakPolarHBondContact CD1-OG 3.35Å
76	S	87.8	Confident	85.3	Confident	46 Å²	46	39.4 Å²	39.4	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	159.6	167.8	58.3	0	0	0	0	109.8	L83 Q84 S86	S76-L83 WeakPolarHBondContact O-CA 3.48Å; S76-Q84 PolarHBondContact N-O 3.17Å; S76-Q84 PolarHBondContact O-N 2.88Å; S76-Q84 PolarHBondContact OG-O 3.17Å; S76-S86 PolarHBondContact N-OG 3.43Å
77	F	88.7	Confident	84.5	Confident	54 Å²	54	44.7 Å²	44.7	24%	0.237	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.1	176.1	170.1	-114.4	0	0	0	109.5	L83 Y285 P340 Y341	F77-L83 HydrophobicContact CB-CD2 4.49Å; F77-Y285 AromaticContact CE2-CD1 3.62Å; F77-Y285 HydrophobicContact CE2-CD1 3.62Å; F77-Y285 AromaticContact CE2-CE1 3.91Å; F77-Y285 HydrophobicContact CE2-CE1 3.91Å; F77-Y285 HydrophobicContact CE2-CG 4.39Å; F77-Y285 HydrophobicContact CZ-CD1 4.2Å; F77-Y285 HydrophobicContact CZ-CE1 4.01Å; F77-P340 HydrophobicContact CB-CB 4.05Å; F77-P340 HydrophobicContact CB-CG 3.91Å; F77-Y341 HydrophobicContact CD2-CD1 4.35Å; F77-Y341 VanDerWaalsContact CE2-CB 3.44Å; F77-Y341 HydrophobicContact CE2-CG 4.45Å; F77-Y341 VanDerWaalsContact CZ-CB 3.42Å
78	D	87.8	Confident	84	Confident	61 Å²	61	52.2 Å²	52.2	33%	0.326	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134	170.5	177.8	-79.9	0	0	0	108.5	A80 V81 G82	D78-A80 VanDerWaalsContact C-N 3.31Å; D78-A80 PolarHBondContact O-N 3.01Å; D78-A80 WeakPolarHBondContact OD1-CA 3.34Å; D78-A80 WeakPolarHBondContact OD1-CB 3.39Å; D78-A80 PolarHBondContact OD1-N 2.61Å; D78-V81 HydrophobicContact CB-CB 4.35Å; D78-V81 PolarHBondContact O-N 3.4Å; D78-V81 PolarHBondContact OD1-N 2.91Å; D78-G82 PolarHBondContact N-O 3.36Å; D78-G82 VanDerWaalsContact O-CA 3.27Å; D78-G82 WeakPolarHBondContact O-CA 3.48Å; D78-G82 PolarHBondContact O-N 3.39Å
79	S	84.1	Confident	83.8	Confident	91 Å²	91	53.1 Å²	53.1	64%	0.636	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-26	-175.8	51	0	0	0	0	114.1
80	A	81.1	Confident	83.8	Confident	43 Å²	43	55.2 Å²	55.2	36%	0.355	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-21.2	179.5	0	0	0	0	0	112.7	D78 P300	D78-A80 VanDerWaalsContact C-N 3.31Å; D78-A80 PolarHBondContact O-N 3.01Å; D78-A80 WeakPolarHBondContact OD1-CA 3.34Å; D78-A80 WeakPolarHBondContact OD1-CB 3.39Å; D78-A80 PolarHBondContact OD1-N 2.61Å; A80-P300 WeakPolarHBondContact O-CG 3.37Å
81	V	81.6	Confident	84.2	Confident	22 Å²	22	54.8 Å²	54.8	13%	0.133	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-34.5	-177.9	179.8	0	0	0	0	113.4	D78 Q84 A294 H295 T298	D78-V81 HydrophobicContact CB-CB 4.35Å; D78-V81 PolarHBondContact O-N 3.4Å; D78-V81 PolarHBondContact OD1-N 2.91Å; V81-Q84 HydrophobicContact CB-CG 4.39Å; V81-Q84 HydrophobicContact CG1-CG 3.95Å; V81-A294 HydrophobicContact CG1-CB 4.16Å; V81-H295 HydrophobicContact CG1-CB 4.31Å; V81-H295 VanDerWaalsContact CG1-CD2 3.43Å; V81-H295 WeakPolarHBondContact CG1-CD2 3.45Å; V81-T298 VanDerWaalsContact O-CB 3.27Å; V81-T298 WeakPolarHBondContact O-CB 3.36Å; V81-T298 WeakPolarHBondContact O-CG2 3.31Å; V81-T298 PolarHBondContact O-OG1 3.06Å
82	G	87.9	Confident	84.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.9	-144.4	-169.9	0	0	0	0	0	112.6	D78	D78-G82 PolarHBondContact N-O 3.36Å; D78-G82 VanDerWaalsContact O-CA 3.27Å; D78-G82 WeakPolarHBondContact O-CA 3.48Å; D78-G82 PolarHBondContact O-N 3.39Å
83	L	89.2	Confident	85	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.4	-177.3	-62	177.8	0	0	0	111.1	W72 I75 S76 F77 Y285 V288 S291 A294 P340 Y341	W72-L83 HydrophobicContact CH2-CD1 3.6Å; W72-L83 HydrophobicContact CH2-CD2 3.87Å; W72-L83 HydrophobicContact CH2-CG 4.4Å; W72-L83 HydrophobicContact CZ2-CD1 4.42Å; W72-L83 HydrophobicContact CZ3-CD1 4.17Å; W72-L83 HydrophobicContact CZ3-CD2 3.64Å; I75-L83 HydrophobicContact CG2-CB 3.83Å; I75-L83 HydrophobicContact CG2-CD2 3.8Å; I75-L83 HydrophobicContact CG2-CG 4.3Å; S76-L83 WeakPolarHBondContact O-CA 3.48Å; F77-L83 HydrophobicContact CB-CD2 4.49Å; L83-Y285 WeakPolarHBondContact CB-O 3.39Å; L83-Y285 WeakPolarHBondContact CG-O 3.33Å; L83-Y285 PolarHBondContact N-O 2.9Å; L83-V288 HydrophobicContact CD1-CG2 4.28Å; L83-S291 WeakPolarHBondContact O-CA 3.48Å; L83-S291 WeakPolarHBondContact O-CB 3.44Å; L83-A294 WeakPolarHBondContact O-CB 3.46Å; L83-P340 HydrophobicContact CD2-CG 4.46Å; L83-Y341 HydrophobicContact CD1-CE1 4.23Å; L83-Y341 HydrophobicContact CD2-CD1 3.85Å; L83-Y341 HydrophobicContact CD2-CE1 3.95Å; L83-Y341 HydrophobicContact CG-CD1 4.42Å; L83-Y341 HydrophobicContact CG-CE1 4.28Å
84	Q	86.6	Confident	85.5	Confident	42 Å²	42	51.4 Å²	51.4	20%	0.196	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.7	179.6	-67.1	177.3	-24.5	0	0	111.1	I75 S76 V81 S86 H295	I75-Q84 CarbonylContact C-O 3.59Å; I75-Q84 WeakPolarHBondContact CA-O 3.06Å; S76-Q84 PolarHBondContact N-O 3.17Å; S76-Q84 PolarHBondContact O-N 2.88Å; S76-Q84 PolarHBondContact OG-O 3.17Å; V81-Q84 HydrophobicContact CB-CG 4.39Å; V81-Q84 HydrophobicContact CG1-CG 3.95Å; Q84-S86 PolarHBondContact O-N 2.98Å; Q84-H295 PolarHBondContact NE2-CE1 3.48Å; Q84-H295 PolarHBondContact NE2-NE2 3.11Å
85	M	83	Confident	86	Confident	36 Å²	36	55.8 Å²	55.8	18%	0.177	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	126.4	167.6	-79.1	-63.7	-70.4	0	0	109.5	P67 R69 N74 I75 H89 S291 F292	P67-M85 HydrophobicContact CB-CE 4.08Å; R69-M85 HydrophobicContact CB-CE 4.34Å; R69-M85 HydrophobicContact CB-SD 3.92Å; N74-M85 HydrophobicContact CB-CE 4.41Å; I75-M85 HydrophobicContact CD1-SD 3.63Å; M85-H89 HydrophobicContact CE-CB 3.89Å; M85-S291 VanDerWaalsContact CG-OG 3.26Å; M85-S291 WeakPolarHBondContact CG-OG 3.48Å; M85-S291 PolarHBondContact SD-OG 3.33Å; M85-S291 VanDerWaalsContact SD-OG 3.4Å; M85-F292 HydrophobicContact CG-CB 4.48Å
86	S	82.3	Confident	86.5	Confident	25 Å²	25	56.6 Å²	56.6	18%	0.175	33%	0.328	C	S	.	.			trans	-63.7	147.2	174.3	-60.1	0	0	0	0	111.1	N74 S76 Q84 E88 H89	N74-S86 WeakPolarHBondContact O-CB 3.36Å; N74-S86 PolarHBondContact O-N 2.87Å; N74-S86 PolarHBondContact O-OG 3.21Å; S76-S86 PolarHBondContact N-OG 3.43Å; Q84-S86 PolarHBondContact O-N 2.98Å; S86-E88 VanDerWaalsContact C-N 3.31Å; S86-E88 PolarHBondContact O-N 3.07Å; S86-H89 PolarHBondContact O-ND1 3.19Å
87	S	75.8	Confident	86.8	Confident	116 Å²	116	58.3 Å²	58.3	81%	0.811	33%	0.334	S	S	*	.	S	Bend	trans	-59.9	-43.4	173.4	49.4	0	0	0	0	111.5	H89	S87-H89 PolarHBondContact O-N 3.17Å; S87-H89 PolarHBondContact O-ND1 3.46Å
88	E	77.3	Confident	87.1	Confident	178 Å²	178	57.6 Å²	57.6	83%	0.832	34%	0.335	S	S	*	.	S	Bend	trans	-90.3	80.8	172.8	-62.3	-174.3	-178.3	0	0	110	S86	S86-E88 VanDerWaalsContact C-N 3.31Å; S86-E88 PolarHBondContact O-N 3.07Å
89	H	80.1	Confident	87.3	Confident	64 Å²	64	60.2 Å²	60.2	30%	0.296	36%	0.356	S	S	.	.			trans	-105.7	143.6	175.8	52.7	-89.6	0	0	0	111.2	N74 M85 S86 S87	N74-H89 HydrophobicContact CB-CB 3.92Å; M85-H89 HydrophobicContact CE-CB 3.89Å; S86-H89 PolarHBondContact O-ND1 3.19Å; S87-H89 PolarHBondContact O-N 3.17Å; S87-H89 PolarHBondContact O-ND1 3.46Å
90	S	85.6	Confident	87.7	Confident	54 Å²	54	61.2 Å²	61.2	38%	0.378	36%	0.363	S	S	.	.			trans	-64.2	147.3	167.3	50.9	0	0	0	0	110.7	N68 N74	N68-S90 VanDerWaalsContact CB-O 3.25Å; N68-S90 WeakPolarHBondContact CB-O 3.41Å; N68-S90 PolarHBondContact N-O 2.84Å; N74-S90 VanDerWaalsContact CG-OG 3.29Å; N74-S90 PolarHBondContact ND2-OG 2.84Å; N74-S90 PolarHBondContact OD1-N 3.34Å; N74-S90 PolarHBondContact OD1-OG 3.42Å
91	V	89.1	Confident	88.4	Confident	77 Å²	77	59.8 Å²	59.8	47%	0.467	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	151.5	176.9	-64.3	0	0	0	0	110.4	V65 L66	V65-V91 HydrophobicContact CG1-CB 3.59Å; V65-V91 HydrophobicContact CG1-CG1 3.89Å; V65-V91 HydrophobicContact CG1-CG2 3.75Å; L66-V91 CarbonylContact O-C 3.5Å; L66-V91 VanDerWaalsContact O-CA 3.29Å; L66-V91 WeakPolarHBondContact O-CA 3.37Å
92	T	90.3	Very high	89	Confident	62 Å²	62	61.5 Å²	61.5	38%	0.38	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.6	173.3	-52.9	0	0	0	0	108.9	L66 I94	L66-T92 PolarHBondContact N-O 2.88Å; L66-T92 PolarHBondContact O-N 2.94Å; T92-I94 HydrophobicContact CG2-CD1 3.97Å
93	S	92.6	Very high	89.4	Confident	69 Å²	69	65.2 Å²	65.2	48%	0.483	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.9	176.2	-60.7	0	0	0	0	110.5
94	I	94.9	Very high	89.6	Confident	10 Å²	10	68.2 Å²	68.2	5%	0.051	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	107.2	174.3	-52.5	-54.9	0	0	0	107.4	I63 L64 L66 T92 K104 F105 I108	I63-I94 WeakPolarHBondContact CA-O 3.45Å; L64-I94 HydrophobicContact CB-CB 4.27Å; L64-I94 PolarHBondContact N-O 2.97Å; L64-I94 PolarHBondContact O-N 3.26Å; L66-I94 HydrophobicContact CD1-CD1 4.42Å; L66-I94 HydrophobicContact CD1-CG1 3.68Å; L66-I94 HydrophobicContact CG-CG1 4.22Å; T92-I94 HydrophobicContact CG2-CD1 3.97Å; I94-K104 HydrophobicContact CD1-CD 4.02Å; I94-K104 HydrophobicContact CG2-CB 4.38Å; I94-F105 HydrophobicContact CG2-CB 3.79Å; I94-F105 HydrophobicContact CG2-CD2 4.07Å; I94-F105 HydrophobicContact CG2-CG 4.44Å; I94-F105 WeakPolarHBondContact O-CD2 3.46Å; I94-I108 HydrophobicContact CG1-CD1 4.45Å; I94-I108 HydrophobicContact CG2-CD1 4.45Å
95	R	94.9	Very high	90.1	Very high	101 Å²	101	66.9 Å²	66.9	38%	0.381	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	145.9	-179	-56.2	175.8	58.6	118.7	-2.7	111.1	I63 D97 C98 S101	I63-R95 HydrophobicContact CD1-CG 4.2Å; I63-R95 HydrophobicContact CG1-CG 4.11Å; I63-R95 HydrophobicContact CG2-CG 4.47Å; R95-D97 VanDerWaalsContact CB-OD1 3.24Å; R95-D97 WeakPolarHBondContact CB-OD1 3.48Å; R95-D97 IonicContact CZ-OD1 3.77Å; R95-D97 IonicContact CZ-OD2 3.34Å; R95-D97 IonicContact NE-OD1 2.75Å; R95-D97 PolarHBondContact NE-OD1 2.88Å; R95-D97 IonicContact NE-OD2 2.76Å; R95-D97 IonicContact NH2-OD1 3.24Å; R95-D97 PolarHBondContact NH2-OD1 2.72Å; R95-D97 IonicContact NH2-OD2 2.79Å; R95-D97 PolarHBondContact NH2-OD2 3.23Å; R95-C98 HydrophobicContact CB-CB 4.2Å; R95-S101 PolarHBondContact N-OG 3.36Å; R95-S101 PolarHBondContact O-OG 2.85Å
96	S	95.1	Very high	90.8	Very high	34 Å²	34	67.2 Å²	67.2	24%	0.238	40%	0.398	C	S	.	.	S	Bend	trans	-79.5	-18.1	176.4	66.9	0	0	0	0	114.1	P62 V102	P62-S96 WeakPolarHBondContact CD-OG 3.3Å; P62-S96 PolarHBondContact O-N 2.85Å; P62-S96 VanDerWaalsContact O-N 3.11Å; P62-S96 PolarHBondContact O-OG 3.26Å; S96-V102 VanDerWaalsContact O-CG2 3.31Å; S96-V102 WeakPolarHBondContact O-CG2 3.34Å
97	D	94.8	Very high	91.5	Very high	82 Å²	82	66.7 Å²	66.7	44%	0.439	39%	0.393	S	S	.	.	S	Bend	trans	-96.1	-8.7	-176.5	69.1	-21.3	0	0	0	114.1	V61 R95	V61-D97 HydrophobicContact CG1-CB 3.79Å; V61-D97 VanDerWaalsContact CG1-CG 3.42Å; V61-D97 WeakPolarHBondContact CG1-OD1 3.22Å; V61-D97 HydrophobicContact CG2-CB 4.15Å; V61-D97 WeakPolarHBondContact CG2-OD2 3.49Å; R95-D97 VanDerWaalsContact CB-OD1 3.24Å; R95-D97 WeakPolarHBondContact CB-OD1 3.48Å; R95-D97 IonicContact CZ-OD1 3.77Å; R95-D97 IonicContact CZ-OD2 3.34Å; R95-D97 IonicContact NE-OD1 2.75Å; R95-D97 PolarHBondContact NE-OD1 2.88Å; R95-D97 IonicContact NE-OD2 2.76Å; R95-D97 IonicContact NH2-OD1 3.24Å; R95-D97 PolarHBondContact NH2-OD1 2.72Å; R95-D97 IonicContact NH2-OD2 2.79Å; R95-D97 PolarHBondContact NH2-OD2 3.23Å
98	C	95.1	Very high	92.5	Very high	39 Å²	39	61.2 Å²	61.2	26%	0.264	36%	0.355	S	S	.	.			trans	-96.3	126	-174.5	-175.9	0	0	0	0	111.1	R95 S100 S101 V102	R95-C98 HydrophobicContact CB-CB 4.2Å; C98-S100 PolarHBondContact O-N 3.36Å; C98-S100 VanDerWaalsContact O-N 3.08Å; C98-S100 PolarHBondContact SG-OG 2.85Å; C98-S101 WeakPolarHBondContact CB-OG 3.49Å; C98-S101 PolarHBondContact O-N 3.17Å; C98-V102 WeakPolarHBondContact O-CB 3.39Å; C98-V102 PolarHBondContact O-N 2.98Å
99	P	92.9	Very high	93.4	Very high	117 Å²	117	55 Å²	55	76%	0.76	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-30.8	-179.4	-28.1	35	0	0	0	114.4
100	S	92.6	Very high	94.2	Very high	111 Å²	111	56 Å²	56	78%	0.776	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-24.7	-179.8	69.1	0	0	0	0	113.8	C98	C98-S100 PolarHBondContact O-N 3.36Å; C98-S100 VanDerWaalsContact O-N 3.08Å; C98-S100 PolarHBondContact SG-OG 2.85Å
101	S	94.5	Very high	94.8	Very high	13 Å²	13	53.4 Å²	53.4	9%	0.091	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-17.1	-174.8	62.6	0	0	0	0	114.5	R95 C98 T103 K104 F105	R95-S101 PolarHBondContact N-OG 3.36Å; R95-S101 PolarHBondContact O-OG 2.85Å; C98-S101 WeakPolarHBondContact CB-OG 3.49Å; C98-S101 PolarHBondContact O-N 3.17Å; S101-T103 VanDerWaalsContact C-N 3.28Å; S101-T103 PolarHBondContact O-N 3.45Å; S101-K104 PolarHBondContact O-N 3.5Å; S101-F105 PolarHBondContact O-N 2.96Å
102	V	95.1	Very high	95.2	Very high	59 Å²	59	49.8 Å²	49.8	36%	0.358	29%	0.29	S	S	.	.	H	α-helix	trans	-56.7	-39.5	-175.5	66	0	0	0	0	112.8	S96 C98 F105 A106	S96-V102 VanDerWaalsContact O-CG2 3.31Å; S96-V102 WeakPolarHBondContact O-CG2 3.34Å; C98-V102 WeakPolarHBondContact O-CB 3.39Å; C98-V102 PolarHBondContact O-N 2.98Å; V102-F105 WeakPolarHBondContact O-CB 3.45Å; V102-F105 PolarHBondContact O-N 2.92Å; V102-A106 PolarHBondContact O-N 3.07Å
103	T	94.9	Very high	95.5	Very high	79 Å²	79	49.6 Å²	49.6	49%	0.485	29%	0.291	S	S	.	.	H	α-helix	trans	-64.4	-44.5	176.7	-55.9	0	0	0	0	111.2	S101 F105 A106 Q107	S101-T103 VanDerWaalsContact C-N 3.28Å; S101-T103 PolarHBondContact O-N 3.45Å; T103-F105 VanDerWaalsContact C-N 3.35Å; T103-A106 PolarHBondContact O-N 3.33Å; T103-Q107 WeakPolarHBondContact O-CB 3.26Å; T103-Q107 WeakPolarHBondContact O-CG 3.36Å; T103-Q107 PolarHBondContact O-N 3.23Å
104	K	95.3	Very high	95.7	Very high	64 Å²	64	47.4 Å²	47.4	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-65.5	-40	177.3	-173.6	172.9	179.9	-178.2	0	110.8	I94 S101 Q107 I108 D150	I94-K104 HydrophobicContact CD1-CD 4.02Å; I94-K104 HydrophobicContact CG2-CB 4.38Å; S101-K104 PolarHBondContact O-N 3.5Å; K104-Q107 PolarHBondContact O-N 3.33Å; K104-I108 HydrophobicContact CG-CD1 3.96Å; K104-I108 HydrophobicContact CG-CG1 4.44Å; K104-I108 WeakPolarHBondContact O-CD1 3.43Å; K104-I108 VanDerWaalsContact O-CG1 3.27Å; K104-I108 WeakPolarHBondContact O-CG1 3.4Å; K104-I108 PolarHBondContact O-N 2.97Å; K104-D150 WeakPolarHBondContact CE-OD2 3.31Å; K104-D150 IonicContact NZ-OD2 3.86Å; K104-D150 PolarHBondContact NZ-OD2 3.35Å
105	F	96.9	Very high	95.8	Very high	14 Å²	14	47 Å²	47	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-56.4	-52.4	174.6	-168.7	-87.6	0	0	0	111.3	I52 P62 L64 I94 S101 V102 T103 Q107 I108 L109	I52-F105 HydrophobicContact CD1-CZ 4.13Å; I52-F105 HydrophobicContact CG1-CZ 4.4Å; P62-F105 HydrophobicContact CB-CE2 4.22Å; P62-F105 HydrophobicContact CB-CZ 3.67Å; L64-F105 HydrophobicContact CB-CD2 4.42Å; L64-F105 HydrophobicContact CB-CE2 4.29Å; L64-F105 HydrophobicContact CD1-CD2 3.76Å; L64-F105 HydrophobicContact CD1-CE2 3.77Å; L64-F105 HydrophobicContact CD1-CG 4.36Å; L64-F105 HydrophobicContact CD1-CZ 4.34Å; L64-F105 HydrophobicContact CG-CD2 3.96Å; L64-F105 HydrophobicContact CG-CE2 3.58Å; L64-F105 HydrophobicContact CG-CZ 4.28Å; I94-F105 HydrophobicContact CG2-CB 3.79Å; I94-F105 HydrophobicContact CG2-CD2 4.07Å; I94-F105 HydrophobicContact CG2-CG 4.44Å; I94-F105 WeakPolarHBondContact O-CD2 3.46Å; S101-F105 PolarHBondContact O-N 2.96Å; V102-F105 WeakPolarHBondContact O-CB 3.45Å; V102-F105 PolarHBondContact O-N 2.92Å; T103-F105 VanDerWaalsContact C-N 3.35Å; F105-Q107 VanDerWaalsContact C-N 3.35Å; F105-Q107 PolarHBondContact O-N 2.67Å; F105-I108 PolarHBondContact O-N 3.07Å; F105-L109 HydrophobicContact CD1-CD1 3.86Å; F105-L109 HydrophobicContact CD1-CG 4.3Å; F105-L109 HydrophobicContact CE1-CD1 3.43Å; F105-L109 VanDerWaalsContact CE1-CD1 3.43Å; F105-L109 HydrophobicContact CE1-CG 4.09Å; F105-L109 HydrophobicContact CZ-CD1 4.31Å; F105-L109 PolarHBondContact O-N 3.1Å
106	A	95.9	Very high	96	Very high	44 Å²	44	44.8 Å²	44.8	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-39.6	178.6	0	0	0	0	0	112.7	V102 T103 L109 K110	V102-A106 PolarHBondContact O-N 3.07Å; T103-A106 PolarHBondContact O-N 3.33Å; A106-L109 PolarHBondContact O-N 3.01Å; A106-K110 WeakPolarHBondContact O-CB 3.46Å; A106-K110 PolarHBondContact O-N 3.42Å
107	Q	97	Very high	96	Very high	14 Å²	14	51.2 Å²	51.2	7%	0.065	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.2	-71.2	166.4	-19.3	0	0	112.3	T103 K104 F105 K110 I111 L137 F138 I147	T103-Q107 WeakPolarHBondContact O-CB 3.26Å; T103-Q107 WeakPolarHBondContact O-CG 3.36Å; T103-Q107 PolarHBondContact O-N 3.23Å; K104-Q107 PolarHBondContact O-N 3.33Å; F105-Q107 VanDerWaalsContact C-N 3.35Å; F105-Q107 PolarHBondContact O-N 2.67Å; Q107-K110 PolarHBondContact O-N 3.14Å; Q107-I111 WeakPolarHBondContact O-CG1 3.29Å; Q107-I111 PolarHBondContact O-N 3.17Å; Q107-L137 HydrophobicContact CG-CD1 3.94Å; Q107-L137 HydrophobicContact CG-CD2 4.48Å; Q107-L137 HydrophobicContact CG-CG 3.88Å; Q107-L137 PolarHBondContact NE2-O 3.25Å; Q107-F138 HydrophobicContact CB-CD1 4.4Å; Q107-F138 HydrophobicContact CB-CE1 4.23Å; Q107-F138 HydrophobicContact CG-CD1 4.12Å; Q107-F138 HydrophobicContact CG-CE1 4.32Å; Q107-I147 HydrophobicContact CB-CD1 3.39Å; Q107-I147 HydrophobicContact CG-CD1 4.31Å
108	I	97.2	Very high	96.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-48.8	175.8	-67.9	159.9	0	0	0	110.2	L64 L66 I94 K104 F105 K110 I111 L112 I147 I151	L64-I108 HydrophobicContact CD1-CB 4.04Å; L64-I108 HydrophobicContact CD1-CD1 4.16Å; L64-I108 HydrophobicContact CD1-CG2 3.71Å; L66-I108 HydrophobicContact CD1-CD1 3.83Å; I94-I108 HydrophobicContact CG1-CD1 4.45Å; I94-I108 HydrophobicContact CG2-CD1 4.45Å; K104-I108 HydrophobicContact CG-CD1 3.96Å; K104-I108 HydrophobicContact CG-CG1 4.44Å; K104-I108 WeakPolarHBondContact O-CD1 3.43Å; K104-I108 VanDerWaalsContact O-CG1 3.27Å; K104-I108 WeakPolarHBondContact O-CG1 3.4Å; K104-I108 PolarHBondContact O-N 2.97Å; F105-I108 PolarHBondContact O-N 3.07Å; I108-K110 VanDerWaalsContact C-N 3.28Å; I108-K110 PolarHBondContact O-N 3.24Å; I108-I111 PolarHBondContact O-N 3.12Å; I108-I111 VanDerWaalsContact O-N 3.17Å; I108-L112 HydrophobicContact CG2-CD1 3.88Å; I108-L112 HydrophobicContact CG2-CG 4.26Å; I108-L112 WeakPolarHBondContact O-CG 3.38Å; I108-L112 PolarHBondContact O-N 3.47Å; I108-I147 HydrophobicContact CB-CG2 4.36Å; I108-I147 HydrophobicContact CG1-CG1 4.37Å; I108-I147 HydrophobicContact CG1-CG2 3.78Å; I108-I151 HydrophobicContact CG2-CD1 4.31Å; I108-I151 HydrophobicContact CG2-CG1 4.19Å
109	L	96.8	Very high	96.2	Very high	49 Å²	49	46.2 Å²	46.2	26%	0.257	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-40.9	177	-68.5	-176	0	0	0	112.4	I49 I52 F105 A106 I111 L112 S113	I49-L109 HydrophobicContact CD1-CD2 4Å; I52-L109 HydrophobicContact CD1-CD1 4.49Å; I52-L109 HydrophobicContact CD1-CD2 3.41Å; I52-L109 VanDerWaalsContact CD1-CD2 3.41Å; F105-L109 HydrophobicContact CD1-CD1 3.86Å; F105-L109 HydrophobicContact CD1-CG 4.3Å; F105-L109 HydrophobicContact CE1-CD1 3.43Å; F105-L109 VanDerWaalsContact CE1-CD1 3.43Å; F105-L109 HydrophobicContact CE1-CG 4.09Å; F105-L109 HydrophobicContact CZ-CD1 4.31Å; F105-L109 PolarHBondContact O-N 3.1Å; A106-L109 PolarHBondContact O-N 3.01Å; L109-I111 PolarHBondContact O-N 2.96Å; L109-L112 HydrophobicContact CD2-CD1 4.43Å; L109-L112 PolarHBondContact O-N 3.33Å; L109-S113 WeakPolarHBondContact O-CB 3.26Å; L109-S113 PolarHBondContact O-N 3.48Å
110	K	97.1	Very high	96.3	Very high	84 Å²	84	46.5 Å²	46.5	37%	0.365	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-42.8	177.5	-177.3	56.8	-178.8	174.2	0	111.7	A106 Q107 I108 S113 V114 L137 F138	A106-K110 WeakPolarHBondContact O-CB 3.46Å; A106-K110 PolarHBondContact O-N 3.42Å; Q107-K110 PolarHBondContact O-N 3.14Å; I108-K110 VanDerWaalsContact C-N 3.28Å; I108-K110 PolarHBondContact O-N 3.24Å; K110-S113 PolarHBondContact O-N 3.31Å; K110-V114 WeakPolarHBondContact O-CG2 3.26Å; K110-V114 PolarHBondContact O-N 3.37Å; K110-L137 HydrophobicContact CB-CD2 3.85Å; K110-L137 HydrophobicContact CG-CD2 3.83Å; K110-F138 HydrophobicContact CG-CZ 4.14Å
111	I	97.2	Very high	96.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.8	-40.9	178.8	-69.9	172.5	0	0	0	111	Q107 I108 L109 S113 V114 I115 I130 F138 V144 I147 I148 I151	Q107-I111 WeakPolarHBondContact O-CG1 3.29Å; Q107-I111 PolarHBondContact O-N 3.17Å; I108-I111 PolarHBondContact O-N 3.12Å; I108-I111 VanDerWaalsContact O-N 3.17Å; L109-I111 PolarHBondContact O-N 2.96Å; I111-S113 VanDerWaalsContact C-N 3.3Å; I111-S113 PolarHBondContact O-N 2.88Å; I111-V114 PolarHBondContact O-N 3.44Å; I111-V114 VanDerWaalsContact O-N 3.1Å; I111-I115 HydrophobicContact CG2-CD1 3.72Å; I111-I115 HydrophobicContact CG2-CG1 4.24Å; I111-I115 WeakPolarHBondContact O-CG1 3.4Å; I111-I115 PolarHBondContact O-N 3.4Å; I111-I130 HydrophobicContact CG1-CG2 4.31Å; I111-F138 HydrophobicContact CD1-CD1 4.36Å; I111-F138 HydrophobicContact CD1-CE1 3.61Å; I111-F138 HydrophobicContact CD1-CZ 4.12Å; I111-F138 HydrophobicContact CG1-CE1 3.71Å; I111-F138 HydrophobicContact CG1-CZ 3.78Å; I111-V144 HydrophobicContact CD1-CG1 4.26Å; I111-I147 HydrophobicContact CB-CG2 4.13Å; I111-I147 HydrophobicContact CD1-CB 3.72Å; I111-I147 HydrophobicContact CD1-CD1 4.2Å; I111-I147 HydrophobicContact CD1-CG2 3.45Å; I111-I147 VanDerWaalsContact CD1-CG2 3.45Å; I111-I147 HydrophobicContact CG1-CG2 4.3Å; I111-I147 HydrophobicContact CG2-CG2 4.39Å; I111-I148 HydrophobicContact CG2-CG1 4.12Å; I111-I151 HydrophobicContact CB-CD1 3.88Å; I111-I151 HydrophobicContact CG2-CD1 3.46Å; I111-I151 VanDerWaalsContact CG2-CD1 3.46Å
112	L	97.7	Very high	96.3	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-56.6	-44.3	172.1	-75.4	170.6	0	0	0	111.6	I45 V48 I108 L109 V114 I115 Y116 I151 M154 L155	I45-L112 HydrophobicContact CG1-CD2 4.23Å; I45-L112 HydrophobicContact CG2-CB 4.4Å; I45-L112 HydrophobicContact CG2-CD2 4.37Å; V48-L112 HydrophobicContact CG1-CD1 4.06Å; I108-L112 HydrophobicContact CG2-CD1 3.88Å; I108-L112 HydrophobicContact CG2-CG 4.26Å; I108-L112 WeakPolarHBondContact O-CG 3.38Å; I108-L112 PolarHBondContact O-N 3.47Å; L109-L112 HydrophobicContact CD2-CD1 4.43Å; L109-L112 PolarHBondContact O-N 3.33Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.45Å; L112-I115 PolarHBondContact O-N 2.82Å; L112-Y116 VanDerWaalsContact O-CB 3.31Å; L112-Y116 WeakPolarHBondContact O-CB 3.47Å; L112-Y116 PolarHBondContact O-N 2.85Å; L112-I151 HydrophobicContact CD2-CD1 4.08Å; L112-I151 HydrophobicContact CD2-CG1 4.15Å; L112-I151 HydrophobicContact CD2-CG2 3.75Å; L112-I151 HydrophobicContact CG-CD1 3.97Å; L112-I151 HydrophobicContact CG-CG1 4.33Å; L112-M154 HydrophobicContact CD1-CE 4.23Å; L112-M154 HydrophobicContact CD2-CE 4.18Å; L112-L155 HydrophobicContact CD2-CD1 4.26Å
113	S	97.4	Very high	96.2	Very high	57 Å²	57	47.9 Å²	47.9	40%	0.399	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-38.2	175.4	169.3	0	0	0	0	112.9	L109 K110 I111 R117	L109-S113 WeakPolarHBondContact O-CB 3.26Å; L109-S113 PolarHBondContact O-N 3.48Å; K110-S113 PolarHBondContact O-N 3.31Å; I111-S113 VanDerWaalsContact C-N 3.3Å; I111-S113 PolarHBondContact O-N 2.88Å; S113-R117 PolarHBondContact O-N 3.42Å
114	V	96.9	Very high	96	Very high	24 Å²	24	49.7 Å²	49.7	15%	0.145	25%	0.25	C	C	.	.	H	α-helix	trans	-67.2	-49.6	175.3	170.5	0	0	0	0	110.5	K110 I111 L112 Y116 R117 L118 I130	K110-V114 WeakPolarHBondContact O-CG2 3.26Å; K110-V114 PolarHBondContact O-N 3.37Å; I111-V114 PolarHBondContact O-N 3.44Å; I111-V114 VanDerWaalsContact O-N 3.1Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.45Å; V114-Y116 VanDerWaalsContact C-N 3.35Å; V114-Y116 PolarHBondContact O-N 3.2Å; V114-R117 PolarHBondContact O-N 3.04Å; V114-L118 HydrophobicContact CG1-CD1 3.9Å; V114-L118 HydrophobicContact CG1-CG 4.34Å; V114-L118 WeakPolarHBondContact O-CG 3.46Å; V114-L118 PolarHBondContact O-N 2.83Å; V114-I130 HydrophobicContact CG1-CD1 4.26Å; V114-I130 HydrophobicContact CG1-CG1 4.14Å
115	I	97.3	Very high	95.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-48.5	177.8	-70.1	167.7	0	0	0	110.5	I45 I111 L112 R117 L118 V119 I151 L162 V164	I45-I115 HydrophobicContact CD1-CB 4.44Å; I45-I115 HydrophobicContact CD1-CG2 3.71Å; I111-I115 HydrophobicContact CG2-CD1 3.72Å; I111-I115 HydrophobicContact CG2-CG1 4.24Å; I111-I115 WeakPolarHBondContact O-CG1 3.4Å; I111-I115 PolarHBondContact O-N 3.4Å; L112-I115 PolarHBondContact O-N 2.82Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 3.32Å; I115-L118 WeakPolarHBondContact O-CB 3.35Å; I115-L118 PolarHBondContact O-N 3.18Å; I115-V119 HydrophobicContact CG2-CG2 4.13Å; I115-V119 WeakPolarHBondContact O-CG2 3.44Å; I115-V119 PolarHBondContact O-N 2.85Å; I115-I151 HydrophobicContact CD1-CD1 4.15Å; I115-I151 HydrophobicContact CD1-CG2 3.95Å; I115-L162 HydrophobicContact CD1-CB 4.2Å; I115-L162 HydrophobicContact CD1-CD1 4.17Å; I115-L162 HydrophobicContact CG1-CB 4.37Å; I115-L162 HydrophobicContact CG2-CB 3.98Å; I115-L162 HydrophobicContact CG2-CD2 4.06Å; I115-V164 HydrophobicContact CG1-CG2 3.92Å
116	Y	97.6	Very high	95.6	Very high	56 Å²	56	48.6 Å²	48.6	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-53.6	-47.9	179	-174.4	-88.1	0	0	0	111.6	L42 I45 E46 L112 V114 V119 Q120	L42-Y116 HydrophobicContact CB-CE2 4.04Å; L42-Y116 HydrophobicContact CD2-CD1 4.41Å; L42-Y116 HydrophobicContact CD2-CD2 3.51Å; L42-Y116 HydrophobicContact CD2-CE1 4.43Å; L42-Y116 HydrophobicContact CD2-CE2 3.54Å; L42-Y116 HydrophobicContact CD2-CG 3.98Å; L42-Y116 HydrophobicContact CG-CE2 4.35Å; I45-Y116 HydrophobicContact CB-CD2 4.12Å; I45-Y116 HydrophobicContact CD1-CD2 4.44Å; I45-Y116 HydrophobicContact CG2-CD2 3.87Å; I45-Y116 HydrophobicContact CG2-CG 4.5Å; E46-Y116 HydrophobicContact CG-CE2 3.75Å; E46-Y116 WeakPolarHBondContact OE1-CE2 3.41Å; E46-Y116 PolarHBondContact OE1-OH 3.35Å; L112-Y116 VanDerWaalsContact O-CB 3.31Å; L112-Y116 WeakPolarHBondContact O-CB 3.47Å; L112-Y116 PolarHBondContact O-N 2.85Å; V114-Y116 VanDerWaalsContact C-N 3.35Å; V114-Y116 PolarHBondContact O-N 3.2Å; Y116-V119 PolarHBondContact O-N 2.83Å; Y116-Q120 WeakPolarHBondContact O-CB 3.44Å; Y116-Q120 PolarHBondContact O-N 2.88Å
117	R	97.1	Very high	95.4	Very high	168 Å²	168	47.7 Å²	47.7	63%	0.634	24%	0.239	S	C	*	.	H	α-helix	trans	-63.1	-42.2	175.9	-80.1	175.6	38.4	172.7	-8	113.1	S113 V114 I115 S121	S113-R117 PolarHBondContact O-N 3.42Å; V114-R117 PolarHBondContact O-N 3.04Å; I115-R117 VanDerWaalsContact C-N 3.3Å; I115-R117 PolarHBondContact O-N 3.32Å; R117-S121 WeakPolarHBondContact O-CB 3.39Å; R117-S121 PolarHBondContact O-N 3.12Å; R117-S121 PolarHBondContact O-OG 2.93Å
118	L	96.4	Very high	95	Very high	17 Å²	17	52.7 Å²	52.7	9%	0.089	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-46.5	179.6	-70.6	173.1	0	0	0	110.9	V114 I115 S121 N122 S123 A125 H163 V164	V114-L118 HydrophobicContact CG1-CD1 3.9Å; V114-L118 HydrophobicContact CG1-CG 4.34Å; V114-L118 WeakPolarHBondContact O-CG 3.46Å; V114-L118 PolarHBondContact O-N 2.83Å; I115-L118 WeakPolarHBondContact O-CB 3.35Å; I115-L118 PolarHBondContact O-N 3.18Å; L118-S121 PolarHBondContact O-N 2.97Å; L118-S121 PolarHBondContact O-OG 3.37Å; L118-N122 WeakPolarHBondContact O-CA 3.38Å; L118-N122 PolarHBondContact O-N 3.44Å; L118-N122 VanDerWaalsContact O-N 3.08Å; L118-S123 CarbonylContact C-O 3.13Å; L118-S123 WeakPolarHBondContact CB-O 3.3Å; L118-S123 WeakPolarHBondContact CD2-OG 3.18Å; L118-S123 PolarHBondContact O-N 3.06Å; L118-S123 VanDerWaalsContact O-O 3.08Å; L118-A125 HydrophobicContact CD1-CB 3.8Å; L118-A125 HydrophobicContact CD2-CB 3.96Å; L118-H163 HydrophobicContact CB-CB 3.8Å; L118-H163 PolarHBondContact O-ND1 3.1Å; L118-V164 HydrophobicContact CD1-CG2 4.31Å
119	V	95.9	Very high	94.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.9	-50.4	177.1	176.8	0	0	0	0	110.4	Q38 I41 L42 I115 Y116 S121 N122 H163	Q38-V119 HydrophobicContact CB-CG1 3.93Å; Q38-V119 HydrophobicContact CG-CG1 4.21Å; I41-V119 HydrophobicContact CB-CG1 4.34Å; I41-V119 HydrophobicContact CG2-CG1 4.49Å; I41-V119 HydrophobicContact CG2-CG2 4.17Å; L42-V119 HydrophobicContact CD1-CG1 4.42Å; L42-V119 HydrophobicContact CD2-CB 3.95Å; L42-V119 HydrophobicContact CD2-CG1 3.83Å; L42-V119 HydrophobicContact CG-CG1 3.84Å; I115-V119 HydrophobicContact CG2-CG2 4.13Å; I115-V119 WeakPolarHBondContact O-CG2 3.44Å; I115-V119 PolarHBondContact O-N 2.85Å; Y116-V119 PolarHBondContact O-N 2.83Å; V119-S121 VanDerWaalsContact C-N 3.29Å; V119-S121 PolarHBondContact O-N 3.39Å; V119-N122 PolarHBondContact O-N 3.12Å; V119-N122 VanDerWaalsContact O-N 3.08Å; V119-H163 HydrophobicContact CG2-CB 4.39Å
120	Q	96.6	Very high	94.6	Very high	122 Å²	122	54 Å²	54	57%	0.57	26%	0.264	S	S	*	.	H	α-helix	trans	-59.1	-36.5	179.6	-177	179.6	51.9	0	0	113.5	L42 Y116	L42-Q120 HydrophobicContact CD1-CB 4.43Å; L42-Q120 HydrophobicContact CD2-CB 4.18Å; Y116-Q120 WeakPolarHBondContact O-CB 3.44Å; Y116-Q120 PolarHBondContact O-N 2.88Å
121	S	95.6	Very high	94.4	Very high	73 Å²	73	51.6 Å²	51.6	51%	0.51	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	1.4	-179.8	58.2	0	0	0	0	113.7	R117 L118 V119 S123	R117-S121 WeakPolarHBondContact O-CB 3.39Å; R117-S121 PolarHBondContact O-N 3.12Å; R117-S121 PolarHBondContact O-OG 2.93Å; L118-S121 PolarHBondContact O-N 2.97Å; L118-S121 PolarHBondContact O-OG 3.37Å; V119-S121 VanDerWaalsContact C-N 3.29Å; V119-S121 PolarHBondContact O-N 3.39Å; S121-S123 PolarHBondContact O-N 3.17Å; S121-S123 PolarHBondContact OG-OG 2.91Å
122	N	91.1	Very high	94.1	Very high	92 Å²	92	58.3 Å²	58.3	49%	0.492	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	40.2	-169.8	-164.2	34.9	0	0	0	113.3	Q38 L118 V119 H163	Q38-N122 PolarHBondContact NE2-OD1 3.48Å; L118-N122 WeakPolarHBondContact O-CA 3.38Å; L118-N122 PolarHBondContact O-N 3.44Å; L118-N122 VanDerWaalsContact O-N 3.08Å; V119-N122 PolarHBondContact O-N 3.12Å; V119-N122 VanDerWaalsContact O-N 3.08Å; N122-H163 PolarHBondContact OD1-CE1 3.29Å
123	S	92.4	Very high	93.7	Very high	47 Å²	47	64.1 Å²	64.1	33%	0.329	31%	0.311	S	S	.	.			trans	-113.5	162.5	177.5	66.5	0	0	0	0	110.9	L118 S121 H163	L118-S123 CarbonylContact C-O 3.13Å; L118-S123 WeakPolarHBondContact CB-O 3.3Å; L118-S123 WeakPolarHBondContact CD2-OG 3.18Å; L118-S123 PolarHBondContact O-N 3.06Å; L118-S123 VanDerWaalsContact O-O 3.08Å; S121-S123 PolarHBondContact O-N 3.17Å; S121-S123 PolarHBondContact OG-OG 2.91Å; S123-H163 WeakPolarHBondContact O-CB 3.07Å; S123-H163 PolarHBondContact O-ND1 3.48Å
124	Y	91.3	Very high	93.4	Very high	118 Å²	118	64.2 Å²	64.2	46%	0.463	31%	0.307	S	S	.	.			trans	-124.1	149.9	-176	-64.7	-91.9	0	0	0	111.1	H163 L165	Y124-H163 WeakPolarHBondContact CA-O 3.36Å; Y124-H163 HydrophobicContact CD1-CB 3.79Å; Y124-H163 AromaticContact CD1-CG 3.99Å; Y124-H163 HydrophobicContact CE1-CB 3.97Å; Y124-H163 AromaticContact CE1-CD2 3.72Å; Y124-H163 AromaticContact CE1-CG 3.68Å; Y124-H163 HydrophobicContact CG-CB 4.46Å; Y124-L165 HydrophobicContact CD1-CD1 4.42Å; Y124-L165 HydrophobicContact CD1-CD2 3.82Å; Y124-L165 HydrophobicContact CD1-CG 4.06Å; Y124-L165 HydrophobicContact CE1-CD2 4.47Å; Y124-L165 HydrophobicContact CG-CD1 4.28Å; Y124-L165 HydrophobicContact CG-CD2 4.48Å; Y124-L165 HydrophobicContact CG-CG 4.37Å
125	A	92	Very high	93.1	Very high	15 Å²	15	66.6 Å²	66.6	12%	0.124	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148.6	171.7	0	0	0	0	0	110.9	L118 D129 I130 H163 V164 L165	L118-A125 HydrophobicContact CD1-CB 3.8Å; L118-A125 HydrophobicContact CD2-CB 3.96Å; A125-D129 HydrophobicContact CB-CB 4.42Å; A125-I130 HydrophobicContact CB-CG1 4.28Å; A125-H163 PolarHBondContact N-O 3.46Å; A125-V164 CarbonylContact O-C 3.53Å; A125-V164 WeakPolarHBondContact O-CA 3.13Å; A125-L165 PolarHBondContact O-N 3.09Å
126	T	91.3	Very high	92.8	Very high	39 Å²	39	73 Å²	73	24%	0.239	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	158.4	171.7	73.6	0	0	0	0	110.9	R128 D129 I130 L165	T126-R128 PolarHBondContact O-N 3.27Å; T126-R128 VanDerWaalsContact O-N 3.15Å; T126-R128 PolarHBondContact OG1-N 3.02Å; T126-D129 WeakPolarHBondContact CB-OD2 3.5Å; T126-D129 WeakPolarHBondContact CG2-OD2 3.28Å; T126-D129 PolarHBondContact N-OD2 2.78Å; T126-D129 PolarHBondContact O-N 3.44Å; T126-D129 PolarHBondContact OG1-N 3.36Å; T126-D129 PolarHBondContact OG1-OD1 3.09Å; T126-D129 PolarHBondContact OG1-OD2 2.6Å; T126-I130 PolarHBondContact O-N 3.05Å; T126-I130 VanDerWaalsContact O-N 3.15Å; T126-L165 WeakPolarHBondContact CA-O 3.21Å
127	K	90.8	Very high	92.6	Very high	26 Å²	26	72.5 Å²	72.5	11%	0.113	35%	0.349	C	S	.	.	H	α-helix	trans	-55.2	-32.7	173.2	-54.4	-165.5	-173.4	-175.9	0	112.8	Y131 D145 I148 V164 L165	K127-Y131 PolarHBondContact O-N 3.49Å; K127-Y131 VanDerWaalsContact O-N 3.09Å; K127-D145 WeakPolarHBondContact CD-OD1 3.33Å; K127-D145 IonicContact NZ-OD1 3.46Å; K127-I148 HydrophobicContact CB-CD1 4.38Å; K127-I148 HydrophobicContact CD-CD1 4.03Å; K127-I148 HydrophobicContact CG-CD1 3.88Å; K127-V164 HydrophobicContact CG-CG1 3.85Å; K127-L165 PolarHBondContact N-O 3.48Å
128	R	90	Very high	92.4	Very high	118 Å²	118	64.7 Å²	64.7	45%	0.445	32%	0.319	S	S	.	.	H	α-helix	trans	-70.1	-41.1	176.7	-69.6	-169.4	178	136.8	1.4	112	T126 I130 Y131 Y132	T126-R128 PolarHBondContact O-N 3.27Å; T126-R128 VanDerWaalsContact O-N 3.15Å; T126-R128 PolarHBondContact OG1-N 3.02Å; R128-I130 VanDerWaalsContact C-N 3.29Å; R128-I130 PolarHBondContact O-N 3.42Å; R128-Y131 WeakPolarHBondContact O-CB 3.37Å; R128-Y131 PolarHBondContact O-N 3.3Å; R128-Y131 VanDerWaalsContact O-N 3.14Å; R128-Y132 HydrophobicContact CB-CD2 4.31Å; R128-Y132 HydrophobicContact CB-CE2 4.19Å; R128-Y132 WeakPolarHBondContact O-CD2 3.33Å; R128-Y132 PolarHBondContact O-N 3.24Å
129	D	91.2	Very high	92.1	Very high	75 Å²	75	72.2 Å²	72.2	40%	0.401	35%	0.347	S	S	.	.	H	α-helix	trans	-61.2	-42.8	177	-55.2	-36.5	0	0	0	110.6	A125 T126 Y131 Y132 N133	A125-D129 HydrophobicContact CB-CB 4.42Å; T126-D129 WeakPolarHBondContact CB-OD2 3.5Å; T126-D129 WeakPolarHBondContact CG2-OD2 3.28Å; T126-D129 PolarHBondContact N-OD2 2.78Å; T126-D129 PolarHBondContact O-N 3.44Å; T126-D129 PolarHBondContact OG1-N 3.36Å; T126-D129 PolarHBondContact OG1-OD1 3.09Å; T126-D129 PolarHBondContact OG1-OD2 2.6Å; D129-Y131 VanDerWaalsContact C-N 3.33Å; D129-Y131 PolarHBondContact O-N 2.82Å; D129-Y132 PolarHBondContact O-N 2.77Å; D129-N133 VanDerWaalsContact O-CG 3.23Å; D129-N133 PolarHBondContact O-N 2.93Å; D129-N133 PolarHBondContact O-ND2 2.84Å; D129-N133 VanDerWaalsContact O-ND2 3.07Å
130	I	93.5	Very high	92	Very high	1 Å²	1	74.4 Å²	74.4	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-44.4	175	-60.3	175.8	0	0	0	110.9	I111 V114 A125 T126 R128 N133 F138 V144 I148 V164	I111-I130 HydrophobicContact CG1-CG2 4.31Å; V114-I130 HydrophobicContact CG1-CD1 4.26Å; V114-I130 HydrophobicContact CG1-CG1 4.14Å; A125-I130 HydrophobicContact CB-CG1 4.28Å; T126-I130 PolarHBondContact O-N 3.05Å; T126-I130 VanDerWaalsContact O-N 3.15Å; R128-I130 VanDerWaalsContact C-N 3.29Å; R128-I130 PolarHBondContact O-N 3.42Å; I130-N133 PolarHBondContact O-N 2.94Å; I130-F138 HydrophobicContact CG2-CE2 4.26Å; I130-F138 HydrophobicContact CG2-CZ 4.34Å; I130-F138 WeakPolarHBondContact O-CE2 3.24Å; I130-V144 HydrophobicContact CB-CG1 4.18Å; I130-V144 HydrophobicContact CG2-CG1 3.89Å; I130-I148 HydrophobicContact CD1-CD1 4.41Å; I130-V164 HydrophobicContact CD1-CB 4.32Å; I130-V164 HydrophobicContact CD1-CG1 3.6Å; I130-V164 HydrophobicContact CD1-CG2 3.72Å
131	Y	93.5	Very high	91.7	Very high	35 Å²	35	71.5 Å²	71.5	14%	0.137	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-47.9	176.4	170.1	-107.8	0	0	0	112.5	K127 R128 D129 N133 N134 I135 F138 R139 Q141 V144	K127-Y131 PolarHBondContact O-N 3.49Å; K127-Y131 VanDerWaalsContact O-N 3.09Å; R128-Y131 WeakPolarHBondContact O-CB 3.37Å; R128-Y131 PolarHBondContact O-N 3.3Å; R128-Y131 VanDerWaalsContact O-N 3.14Å; D129-Y131 VanDerWaalsContact C-N 3.33Å; D129-Y131 PolarHBondContact O-N 2.82Å; Y131-N133 VanDerWaalsContact C-N 3.29Å; Y131-N133 PolarHBondContact O-N 3.41Å; Y131-N134 CarbonylContact O-C 3.35Å; Y131-N134 VanDerWaalsContact O-C 3.31Å; Y131-N134 PolarHBondContact O-N 3.42Å; Y131-I135 HydrophobicContact CE1-CG1 4.38Å; Y131-I135 HydrophobicContact CE2-CG2 4.32Å; Y131-I135 PolarHBondContact O-N 3.45Å; Y131-F138 HydrophobicContact CD2-CB 4.02Å; Y131-F138 HydrophobicContact CE2-CB 4.44Å; Y131-R139 PolarHBondContact OH-O 3.39Å; Y131-Q141 HydrophobicContact CD1-CG 3.55Å; Y131-Q141 HydrophobicContact CD2-CG 4.08Å; Y131-Q141 HydrophobicContact CE1-CG 3.94Å; Y131-Q141 HydrophobicContact CE2-CG 4.45Å; Y131-Q141 HydrophobicContact CG-CG 3.61Å; Y131-V144 HydrophobicContact CD2-CG2 4.34Å
132	Y	91.7	Very high	91.5	Very high	141 Å²	141	78.2 Å²	78.2	55%	0.553	36%	0.362	S	S	*	.	H	α-helix	trans	-68	-28.4	-177.7	-74.6	-61.7	0	0	0	113.2	R128 D129 N134 I135	R128-Y132 HydrophobicContact CB-CD2 4.31Å; R128-Y132 HydrophobicContact CB-CE2 4.19Å; R128-Y132 WeakPolarHBondContact O-CD2 3.33Å; R128-Y132 PolarHBondContact O-N 3.24Å; D129-Y132 PolarHBondContact O-N 2.77Å; Y132-N134 PolarHBondContact O-N 3.39Å; Y132-I135 HydrophobicContact CD1-CD1 3.83Å; Y132-I135 HydrophobicContact CD1-CG1 4.18Å; Y132-I135 HydrophobicContact CE1-CD1 4.4Å
133	N	89.1	Confident	91.5	Very high	123 Å²	123	75.5 Å²	75.5	66%	0.658	35%	0.349	S	S	*	.	H	α-helix	trans	-61.6	-24.8	174.1	-77.7	-35.3	0	0	0	113.4	D129 I130 Y131	D129-N133 VanDerWaalsContact O-CG 3.23Å; D129-N133 PolarHBondContact O-N 2.93Å; D129-N133 PolarHBondContact O-ND2 2.84Å; D129-N133 VanDerWaalsContact O-ND2 3.07Å; I130-N133 PolarHBondContact O-N 2.94Å; Y131-N133 VanDerWaalsContact C-N 3.29Å; Y131-N133 PolarHBondContact O-N 3.41Å
134	N	89.3	Confident	91.6	Very high	58 Å²	58	73.3 Å²	73.3	31%	0.31	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.2	70.4	173.6	-159.2	-28.3	0	0	0	113.3	Y131 Y132 Q136 L137 F138	Y131-N134 CarbonylContact O-C 3.35Å; Y131-N134 VanDerWaalsContact O-C 3.31Å; Y131-N134 PolarHBondContact O-N 3.42Å; Y132-N134 PolarHBondContact O-N 3.39Å; N134-Q136 PolarHBondContact O-N 3.38Å; N134-L137 HydrophobicContact CB-CB 4.09Å; N134-L137 PolarHBondContact O-N 2.89Å; N134-L137 WeakPolarHBondContact OD1-CB 3.32Å; N134-L137 PolarHBondContact OD1-N 3.06Å; N134-F138 HydrophobicContact CB-CD2 4.2Å; N134-F138 HydrophobicContact CB-CE2 3.98Å; N134-F138 WeakPolarHBondContact O-CD2 3.38Å; N134-F138 PolarHBondContact O-N 2.67Å; N134-F138 VanDerWaalsContact O-N 3.14Å
135	I	91.6	Very high	91.6	Very high	75 Å²	75	70.2 Å²	70.2	39%	0.385	33%	0.325	S	S	.	.	H	α-helix	trans	-56.3	-38.9	-178.6	-57.2	173.3	0	0	0	111.8	Y131 Y132 R139	Y131-I135 HydrophobicContact CE1-CG1 4.38Å; Y131-I135 HydrophobicContact CE2-CG2 4.32Å; Y131-I135 PolarHBondContact O-N 3.45Å; Y132-I135 HydrophobicContact CD1-CD1 3.83Å; Y132-I135 HydrophobicContact CD1-CG1 4.18Å; Y132-I135 HydrophobicContact CE1-CD1 4.4Å; I135-R139 WeakPolarHBondContact O-CA 3.3Å; I135-R139 PolarHBondContact O-N 2.85Å
136	Q	91.5	Very high	91.5	Very high	134 Å²	134	71.6 Å²	71.6	63%	0.626	33%	0.334	S	S	*	.	H	α-helix	trans	-66.8	-39.1	-177.8	-68.2	-62.7	-15.2	0	0	112.4	N134 R139	N134-Q136 PolarHBondContact O-N 3.38Å; Q136-R139 WeakPolarHBondContact O-CD 3.48Å; Q136-R139 PolarHBondContact O-NE 2.69Å; Q136-R139 VanDerWaalsContact O-NE 3.11Å
137	L	92.3	Very high	91.7	Very high	46 Å²	46	69.9 Å²	69.9	24%	0.241	32%	0.323	C	S	.	.	H	α-helix	trans	-69.3	-47.3	176.8	179.2	63.7	0	0	0	111.3	Q107 K110 N134	Q107-L137 HydrophobicContact CG-CD1 3.94Å; Q107-L137 HydrophobicContact CG-CD2 4.48Å; Q107-L137 HydrophobicContact CG-CG 3.88Å; Q107-L137 PolarHBondContact NE2-O 3.25Å; K110-L137 HydrophobicContact CB-CD2 3.85Å; K110-L137 HydrophobicContact CG-CD2 3.83Å; N134-L137 HydrophobicContact CB-CB 4.09Å; N134-L137 PolarHBondContact O-N 2.89Å; N134-L137 WeakPolarHBondContact OD1-CB 3.32Å; N134-L137 PolarHBondContact OD1-N 3.06Å
138	F	92.8	Very high	91.8	Very high	3 Å²	3	68.7 Å²	68.7	1%	0.013	32%	0.318	C	S	.	.	H	α-helix	trans	-83.9	-26.9	-170.3	-63.5	-57.4	0	0	0	114.5	Q107 K110 I111 I130 Y131 N134 S140 T143 V144	Q107-F138 HydrophobicContact CB-CD1 4.4Å; Q107-F138 HydrophobicContact CB-CE1 4.23Å; Q107-F138 HydrophobicContact CG-CD1 4.12Å; Q107-F138 HydrophobicContact CG-CE1 4.32Å; K110-F138 HydrophobicContact CG-CZ 4.14Å; I111-F138 HydrophobicContact CD1-CD1 4.36Å; I111-F138 HydrophobicContact CD1-CE1 3.61Å; I111-F138 HydrophobicContact CD1-CZ 4.12Å; I111-F138 HydrophobicContact CG1-CE1 3.71Å; I111-F138 HydrophobicContact CG1-CZ 3.78Å; I130-F138 HydrophobicContact CG2-CE2 4.26Å; I130-F138 HydrophobicContact CG2-CZ 4.34Å; I130-F138 WeakPolarHBondContact O-CE2 3.24Å; Y131-F138 HydrophobicContact CD2-CB 4.02Å; Y131-F138 HydrophobicContact CE2-CB 4.44Å; N134-F138 HydrophobicContact CB-CD2 4.2Å; N134-F138 HydrophobicContact CB-CE2 3.98Å; N134-F138 WeakPolarHBondContact O-CD2 3.38Å; N134-F138 PolarHBondContact O-N 2.67Å; N134-F138 VanDerWaalsContact O-N 3.14Å; F138-S140 PolarHBondContact O-N 3.4Å; F138-T143 VanDerWaalsContact O-CB 3.28Å; F138-T143 WeakPolarHBondContact O-CB 3.33Å; F138-T143 PolarHBondContact O-OG1 2.87Å; F138-V144 HydrophobicContact CB-CG2 3.73Å; F138-V144 HydrophobicContact CD1-CG2 3.74Å; F138-V144 HydrophobicContact CD2-CG2 3.87Å; F138-V144 HydrophobicContact CE1-CG2 4.32Å; F138-V144 HydrophobicContact CE2-CG2 4.42Å; F138-V144 HydrophobicContact CG-CG2 3.49Å; F138-V144 VanDerWaalsContact CG-CG2 3.49Å
139	R	91.7	Very high	91.9	Very high	176 Å²	176	63.9 Å²	63.9	66%	0.664	30%	0.301	S	S	*	.			trans	64.2	-45.4	-176.7	-52.3	-64.6	-174	-172.8	-4.5	114.7	Y131 I135 Q136	Y131-R139 PolarHBondContact OH-O 3.39Å; I135-R139 WeakPolarHBondContact O-CA 3.3Å; I135-R139 PolarHBondContact O-N 2.85Å; Q136-R139 WeakPolarHBondContact O-CD 3.48Å; Q136-R139 PolarHBondContact O-NE 2.69Å; Q136-R139 VanDerWaalsContact O-NE 3.11Å
140	S	93	Very high	91.9	Very high	45 Å²	45	60.8 Å²	60.8	32%	0.315	29%	0.285	S	S	.	.	S	Bend	trans	-139.8	151.8	-178.7	84.8	0	0	0	0	112.5	F138 R142 T143	F138-S140 PolarHBondContact O-N 3.4Å; S140-R142 VanDerWaalsContact C-N 3.27Å; S140-R142 PolarHBondContact O-N 2.97Å; S140-T143 VanDerWaalsContact O-CB 3.31Å; S140-T143 WeakPolarHBondContact O-CB 3.4Å; S140-T143 PolarHBondContact O-N 2.79Å; S140-T143 PolarHBondContact O-OG1 3.25Å; S140-T143 PolarHBondContact OG-N 3.47Å; S140-T143 PolarHBondContact OG-OG1 2.88Å
141	Q	90.3	Very high	92	Very high	62 Å²	62	60.7 Å²	60.7	29%	0.29	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-35.6	172.8	-70.8	-178.5	11.4	0	0	111.8	Y131 T143 V144 D145	Y131-Q141 HydrophobicContact CD1-CG 3.55Å; Y131-Q141 HydrophobicContact CD2-CG 4.08Å; Y131-Q141 HydrophobicContact CE1-CG 3.94Å; Y131-Q141 HydrophobicContact CE2-CG 4.45Å; Y131-Q141 HydrophobicContact CG-CG 3.61Å; Q141-T143 PolarHBondContact O-N 2.79Å; Q141-V144 WeakPolarHBondContact O-CB 3.4Å; Q141-V144 PolarHBondContact O-N 3.26Å; Q141-D145 PolarHBondContact O-N 2.89Å
142	R	90.8	Very high	91.9	Very high	213 Å²	213	59.1 Å²	59.1	80%	0.804	28%	0.278	S	S	*	.	H	α-helix	trans	-58.5	-32.7	176.2	-66.2	-176.2	-173.9	166.8	1.9	112.6	S140 S146	S140-R142 VanDerWaalsContact C-N 3.27Å; S140-R142 PolarHBondContact O-N 2.97Å; R142-S146 VanDerWaalsContact O-CB 3.29Å; R142-S146 WeakPolarHBondContact O-CB 3.42Å; R142-S146 PolarHBondContact O-N 3.08Å
143	T	92.7	Very high	91.8	Very high	36 Å²	36	53 Å²	53	22%	0.221	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-47.2	175	-49.3	0	0	0	0	110.8	F138 S140 Q141 S146 I147	F138-T143 VanDerWaalsContact O-CB 3.28Å; F138-T143 WeakPolarHBondContact O-CB 3.33Å; F138-T143 PolarHBondContact O-OG1 2.87Å; S140-T143 VanDerWaalsContact O-CB 3.31Å; S140-T143 WeakPolarHBondContact O-CB 3.4Å; S140-T143 PolarHBondContact O-N 2.79Å; S140-T143 PolarHBondContact O-OG1 3.25Å; S140-T143 PolarHBondContact OG-N 3.47Å; S140-T143 PolarHBondContact OG-OG1 2.88Å; Q141-T143 PolarHBondContact O-N 2.79Å; T143-S146 PolarHBondContact O-N 3.47Å; T143-I147 HydrophobicContact CG2-CD1 3.95Å; T143-I147 VanDerWaalsContact O-CG1 3.31Å; T143-I147 WeakPolarHBondContact O-CG1 3.2Å; T143-I147 PolarHBondContact O-N 2.95Å
144	V	93.8	Very high	91.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-47.2	178.1	177.3	0	0	0	0	110.3	I111 I130 Y131 F138 Q141 S146 I147 I148	I111-V144 HydrophobicContact CD1-CG1 4.26Å; I130-V144 HydrophobicContact CB-CG1 4.18Å; I130-V144 HydrophobicContact CG2-CG1 3.89Å; Y131-V144 HydrophobicContact CD2-CG2 4.34Å; F138-V144 HydrophobicContact CB-CG2 3.73Å; F138-V144 HydrophobicContact CD1-CG2 3.74Å; F138-V144 HydrophobicContact CD2-CG2 3.87Å; F138-V144 HydrophobicContact CE1-CG2 4.32Å; F138-V144 HydrophobicContact CE2-CG2 4.42Å; F138-V144 HydrophobicContact CG-CG2 3.49Å; F138-V144 VanDerWaalsContact CG-CG2 3.49Å; Q141-V144 WeakPolarHBondContact O-CB 3.4Å; Q141-V144 PolarHBondContact O-N 3.26Å; V144-S146 VanDerWaalsContact C-N 3.33Å; V144-S146 PolarHBondContact O-N 3.48Å; V144-I147 PolarHBondContact O-N 3.4Å; V144-I148 HydrophobicContact CG1-CD1 3.58Å; V144-I148 HydrophobicContact CG1-CG1 4.38Å; V144-I148 WeakPolarHBondContact O-CD1 3.3Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.27Å; V144-I148 PolarHBondContact O-N 2.93Å
145	D	90.6	Very high	92.1	Very high	54 Å²	54	46.7 Å²	46.7	29%	0.289	22%	0.221	S	C	.	.	H	α-helix	trans	-55.1	-49.1	176.8	-65.8	-23	0	0	0	111.6	K127 Q141 I147 I148 D149	K127-D145 WeakPolarHBondContact CD-OD1 3.33Å; K127-D145 IonicContact NZ-OD1 3.46Å; Q141-D145 PolarHBondContact O-N 2.89Å; D145-I147 PolarHBondContact O-N 2.84Å; D145-I148 PolarHBondContact O-N 2.86Å; D145-D149 VanDerWaalsContact O-CG 3.3Å; D145-D149 PolarHBondContact O-N 3.35Å; D145-D149 VanDerWaalsContact O-N 3.08Å
146	S	91.5	Very high	91.9	Very high	44 Å²	44	50.3 Å²	50.3	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-64.3	-39.9	-178.2	-172.3	0	0	0	0	112.5	R69 R142 T143 V144 D149 D150	R69-S146 PolarHBondContact NH2-O 3.27Å; R69-S146 PolarHBondContact NH2-OG 2.87Å; R69-S146 VanDerWaalsContact NH2-OG 3.17Å; R142-S146 VanDerWaalsContact O-CB 3.29Å; R142-S146 WeakPolarHBondContact O-CB 3.42Å; R142-S146 PolarHBondContact O-N 3.08Å; T143-S146 PolarHBondContact O-N 3.47Å; V144-S146 VanDerWaalsContact C-N 3.33Å; V144-S146 PolarHBondContact O-N 3.48Å; S146-D149 PolarHBondContact O-N 3.32Å; S146-D150 PolarHBondContact O-N 2.71Å
147	I	94.4	Very high	91.8	Very high	3 Å²	3	44 Å²	44	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-71.4	-38.6	179	-68.7	171	0	0	0	111.5	Q107 I108 I111 T143 V144 D145 D149 D150 I151	Q107-I147 HydrophobicContact CB-CD1 3.39Å; Q107-I147 HydrophobicContact CG-CD1 4.31Å; I108-I147 HydrophobicContact CB-CG2 4.36Å; I108-I147 HydrophobicContact CG1-CG1 4.37Å; I108-I147 HydrophobicContact CG1-CG2 3.78Å; I111-I147 HydrophobicContact CB-CG2 4.13Å; I111-I147 HydrophobicContact CD1-CB 3.72Å; I111-I147 HydrophobicContact CD1-CD1 4.2Å; I111-I147 HydrophobicContact CD1-CG2 3.45Å; I111-I147 VanDerWaalsContact CD1-CG2 3.45Å; I111-I147 HydrophobicContact CG1-CG2 4.3Å; I111-I147 HydrophobicContact CG2-CG2 4.39Å; T143-I147 HydrophobicContact CG2-CD1 3.95Å; T143-I147 VanDerWaalsContact O-CG1 3.31Å; T143-I147 WeakPolarHBondContact O-CG1 3.2Å; T143-I147 PolarHBondContact O-N 2.95Å; V144-I147 PolarHBondContact O-N 3.4Å; D145-I147 PolarHBondContact O-N 2.84Å; I147-D149 VanDerWaalsContact C-N 3.31Å; I147-D149 PolarHBondContact O-N 3.02Å; I147-D150 PolarHBondContact O-N 2.7Å; I147-I151 HydrophobicContact CG2-CD1 3.73Å; I147-I151 HydrophobicContact CG2-CG1 4.26Å; I147-I151 WeakPolarHBondContact O-CB 3.47Å; I147-I151 VanDerWaalsContact O-CG1 3.31Å; I147-I151 WeakPolarHBondContact O-CG1 3.27Å; I147-I151 PolarHBondContact O-N 2.68Å
148	I	93.9	Very high	91.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-43.3	175	-69.5	159.4	0	0	0	110.4	I111 K127 I130 V144 D145 I151 S152 R159 V164	I111-I148 HydrophobicContact CG2-CG1 4.12Å; K127-I148 HydrophobicContact CB-CD1 4.38Å; K127-I148 HydrophobicContact CD-CD1 4.03Å; K127-I148 HydrophobicContact CG-CD1 3.88Å; I130-I148 HydrophobicContact CD1-CD1 4.41Å; V144-I148 HydrophobicContact CG1-CD1 3.58Å; V144-I148 HydrophobicContact CG1-CG1 4.38Å; V144-I148 WeakPolarHBondContact O-CD1 3.3Å; V144-I148 VanDerWaalsContact O-CG1 3.3Å; V144-I148 WeakPolarHBondContact O-CG1 3.27Å; V144-I148 PolarHBondContact O-N 2.93Å; D145-I148 PolarHBondContact O-N 2.86Å; I148-I151 PolarHBondContact O-N 2.89Å; I148-S152 WeakPolarHBondContact O-CB 3.41Å; I148-S152 PolarHBondContact O-N 3.39Å; I148-R159 HydrophobicContact CG2-CG 3.94Å; I148-V164 HydrophobicContact CD1-CG1 3.74Å
149	D	90.2	Very high	91.3	Very high	18 Å²	18	43.9 Å²	43.9	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-41.1	175.5	-66.9	-11.3	0	0	0	111.6	R69 D145 S146 I147 S152 C153 R159	R69-D149 IonicContact CZ-OD2 3.54Å; R69-D149 VanDerWaalsContact NH1-CB 3.3Å; R69-D149 IonicContact NH1-OD2 2.76Å; R69-D149 PolarHBondContact NH1-OD2 3.24Å; R69-D149 IonicContact NH2-OD2 2.77Å; D145-D149 VanDerWaalsContact O-CG 3.3Å; D145-D149 PolarHBondContact O-N 3.35Å; D145-D149 VanDerWaalsContact O-N 3.08Å; S146-D149 PolarHBondContact O-N 3.32Å; I147-D149 VanDerWaalsContact C-N 3.31Å; I147-D149 PolarHBondContact O-N 3.02Å; D149-S152 PolarHBondContact O-N 3.32Å; D149-C153 PolarHBondContact O-N 2.98Å; D149-C153 PolarHBondContact O-SG 2.96Å; D149-R159 VanDerWaalsContact OD1-CD 3.27Å; D149-R159 WeakPolarHBondContact OD1-CD 3.48Å; D149-R159 IonicContact OD1-CZ 2.85Å; D149-R159 IonicContact OD1-NE 2.83Å; D149-R159 IonicContact OD1-NH1 2.69Å; D149-R159 PolarHBondContact OD1-NH1 3.39Å
150	D	92.6	Very high	90.8	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.048	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-43	176.4	-72.8	-4.7	0	0	0	111.1	L66 R69 K104 S146 I147 C153 M154	L66-D150 HydrophobicContact CD1-CB 4.13Å; L66-D150 HydrophobicContact CD2-CB 4.4Å; R69-D150 IonicContact CZ-OD1 2.63Å; R69-D150 IonicContact NE-OD1 3.79Å; R69-D150 PolarHBondContact NE-OD1 3.41Å; R69-D150 IonicContact NH2-OD1 3.82Å; R69-D150 PolarHBondContact NH2-OD1 3.05Å; K104-D150 WeakPolarHBondContact CE-OD2 3.31Å; K104-D150 IonicContact NZ-OD2 3.86Å; K104-D150 PolarHBondContact NZ-OD2 3.35Å; S146-D150 PolarHBondContact O-N 2.71Å; I147-D150 PolarHBondContact O-N 2.7Å; D150-C153 PolarHBondContact O-N 3.4Å; D150-M154 VanDerWaalsContact O-CB 3.26Å; D150-M154 WeakPolarHBondContact O-CB 3.31Å; D150-M154 PolarHBondContact O-N 3.41Å
151	I	94.6	Very high	90.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-44.8	176.7	-71.3	167	0	0	0	111	I108 I111 L112 I115 I147 I148 C153 M154 L155 L162	I108-I151 HydrophobicContact CG2-CD1 4.31Å; I108-I151 HydrophobicContact CG2-CG1 4.19Å; I111-I151 HydrophobicContact CB-CD1 3.88Å; I111-I151 HydrophobicContact CG2-CD1 3.46Å; I111-I151 VanDerWaalsContact CG2-CD1 3.46Å; L112-I151 HydrophobicContact CD2-CD1 4.08Å; L112-I151 HydrophobicContact CD2-CG1 4.15Å; L112-I151 HydrophobicContact CD2-CG2 3.75Å; L112-I151 HydrophobicContact CG-CD1 3.97Å; L112-I151 HydrophobicContact CG-CG1 4.33Å; I115-I151 HydrophobicContact CD1-CD1 4.15Å; I115-I151 HydrophobicContact CD1-CG2 3.95Å; I147-I151 HydrophobicContact CG2-CD1 3.73Å; I147-I151 HydrophobicContact CG2-CG1 4.26Å; I147-I151 WeakPolarHBondContact O-CB 3.47Å; I147-I151 VanDerWaalsContact O-CG1 3.31Å; I147-I151 WeakPolarHBondContact O-CG1 3.27Å; I147-I151 PolarHBondContact O-N 2.68Å; I148-I151 PolarHBondContact O-N 2.89Å; I151-C153 VanDerWaalsContact C-N 3.28Å; I151-C153 PolarHBondContact O-N 3.5Å; I151-M154 PolarHBondContact O-N 3.19Å; I151-L155 HydrophobicContact CG2-CD1 3.63Å; I151-L155 HydrophobicContact CG2-CG 4.09Å; I151-L155 WeakPolarHBondContact O-CB 3.39Å; I151-L155 WeakPolarHBondContact O-CG 3.12Å; I151-L155 PolarHBondContact O-N 3.46Å; I151-L162 HydrophobicContact CG2-CD1 4.09Å
152	S	91.6	Very high	90.8	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-55.6	-44.6	176.2	175.7	0	0	0	0	111.2	I148 D149 K156 V157	I148-S152 WeakPolarHBondContact O-CB 3.41Å; I148-S152 PolarHBondContact O-N 3.39Å; D149-S152 PolarHBondContact O-N 3.32Å; S152-K156 CarbonylContact O-C 3.57Å; S152-K156 VanDerWaalsContact O-CA 3.28Å; S152-K156 WeakPolarHBondContact O-CA 3.45Å; S152-K156 PolarHBondContact O-N 3.44Å; S152-V157 VanDerWaalsContact CA-O 3.32Å; S152-V157 WeakPolarHBondContact CA-O 3.43Å; S152-V157 VanDerWaalsContact CB-O 3.31Å; S152-V157 WeakPolarHBondContact CB-O 2.91Å; S152-V157 PolarHBondContact O-N 3.15Å; S152-V157 PolarHBondContact OG-O 3.06Å
153	C	89.3	Confident	90.8	Very high	13 Å²	13	26.2 Å²	26.2	9%	0.088	14%	0.135	C	C	.	.	H	α-helix	trans	-69.6	-42.3	176.7	-63.4	0	0	0	0	112.5	P67 D149 D150 I151 K156	P67-C153 HydrophobicContact CB-CB 4.46Å; P67-C153 HydrophobicContact CG-CB 4.27Å; D149-C153 PolarHBondContact O-N 2.98Å; D149-C153 PolarHBondContact O-SG 2.96Å; D150-C153 PolarHBondContact O-N 3.4Å; I151-C153 VanDerWaalsContact C-N 3.28Å; I151-C153 PolarHBondContact O-N 3.5Å; C153-K156 PolarHBondContact O-N 3.42Å
154	M	92.4	Very high	90.8	Very high	37 Å²	37	24.7 Å²	24.7	18%	0.182	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-43.5	-179.7	-178.5	-175.3	69.7	0	0	111.8	V48 L66 L112 D150 I151	V48-M154 HydrophobicContact CG1-CE 4.42Å; V48-M154 HydrophobicContact CG2-CE 4.07Å; L66-M154 HydrophobicContact CD2-CB 4.05Å; L66-M154 HydrophobicContact CD2-CG 4.15Å; L66-M154 HydrophobicContact CD2-SD 3.63Å; L112-M154 HydrophobicContact CD1-CE 4.23Å; L112-M154 HydrophobicContact CD2-CE 4.18Å; D150-M154 VanDerWaalsContact O-CB 3.26Å; D150-M154 WeakPolarHBondContact O-CB 3.31Å; D150-M154 PolarHBondContact O-N 3.41Å; I151-M154 PolarHBondContact O-N 3.19Å
155	L	91.9	Very high	90.5	Very high	11 Å²	11	26.6 Å²	26.6	6%	0.058	14%	0.136	C	C	.	.	H	α-helix	trans	-83.1	-15.2	178.4	-59.3	-177.6	0	0	0	112.4	Q44 I45 V48 L112 I151 V157 L162	Q44-L155 HydrophobicContact CB-CD2 4.18Å; Q44-L155 PolarHBondContact OE1-O 3.14Å; I45-L155 HydrophobicContact CD1-CD1 4.48Å; I45-L155 HydrophobicContact CG1-CD1 3.81Å; V48-L155 HydrophobicContact CG2-CD2 4.01Å; L112-L155 HydrophobicContact CD2-CD1 4.26Å; I151-L155 HydrophobicContact CG2-CD1 3.63Å; I151-L155 HydrophobicContact CG2-CG 4.09Å; I151-L155 WeakPolarHBondContact O-CB 3.39Å; I151-L155 WeakPolarHBondContact O-CG 3.12Å; I151-L155 PolarHBondContact O-N 3.46Å; L155-V157 VanDerWaalsContact C-N 3.25Å; L155-V157 HydrophobicContact CB-CB 4.18Å; L155-V157 HydrophobicContact CB-CG2 3.91Å; L155-V157 PolarHBondContact O-N 3.09Å; L155-L162 HydrophobicContact CD1-CD2 4.06Å
156	K	88.9	Confident	90.2	Very high	152 Å²	152	24.9 Å²	24.9	66%	0.661	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	40.6	-168.7	-53.6	179.5	-179.2	178.2	0	112.3	S152 C153 F292	S152-K156 CarbonylContact O-C 3.57Å; S152-K156 VanDerWaalsContact O-CA 3.28Å; S152-K156 WeakPolarHBondContact O-CA 3.45Å; S152-K156 PolarHBondContact O-N 3.44Å; C153-K156 PolarHBondContact O-N 3.42Å; K156-F292 HydrophobicContact CB-CE2 4.07Å; K156-F292 HydrophobicContact CB-CZ 4Å; K156-F292 HydrophobicContact CG-CE2 4.44Å
157	V	89.8	Confident	89.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.			trans	-119.7	127.6	-178.6	174	0	0	0	0	109	I36 I41 S152 L155 L162	I36-V157 HydrophobicContact CD1-CG2 3.91Å; I36-V157 HydrophobicContact CG2-CG2 4.46Å; I41-V157 HydrophobicContact CD1-CG1 3.99Å; I41-V157 HydrophobicContact CG1-CG1 4.18Å; I41-V157 HydrophobicContact CG1-CG2 4.39Å; S152-V157 VanDerWaalsContact CA-O 3.32Å; S152-V157 WeakPolarHBondContact CA-O 3.43Å; S152-V157 VanDerWaalsContact CB-O 3.31Å; S152-V157 WeakPolarHBondContact CB-O 2.91Å; S152-V157 PolarHBondContact O-N 3.15Å; S152-V157 PolarHBondContact OG-O 3.06Å; L155-V157 VanDerWaalsContact C-N 3.25Å; L155-V157 HydrophobicContact CB-CB 4.18Å; L155-V157 HydrophobicContact CB-CG2 3.91Å; L155-V157 PolarHBondContact O-N 3.09Å; V157-L162 HydrophobicContact CB-CD2 4Å; V157-L162 HydrophobicContact CG1-CD2 3.64Å; V157-L162 HydrophobicContact CG1-CG 4.11Å
158	P	86.3	Confident	89.5	Confident	35 Å²	35	26.9 Å²	26.9	23%	0.227	14%	0.141	C	C	.	.			trans	-56.3	148	175.7	-24.7	34.3	0	0	0	112.2	R160 S161 L162 E293	P158-R160 PolarHBondContact O-N 2.89Å; P158-R160 VanDerWaalsContact O-N 3.17Å; P158-S161 WeakPolarHBondContact O-CB 3.41Å; P158-S161 PolarHBondContact O-N 3.15Å; P158-L162 PolarHBondContact O-N 3.18Å; P158-E293 WeakPolarHBondContact CA-OE2 3.49Å
159	R	86.6	Confident	89.5	Confident	13 Å²	13	31.1 Å²	31.1	5%	0.049	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-33.8	-173.5	-76	178.7	-71.1	-166.2	-10	113.6	I148 D149 S161 L162 E293	I148-R159 HydrophobicContact CG2-CG 3.94Å; D149-R159 VanDerWaalsContact OD1-CD 3.27Å; D149-R159 WeakPolarHBondContact OD1-CD 3.48Å; D149-R159 IonicContact OD1-CZ 2.85Å; D149-R159 IonicContact OD1-NE 2.83Å; D149-R159 IonicContact OD1-NH1 2.69Å; D149-R159 PolarHBondContact OD1-NH1 3.39Å; R159-S161 VanDerWaalsContact C-N 3.3Å; R159-S161 PolarHBondContact O-N 3.14Å; R159-L162 WeakPolarHBondContact O-CB 3.2Å; R159-L162 PolarHBondContact O-N 3.19Å; R159-L162 VanDerWaalsContact O-N 3.16Å; R159-E293 IonicContact CZ-OE1 3.5Å; R159-E293 PolarHBondContact N-OE2 3.19Å; R159-E293 IonicContact NE-OE1 3.51Å; R159-E293 PolarHBondContact NE-OE1 3.26Å; R159-E293 IonicContact NE-OE2 2.89Å; R159-E293 IonicContact NH2-OE1 3.6Å; R159-E293 PolarHBondContact NH2-OE1 3.45Å
160	R	82.9	Confident	89.8	Confident	83 Å²	83	30.2 Å²	30.2	31%	0.313	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-39	177	-175.4	169.7	177.3	-109.7	-0.9	111.7	P158 L162 H163 N200	P158-R160 PolarHBondContact O-N 2.89Å; P158-R160 VanDerWaalsContact O-N 3.17Å; R160-L162 PolarHBondContact O-N 3.23Å; R160-H163 PolarHBondContact O-N 3.32Å; R160-N200 PolarHBondContact NE-OD1 2.84Å; R160-N200 PolarHBondContact NH2-OD1 3.49Å
161	S	89.1	Confident	90	Very high	32 Å²	32	30.6 Å²	30.6	22%	0.224	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-21	177.6	-53.2	0	0	0	0	112.4	I41 P158 R159 H163	I41-S161 WeakPolarHBondContact CD1-O 3.42Å; P158-S161 WeakPolarHBondContact O-CB 3.41Å; P158-S161 PolarHBondContact O-N 3.15Å; R159-S161 VanDerWaalsContact C-N 3.3Å; R159-S161 PolarHBondContact O-N 3.14Å; S161-H163 PolarHBondContact O-CD2 3.37Å; S161-H163 VanDerWaalsContact O-CD2 3.32Å; S161-H163 PolarHBondContact O-N 3.22Å
162	L	92.7	Very high	90.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	3.6	170	-54.5	176.4	0	0	0	113.4	I41 I115 I151 L155 V157 P158 R159 R160 V164	I41-L162 HydrophobicContact CG2-CD2 4.3Å; I115-L162 HydrophobicContact CD1-CB 4.2Å; I115-L162 HydrophobicContact CD1-CD1 4.17Å; I115-L162 HydrophobicContact CG1-CB 4.37Å; I115-L162 HydrophobicContact CG2-CB 3.98Å; I115-L162 HydrophobicContact CG2-CD2 4.06Å; I151-L162 HydrophobicContact CG2-CD1 4.09Å; L155-L162 HydrophobicContact CD1-CD2 4.06Å; V157-L162 HydrophobicContact CB-CD2 4Å; V157-L162 HydrophobicContact CG1-CD2 3.64Å; V157-L162 HydrophobicContact CG1-CG 4.11Å; P158-L162 PolarHBondContact O-N 3.18Å; R159-L162 WeakPolarHBondContact O-CB 3.2Å; R159-L162 PolarHBondContact O-N 3.19Å; R159-L162 VanDerWaalsContact O-N 3.16Å; R160-L162 PolarHBondContact O-N 3.23Å; L162-V164 HydrophobicContact CB-CG2 4.49Å; L162-V164 PolarHBondContact O-N 3.01Å; L162-V164 VanDerWaalsContact O-N 3.12Å
163	H	92.3	Very high	90.4	Very high	9 Å²	9	30.6 Å²	30.6	4%	0.042	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	22.6	-176.9	-69.1	-157.9	0	0	0	114.1	Q38 L118 V119 N122 S123 Y124 A125 R160 S161	Q38-H163 PolarHBondContact NE2-CE1 2.97Å; L118-H163 HydrophobicContact CB-CB 3.8Å; L118-H163 PolarHBondContact O-ND1 3.1Å; V119-H163 HydrophobicContact CG2-CB 4.39Å; N122-H163 PolarHBondContact OD1-CE1 3.29Å; S123-H163 WeakPolarHBondContact O-CB 3.07Å; S123-H163 PolarHBondContact O-ND1 3.48Å; Y124-H163 WeakPolarHBondContact CA-O 3.36Å; Y124-H163 HydrophobicContact CD1-CB 3.79Å; Y124-H163 AromaticContact CD1-CG 3.99Å; Y124-H163 HydrophobicContact CE1-CB 3.97Å; Y124-H163 AromaticContact CE1-CD2 3.72Å; Y124-H163 AromaticContact CE1-CG 3.68Å; Y124-H163 HydrophobicContact CG-CB 4.46Å; A125-H163 PolarHBondContact N-O 3.46Å; R160-H163 PolarHBondContact O-N 3.32Å; S161-H163 PolarHBondContact O-CD2 3.37Å; S161-H163 VanDerWaalsContact O-CD2 3.32Å; S161-H163 PolarHBondContact O-N 3.22Å
164	V	91.5	Very high	90.7	Very high	4 Å²	4	30 Å²	30	2%	0.024	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.6	174.3	-173.8	0	0	0	0	109.9	I115 L118 A125 K127 I130 I148 L162	I115-V164 HydrophobicContact CG1-CG2 3.92Å; L118-V164 HydrophobicContact CD1-CG2 4.31Å; A125-V164 CarbonylContact O-C 3.53Å; A125-V164 WeakPolarHBondContact O-CA 3.13Å; K127-V164 HydrophobicContact CG-CG1 3.85Å; I130-V164 HydrophobicContact CD1-CB 4.32Å; I130-V164 HydrophobicContact CD1-CG1 3.6Å; I130-V164 HydrophobicContact CD1-CG2 3.72Å; I148-V164 HydrophobicContact CD1-CG1 3.74Å; L162-V164 HydrophobicContact CB-CG2 4.49Å; L162-V164 PolarHBondContact O-N 3.01Å; L162-V164 VanDerWaalsContact O-N 3.12Å
165	L	87.4	Confident	90.8	Very high	41 Å²	41	29.3 Å²	29.3	22%	0.215	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.6	-176.1	-59.5	177.9	0	0	0	111.5	Y124 A125 T126 K127	Y124-L165 HydrophobicContact CD1-CD1 4.42Å; Y124-L165 HydrophobicContact CD1-CD2 3.82Å; Y124-L165 HydrophobicContact CD1-CG 4.06Å; Y124-L165 HydrophobicContact CE1-CD2 4.47Å; Y124-L165 HydrophobicContact CG-CD1 4.28Å; Y124-L165 HydrophobicContact CG-CD2 4.48Å; Y124-L165 HydrophobicContact CG-CG 4.37Å; A125-L165 PolarHBondContact O-N 3.09Å; T126-L165 WeakPolarHBondContact CA-O 3.21Å; K127-L165 PolarHBondContact N-O 3.48Å
166	A	84.8	Confident	91.1	Very high	17 Å²	17	28.8 Å²	28.8	14%	0.14	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-77.3	138.4	167.4	0	0	0	0	0	109.6	S168 V249 N250	A166-S168 PolarHBondContact O-N 3.16Å; A166-V249 HydrophobicContact CB-CB 3.94Å; A166-V249 HydrophobicContact CB-CG2 4.16Å; A166-N250 PolarHBondContact O-ND2 3.24Å
167	T	84.6	Confident	91.4	Very high	59 Å²	59	22.1 Å²	22.1	36%	0.362	12%	0.119	S	C	.	.	P	Polyproline II helix	trans	-70.4	125.6	169.4	-51.9	0	0	0	0	109
168	S	87.2	Confident	91.8	Very high	31 Å²	31	22.2 Å²	22.2	22%	0.217	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-80.2	135.3	170.9	-169.6	0	0	0	0	110.1	A166 I197 N250	A166-S168 PolarHBondContact O-N 3.16Å; S168-I197 WeakPolarHBondContact CB-O 3.27Å; S168-I197 WeakPolarHBondContact OG-CB 3.42Å; S168-I197 PolarHBondContact OG-O 2.73Å; S168-N250 PolarHBondContact N-ND2 2.78Å
169	K	93.3	Very high	92.3	Very high	88 Å²	88	23 Å²	23	38%	0.383	12%	0.121	S	C	.	.			trans	-122.5	-7.5	168.9	58.6	165.4	177.4	152.4	0	112.7	G243 K244 V246 D248	K169-G243 WeakPolarHBondContact CE-O 3.48Å; K169-G243 PolarHBondContact NZ-O 3.02Å; K169-K244 HydrophobicContact CD-CB 4.4Å; K169-K244 PolarHBondContact NZ-O 3.13Å; K169-K244 WeakPolarHBondContact O-CD 3.35Å; K169-K244 WeakPolarHBondContact O-CE 3.42Å; K169-V246 WeakPolarHBondContact CE-O 3.44Å; K169-V246 PolarHBondContact NZ-O 3.32Å; K169-D248 HydrophobicContact CG-CB 4.32Å; K169-D248 WeakPolarHBondContact CG-OD2 3.3Å; K169-D248 PolarHBondContact N-OD2 3.01Å
170	G	96.4	Very high	92.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.			trans	-75.5	158.5	-175.3	0	0	0	0	0	112.9	I197 T242	G170-I197 PolarHBondContact O-N 3.4Å; G170-T242 CarbonylContact C-O 3.31Å; G170-T242 WeakPolarHBondContact CA-O 3.42Å
171	L	97.2	Very high	93	Very high	16 Å²	16	26.2 Å²	26.2	8%	0.084	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152.3	177.8	-57.9	175.1	0	0	0	110.2	A194 V195 F223 Q224 I241 T242	L171-A194 HydrophobicContact CB-CB 4.13Å; L171-A194 HydrophobicContact CD1-CB 4.23Å; L171-V195 CarbonylContact C-O 3.56Å; L171-V195 VanDerWaalsContact CA-O 3.3Å; L171-V195 WeakPolarHBondContact CA-O 3.38Å; L171-F223 HydrophobicContact CB-CE1 3.79Å; L171-F223 HydrophobicContact CB-CZ 4.02Å; L171-F223 HydrophobicContact CD1-CD1 4.35Å; L171-F223 HydrophobicContact CD1-CE1 4.11Å; L171-Q224 VanDerWaalsContact CD1-NE2 3.31Å; L171-I241 WeakPolarHBondContact O-CA 3.48Å; L171-T242 HydrophobicContact CB-CG2 3.87Å; L171-T242 HydrophobicContact CG-CG2 4.4Å; L171-T242 PolarHBondContact N-O 2.77Å; L171-T242 PolarHBondContact O-N 2.86Å
172	I	97	Very high	93.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.9	177.9	-173.9	161	0	0	0	110.7	L176 V195 I197 I239 L240 I241 M254 L258	I172-L176 HydrophobicContact CD1-CD2 3.36Å; I172-L176 HydrophobicContact CG1-CD2 4.17Å; I172-V195 HydrophobicContact CG2-CB 4.18Å; I172-V195 PolarHBondContact N-O 2.81Å; I172-V195 PolarHBondContact O-N 2.58Å; I172-I197 HydrophobicContact CB-CG1 4.25Å; I172-I197 HydrophobicContact CG2-CG1 4.21Å; I172-I239 HydrophobicContact CD1-CG2 3.81Å; I172-I239 HydrophobicContact CG1-CG2 3.82Å; I172-L240 WeakPolarHBondContact CA-O 3.37Å; I172-I241 HydrophobicContact CB-CG1 4.3Å; I172-I241 HydrophobicContact CD1-CD1 3.69Å; I172-I241 HydrophobicContact CD1-CG1 3.72Å; I172-I241 HydrophobicContact CG1-CD1 4.33Å; I172-I241 HydrophobicContact CG1-CG1 3.79Å; I172-M254 HydrophobicContact CD1-CE 3.66Å; I172-M254 HydrophobicContact CD1-CG 4.33Å; I172-L258 HydrophobicContact CD1-CD1 3.95Å
173	S	96.4	Very high	93.2	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.014	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	151.8	175.8	-179.2	0	0	0	0	109.9	C188 L240	S173-C188 CarbonylContact C-O 3.49Å; S173-L240 PolarHBondContact N-O 3.43Å; S173-L240 PolarHBondContact O-N 3.42Å
174	G	95.6	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	126.5	-164.2	179	0	0	0	0	0	113.3	L176 C188 H189 C238	G174-L176 VanDerWaalsContact C-N 3.33Å; G174-L176 PolarHBondContact O-N 3.29Å; G174-C188 PolarHBondContact N-O 3.39Å; G174-C188 CarbonylContact O-C 3.58Å; G174-H189 VanDerWaalsContact O-CA 3.31Å; G174-H189 WeakPolarHBondContact O-CA 3.49Å; G174-H189 PolarHBondContact O-N 3.46Å; G174-C238 CarbonylContact C-O 3.51Å; G174-C238 VanDerWaalsContact CA-O 3.29Å; G174-C238 WeakPolarHBondContact CA-O 3.44Å
175	D	95.9	Very high	93.5	Very high	23 Å²	23	43.3 Å²	43.3	12%	0.123	23%	0.231	C	C	.	.	S	Bend	trans	-69.4	85.7	-178.2	-174.4	-45.6	0	0	0	110.6	S209 S210 A211 P237 C238 I239	D175-S209 WeakPolarHBondContact O-CB 3.34Å; D175-S209 PolarHBondContact O-OG 2.59Å; D175-S209 WeakPolarHBondContact OD1-CA 3.4Å; D175-S209 PolarHBondContact OD1-OG 2.94Å; D175-S210 PolarHBondContact OD1-N 3.15Å; D175-S210 PolarHBondContact OD2-OG 3.44Å; D175-A211 HydrophobicContact CB-CB 4.34Å; D175-P237 HydrophobicContact CB-CB 4.01Å; D175-P237 VanDerWaalsContact OD2-CB 3.27Å; D175-P237 WeakPolarHBondContact OD2-CB 3.28Å; D175-C238 PolarHBondContact N-O 3.4Å; D175-I239 WeakPolarHBondContact O-CD1 3.44Å; D175-I239 VanDerWaalsContact O-CG1 3.3Å; D175-I239 WeakPolarHBondContact O-CG1 3.33Å
176	L	96.8	Very high	93.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.			trans	-159.7	131.9	179.4	176.2	66	0	0	0	111	I172 G174 Y178 C188 I207 I239 M254 L258	I172-L176 HydrophobicContact CD1-CD2 3.36Å; I172-L176 HydrophobicContact CG1-CD2 4.17Å; G174-L176 VanDerWaalsContact C-N 3.33Å; G174-L176 PolarHBondContact O-N 3.29Å; L176-Y178 HydrophobicContact CD1-CD1 4.31Å; L176-Y178 HydrophobicContact CD2-CD1 4Å; L176-Y178 HydrophobicContact CD2-CE1 4.02Å; L176-Y178 HydrophobicContact CG-CD1 3.96Å; L176-Y178 HydrophobicContact CG-CE1 4.39Å; L176-C188 HydrophobicContact CB-CB 4.09Å; L176-C188 WeakPolarHBondContact O-CB 3.41Å; L176-C188 PolarHBondContact O-N 2.97Å; L176-I207 HydrophobicContact CD1-CG2 3.78Å; L176-I239 HydrophobicContact CB-CD1 4.02Å; L176-I239 HydrophobicContact CB-CG1 4.17Å; L176-I239 HydrophobicContact CD1-CD1 4.43Å; L176-I239 HydrophobicContact CD2-CD1 4.5Å; L176-M254 HydrophobicContact CD2-CE 3.78Å; L176-L258 HydrophobicContact CD1-CD2 3.82Å; L176-L258 HydrophobicContact CD2-CD1 4.4Å; L176-L258 HydrophobicContact CD2-CD2 4.07Å
177	C	96.8	Very high	94.4	Very high	11 Å²	11	44.4 Å²	44.4	7%	0.074	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.6	163.8	-72	0	0	0	0	109.7	V186 D187 I208	C177-V186 VanDerWaalsContact CA-O 3.3Å; C177-V186 WeakPolarHBondContact CA-O 3.03Å; C177-D187 PolarHBondContact SG-OD1 2.87Å; C177-D187 VanDerWaalsContact SG-OD1 3.41Å; C177-I208 HydrophobicContact CB-CB 4.46Å; C177-I208 PolarHBondContact N-O 3.24Å; C177-I208 PolarHBondContact O-N 3.04Å
178	Y	97.3	Very high	94.8	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	171.2	172.3	59.8	-92.6	0	0	0	111.8	L176 E180 V186 I204 M254	L176-Y178 HydrophobicContact CD1-CD1 4.31Å; L176-Y178 HydrophobicContact CD2-CD1 4Å; L176-Y178 HydrophobicContact CD2-CE1 4.02Å; L176-Y178 HydrophobicContact CG-CD1 3.96Å; L176-Y178 HydrophobicContact CG-CE1 4.39Å; Y178-E180 HydrophobicContact CE2-CG 4.16Å; Y178-V186 HydrophobicContact CD1-CB 4.38Å; Y178-V186 HydrophobicContact CD2-CB 4.03Å; Y178-V186 HydrophobicContact CD2-CG2 4.29Å; Y178-V186 HydrophobicContact CE1-CB 4.02Å; Y178-V186 HydrophobicContact CE1-CG1 3.82Å; Y178-V186 HydrophobicContact CE2-CB 3.67Å; Y178-V186 HydrophobicContact CE2-CG1 4.11Å; Y178-V186 HydrophobicContact CE2-CG2 3.71Å; Y178-V186 HydrophobicContact CG-CB 4.39Å; Y178-V186 PolarHBondContact N-O 3.24Å; Y178-V186 PolarHBondContact O-N 3.35Å; Y178-I204 HydrophobicContact CD2-CB 4.32Å; Y178-I204 HydrophobicContact CD2-CD1 4.1Å; Y178-I204 HydrophobicContact CD2-CG1 3.97Å; Y178-I204 HydrophobicContact CD2-CG2 3.55Å; Y178-I204 HydrophobicContact CE2-CD1 3.74Å; Y178-I204 HydrophobicContact CE2-CG1 3.92Å; Y178-I204 HydrophobicContact CE2-CG2 4.29Å; Y178-I204 HydrophobicContact CG-CG2 3.78Å; Y178-M254 HydrophobicContact CD1-CE 4.33Å; Y178-M254 HydrophobicContact CE1-CE 3.87Å
179	L	97	Very high	94.9	Very high	51 Å²	51	43.1 Å²	43.1	27%	0.267	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.5	170.8	-61.8	-177.3	0	0	0	109.9	T184 R185 I204 R205 N206	L179-T184 WeakPolarHBondContact CA-O 3.33Å; L179-R185 HydrophobicContact CD2-CB 3.67Å; L179-R185 HydrophobicContact CD2-CG 4.09Å; L179-I204 CarbonylContact O-C 3.58Å; L179-I204 WeakPolarHBondContact O-CA 3.27Å; L179-R205 PolarHBondContact N-O 2.8Å; L179-R205 PolarHBondContact O-N 3.24Å; L179-N206 HydrophobicContact CD1-CB 4.17Å; L179-N206 WeakPolarHBondContact CD1-ND2 3.44Å; L179-N206 HydrophobicContact CG-CB 4.18Å
180	E	95	Very high	93.8	Very high	51 Å²	51	41.3 Å²	41.3	24%	0.238	22%	0.219	C	C	.	.			trans	-75.7	172.3	165.3	-62.8	-143.3	149.8	0	0	111.4	Y178 D182 G183 T184 V186 S198	Y178-E180 HydrophobicContact CE2-CG 4.16Å; E180-D182 WeakPolarHBondContact CB-OD1 3.47Å; E180-D182 PolarHBondContact O-N 3.44Å; E180-G183 PolarHBondContact O-N 2.78Å; E180-T184 PolarHBondContact N-O 2.94Å; E180-V186 HydrophobicContact CG-CG2 3.82Å; E180-S198 WeakPolarHBondContact OE1-CB 3.47Å; E180-S198 PolarHBondContact OE1-OG 2.94Å
181	E	89.4	Confident	92.4	Very high	112 Å²	112	47.3 Å²	47.3	52%	0.523	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.2	-178	-175.7	166	-154.8	0	0	112.9	G183 N200 G203	E181-G183 PolarHBondContact O-N 2.93Å; E181-N200 PolarHBondContact OE2-ND2 2.96Å; E181-G203 PolarHBondContact N-O 3.04Å
182	D	91.1	Very high	90.8	Very high	115 Å²	115	48.6 Å²	48.6	62%	0.615	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	0.7	177.4	70	-7.5	0	0	0	113.5	E180 T184	E180-D182 WeakPolarHBondContact CB-OD1 3.47Å; E180-D182 PolarHBondContact O-N 3.44Å; D182-T184 VanDerWaalsContact C-N 3.35Å; D182-T184 VanDerWaalsContact CG-OG1 3.22Å; D182-T184 WeakPolarHBondContact OD1-CB 3.5Å; D182-T184 PolarHBondContact OD1-N 2.72Å; D182-T184 PolarHBondContact OD1-OG1 2.87Å; D182-T184 PolarHBondContact OD2-OG1 3.36Å
183	G	93.5	Very high	90	Very high	49 Å²	49	53 Å²	53	51%	0.505	31%	0.307	S	S	.	.			trans	85.5	1	-177.3	0	0	0	0	0	114.5	E180 E181 R185	E180-G183 PolarHBondContact O-N 2.78Å; E181-G183 PolarHBondContact O-N 2.93Å; G183-R185 PolarHBondContact O-N 3.39Å
184	T	95.1	Very high	89.8	Confident	71 Å²	71	54 Å²	54	44%	0.436	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-62.2	123.2	175.3	-63	0	0	0	0	109.9	L179 E180 D182	L179-T184 WeakPolarHBondContact CA-O 3.33Å; E180-T184 PolarHBondContact N-O 2.94Å; D182-T184 VanDerWaalsContact C-N 3.35Å; D182-T184 VanDerWaalsContact CG-OG1 3.22Å; D182-T184 WeakPolarHBondContact OD1-CB 3.5Å; D182-T184 PolarHBondContact OD1-N 2.72Å; D182-T184 PolarHBondContact OD1-OG1 2.87Å; D182-T184 PolarHBondContact OD2-OG1 3.36Å
185	R	95.7	Very high	89.8	Confident	170 Å²	170	55.6 Å²	55.6	64%	0.642	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.7	173.7	-178	178	165.9	-157.5	-9.4	110	L179 G183 D187	L179-R185 HydrophobicContact CD2-CB 3.67Å; L179-R185 HydrophobicContact CD2-CG 4.09Å; G183-R185 PolarHBondContact O-N 3.39Å; R185-D187 IonicContact NH2-OD2 3.36Å; R185-D187 PolarHBondContact NH2-OD2 3.29Å
186	V	95.4	Very high	89.8	Confident	17 Å²	17	58.6 Å²	58.6	10%	0.103	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.6	173.3	-178.3	0	0	0	0	108.7	C177 Y178 E180 V195	C177-V186 VanDerWaalsContact CA-O 3.3Å; C177-V186 WeakPolarHBondContact CA-O 3.03Å; Y178-V186 HydrophobicContact CD1-CB 4.38Å; Y178-V186 HydrophobicContact CD2-CB 4.03Å; Y178-V186 HydrophobicContact CD2-CG2 4.29Å; Y178-V186 HydrophobicContact CE1-CB 4.02Å; Y178-V186 HydrophobicContact CE1-CG1 3.82Å; Y178-V186 HydrophobicContact CE2-CB 3.67Å; Y178-V186 HydrophobicContact CE2-CG1 4.11Å; Y178-V186 HydrophobicContact CE2-CG2 3.71Å; Y178-V186 HydrophobicContact CG-CB 4.39Å; Y178-V186 PolarHBondContact N-O 3.24Å; Y178-V186 PolarHBondContact O-N 3.35Å; E180-V186 HydrophobicContact CG-CG2 3.82Å; V186-V195 HydrophobicContact CG1-CG1 3.7Å; V186-V195 HydrophobicContact CG1-CG2 4.49Å
187	D	95	Very high	89.8	Confident	63 Å²	63	58.8 Å²	58.8	34%	0.337	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119.7	175.7	-165.6	-28.5	0	0	0	108.4	C177 R185 H189	C177-D187 PolarHBondContact SG-OD1 2.87Å; C177-D187 VanDerWaalsContact SG-OD1 3.41Å; R185-D187 IonicContact NH2-OD2 3.36Å; R185-D187 PolarHBondContact NH2-OD2 3.29Å; D187-H189 WeakPolarHBondContact OD1-CB 3.48Å; D187-H189 IonicContact OD1-CE1 3.92Å; D187-H189 IonicContact OD1-CG 3.65Å; D187-H189 PolarHBondContact OD1-N 3.41Å; D187-H189 IonicContact OD1-ND1 2.67Å; D187-H189 PolarHBondContact OD1-ND1 2.91Å; D187-H189 IonicContact OD2-ND1 3.07Å
188	C	94.5	Very high	89.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	35%	0.349	C	S	.	.			trans	-100.6	5.6	-176.9	-58.9	0	0	0	0	113.2	S173 G174 L176	S173-C188 CarbonylContact C-O 3.49Å; G174-C188 PolarHBondContact N-O 3.39Å; G174-C188 CarbonylContact O-C 3.58Å; L176-C188 HydrophobicContact CB-CB 4.09Å; L176-C188 WeakPolarHBondContact O-CB 3.41Å; L176-C188 PolarHBondContact O-N 2.97Å
189	H	88.9	Confident	89.1	Confident	64 Å²	64	60.8 Å²	60.8	30%	0.296	37%	0.367	S	S	.	.			trans	-57	152	-173.4	-78.7	81	0	0	0	113.1	G174 D187 S191 S192	G174-H189 VanDerWaalsContact O-CA 3.31Å; G174-H189 WeakPolarHBondContact O-CA 3.49Å; G174-H189 PolarHBondContact O-N 3.46Å; D187-H189 WeakPolarHBondContact OD1-CB 3.48Å; D187-H189 IonicContact OD1-CE1 3.92Å; D187-H189 IonicContact OD1-CG 3.65Å; D187-H189 PolarHBondContact OD1-N 3.41Å; D187-H189 IonicContact OD1-ND1 2.67Å; D187-H189 PolarHBondContact OD1-ND1 2.91Å; D187-H189 IonicContact OD2-ND1 3.07Å; H189-S191 PolarHBondContact O-N 2.85Å; H189-S192 PolarHBondContact O-N 2.8Å; H189-S192 PolarHBondContact O-OG 3.46Å
190	P	70.8	Confident	88.7	Confident	50 Å²	50	60.3 Å²	60.3	33%	0.325	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.6	-166.2	-24.9	35.6	0	0	0	115.9	S192 C232	P190-S192 PolarHBondContact O-N 3.08Å; P190-C232 HydrophobicContact CB-CB 3.9Å; P190-C232 HydrophobicContact CG-CB 3.47Å; P190-C232 VanDerWaalsContact CG-CB 3.47Å
191	S	66.1	Low	88.5	Confident	126 Å²	126	58.1 Å²	58.1	88%	0.881	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.4	174.4	53.9	0	0	0	0	113.7	H189	H189-S191 PolarHBondContact O-N 2.85Å
192	S	62.7	Low	88.4	Confident	42 Å²	42	54.7 Å²	54.7	29%	0.294	35%	0.349	S	S	.	.	S	Bend	trans	-106.3	141.6	175.3	65.3	0	0	0	0	110.4	H189 P190	H189-S192 PolarHBondContact O-N 2.8Å; H189-S192 PolarHBondContact O-OG 3.46Å; P190-S192 PolarHBondContact O-N 3.08Å
193	A	81.4	Confident	88.3	Confident	92 Å²	92	49.3 Å²	49.3	76%	0.76	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-52.6	150.8	168.9	0	0	0	0	0	110.1	V195	A193-V195 PolarHBondContact O-N 2.92Å
194	A	92	Very high	88.3	Confident	24 Å²	24	47.2 Å²	47.2	20%	0.198	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-51.8	132.6	-178.7	0	0	0	0	0	112	L171 F223 L227	L171-A194 HydrophobicContact CB-CB 4.13Å; L171-A194 HydrophobicContact CD1-CB 4.23Å; A194-F223 HydrophobicContact CB-CE1 3.61Å; A194-F223 HydrophobicContact CB-CZ 4.08Å; A194-L227 HydrophobicContact CB-CD1 3.73Å
195	V	95.3	Very high	88.3	Confident	34 Å²	34	51.3 Å²	51.3	21%	0.206	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	140	-177.4	-176.9	0	0	0	0	109.3	L171 I172 V186 A193	L171-V195 CarbonylContact C-O 3.56Å; L171-V195 VanDerWaalsContact CA-O 3.3Å; L171-V195 WeakPolarHBondContact CA-O 3.38Å; I172-V195 HydrophobicContact CG2-CB 4.18Å; I172-V195 PolarHBondContact N-O 2.81Å; I172-V195 PolarHBondContact O-N 2.58Å; V186-V195 HydrophobicContact CG1-CG1 3.7Å; V186-V195 HydrophobicContact CG1-CG2 4.49Å; A193-V195 PolarHBondContact O-N 2.92Å
196	S	95.8	Very high	88.3	Confident	86 Å²	86	48.5 Å²	48.5	60%	0.601	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	134.1	173	-64.9	0	0	0	0	110.6	S198	S196-S198 PolarHBondContact O-N 2.84Å
197	I	96.1	Very high	88.4	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-63.1	129.9	176.7	-67	176.5	0	0	0	109.1	S168 G170 I172 I201 I241 N250 M254	S168-I197 WeakPolarHBondContact CB-O 3.27Å; S168-I197 WeakPolarHBondContact OG-CB 3.42Å; S168-I197 PolarHBondContact OG-O 2.73Å; G170-I197 PolarHBondContact O-N 3.4Å; I172-I197 HydrophobicContact CB-CG1 4.25Å; I172-I197 HydrophobicContact CG2-CG1 4.21Å; I197-I201 HydrophobicContact CG2-CD1 3.65Å; I197-I241 HydrophobicContact CD1-CG2 3.89Å; I197-N250 HydrophobicContact CG2-CB 4.27Å; I197-M254 HydrophobicContact CD1-CB 4.49Å; I197-M254 HydrophobicContact CG2-CB 3.88Å; I197-M254 HydrophobicContact CG2-CG 4.23Å
198	S	92.4	Very high	88.5	Confident	11 Å²	11	51.8 Å²	51.8	8%	0.077	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-55.6	142.5	-178.5	-168.6	0	0	0	0	112.3	E180 S196 N200 I201	E180-S198 WeakPolarHBondContact OE1-CB 3.47Å; E180-S198 PolarHBondContact OE1-OG 2.94Å; S196-S198 PolarHBondContact O-N 2.84Å; S198-N200 PolarHBondContact O-N 2.9Å; S198-N200 PolarHBondContact OG-N 2.88Å; S198-I201 WeakPolarHBondContact O-CD1 3.03Å
199	A	87.9	Confident	88.6	Confident	45 Å²	45	53.3 Å²	53.3	37%	0.372	33%	0.329	S	S	.	.	S	Bend	trans	-71	-15.5	170.6	0	0	0	0	0	112.1
200	N	88.1	Confident	89	Confident	40 Å²	40	53.9 Å²	53.9	21%	0.214	34%	0.34	C	S	.	.			trans	-121.2	61.2	-173	-170.9	20.6	0	0	0	112.5	R160 E181 S198 G202 G203	R160-N200 PolarHBondContact NE-OD1 2.84Å; R160-N200 PolarHBondContact NH2-OD1 3.49Å; E181-N200 PolarHBondContact OE2-ND2 2.96Å; S198-N200 PolarHBondContact O-N 2.9Å; S198-N200 PolarHBondContact OG-N 2.88Å; N200-G202 VanDerWaalsContact C-N 3.26Å; N200-G202 PolarHBondContact O-N 3.49Å; N200-G203 PolarHBondContact O-N 3.04Å
201	I	91.8	Very high	90.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.026	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-57.4	-36.4	-176	-56.1	-58.5	0	0	0	113.4	I197 S198 G203 I204 N250 L253 M254 K257	I197-I201 HydrophobicContact CG2-CD1 3.65Å; S198-I201 WeakPolarHBondContact O-CD1 3.03Å; I201-G203 PolarHBondContact O-N 3.01Å; I201-I204 HydrophobicContact CD1-CD1 3.84Å; I201-I204 HydrophobicContact CG2-CD1 4.42Å; I201-I204 WeakPolarHBondContact O-CB 3.44Å; I201-I204 PolarHBondContact O-N 3.32Å; I201-N250 HydrophobicContact CG1-CB 4.21Å; I201-L253 HydrophobicContact CB-CB 3.96Å; I201-L253 HydrophobicContact CG1-CB 3.93Å; I201-L253 HydrophobicContact CG2-CB 3.88Å; I201-M254 HydrophobicContact CD1-CB 3.92Å; I201-M254 HydrophobicContact CD1-CG 4.42Å; I201-M254 HydrophobicContact CD1-SD 4.02Å; I201-K257 HydrophobicContact CG2-CB 4.08Å; I201-K257 HydrophobicContact CG2-CD 3.68Å; I201-K257 VanDerWaalsContact O-CD 3.3Å; I201-K257 WeakPolarHBondContact O-CD 3.17Å; I201-K257 WeakPolarHBondContact O-CE 3.3Å; I201-K257 PolarHBondContact O-NZ 3.46Å
202	G	86.2	Confident	91.7	Very high	40 Å²	40	48.2 Å²	48.2	41%	0.412	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-63.5	-31.6	178.5	0	0	0	0	0	113	N200 I204 K257	N200-G202 VanDerWaalsContact C-N 3.26Å; N200-G202 PolarHBondContact O-N 3.49Å; G202-I204 VanDerWaalsContact C-N 3.3Å; G202-I204 PolarHBondContact O-N 2.88Å; G202-K257 PolarHBondContact O-NZ 3.26Å; G202-K257 VanDerWaalsContact O-NZ 3.17Å
203	G	89.1	Confident	93.3	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.031	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-74.6	-13	177.4	0	0	0	0	0	115.1	E181 N200 I201 R205	E181-G203 PolarHBondContact N-O 3.04Å; N200-G203 PolarHBondContact O-N 3.04Å; I201-G203 PolarHBondContact O-N 3.01Å; G203-R205 PolarHBondContact O-N 2.98Å
204	I	94.9	Very high	94.1	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	25%	0.245	C	C	.	.			trans	-63.6	132.3	178.3	-66.3	175.7	0	0	0	110.8	Y178 L179 I201 G202 I207 M254 K257	Y178-I204 HydrophobicContact CD2-CB 4.32Å; Y178-I204 HydrophobicContact CD2-CD1 4.1Å; Y178-I204 HydrophobicContact CD2-CG1 3.97Å; Y178-I204 HydrophobicContact CD2-CG2 3.55Å; Y178-I204 HydrophobicContact CE2-CD1 3.74Å; Y178-I204 HydrophobicContact CE2-CG1 3.92Å; Y178-I204 HydrophobicContact CE2-CG2 4.29Å; Y178-I204 HydrophobicContact CG-CG2 3.78Å; L179-I204 CarbonylContact O-C 3.58Å; L179-I204 WeakPolarHBondContact O-CA 3.27Å; I201-I204 HydrophobicContact CD1-CD1 3.84Å; I201-I204 HydrophobicContact CG2-CD1 4.42Å; I201-I204 WeakPolarHBondContact O-CB 3.44Å; I201-I204 PolarHBondContact O-N 3.32Å; G202-I204 VanDerWaalsContact C-N 3.3Å; G202-I204 PolarHBondContact O-N 2.88Å; I204-I207 HydrophobicContact CG2-CD1 4.12Å; I204-I207 HydrophobicContact CG2-CG1 3.9Å; I204-M254 HydrophobicContact CD1-CE 4.41Å; I204-M254 HydrophobicContact CD1-SD 3.9Å; I204-K257 HydrophobicContact CB-CD 4.28Å; I204-K257 VanDerWaalsContact O-CE 3.22Å; I204-K257 WeakPolarHBondContact O-CE 3.34Å; I204-K257 PolarHBondContact O-NZ 3.15Å
205	R	94.8	Very high	94.5	Very high	157 Å²	157	40.7 Å²	40.7	59%	0.592	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.8	167.7	-179.8	-63.3	174.3	-170.7	-131.1	2.5	110.7	L179 G203 I207	L179-R205 PolarHBondContact N-O 2.8Å; L179-R205 PolarHBondContact O-N 3.24Å; G203-R205 PolarHBondContact O-N 2.98Å; R205-I207 PolarHBondContact O-N 3.13Å
206	N	95.9	Very high	94.6	Very high	110 Å²	110	39.2 Å²	39.2	59%	0.588	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	49.9	51.5	172.8	-62	-2.4	0	0	0	113.4	L179 I208	L179-N206 HydrophobicContact CD1-CB 4.17Å; L179-N206 WeakPolarHBondContact CD1-ND2 3.44Å; L179-N206 HydrophobicContact CG-CB 4.18Å; N206-I208 PolarHBondContact O-N 3.48Å
207	I	97.3	Very high	94.7	Very high	30 Å²	30	35.1 Å²	35.1	15%	0.154	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.2	174.1	-66.2	170.5	0	0	0	108.3	L176 I204 R205 K257 L258 T261 L262	L176-I207 HydrophobicContact CD1-CG2 3.78Å; I204-I207 HydrophobicContact CG2-CD1 4.12Å; I204-I207 HydrophobicContact CG2-CG1 3.9Å; R205-I207 PolarHBondContact O-N 3.13Å; I207-K257 HydrophobicContact CD1-CD 4.37Å; I207-K257 HydrophobicContact CD1-CG 3.99Å; I207-L258 HydrophobicContact CD1-CD2 4.38Å; I207-L258 HydrophobicContact CG2-CD2 4.1Å; I207-T261 HydrophobicContact CB-CG2 4.12Å; I207-T261 HydrophobicContact CD1-CG2 4.34Å; I207-T261 HydrophobicContact CG2-CG2 4.2Å; I207-L262 HydrophobicContact CG2-CD2 4.1Å
208	I	96.9	Very high	94.8	Very high	119 Å²	119	35.6 Å²	35.6	61%	0.61	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.3	178.3	-60.2	166.4	0	0	0	107.3	C177 N206	C177-I208 HydrophobicContact CB-CB 4.46Å; C177-I208 PolarHBondContact N-O 3.24Å; C177-I208 PolarHBondContact O-N 3.04Å; N206-I208 PolarHBondContact O-N 3.48Å
209	S	96.9	Very high	94.8	Very high	33 Å²	33	37.4 Å²	37.4	23%	0.231	21%	0.207	C	C	.	.			trans	-158	143.4	179.3	177	0	0	0	0	110.6	D175 A211	D175-S209 WeakPolarHBondContact O-CB 3.34Å; D175-S209 PolarHBondContact O-OG 2.59Å; D175-S209 WeakPolarHBondContact OD1-CA 3.4Å; D175-S209 PolarHBondContact OD1-OG 2.94Å; S209-A211 WeakPolarHBondContact OG-CB 3.16Å; S209-A211 PolarHBondContact OG-N 3.4Å
210	S	96.1	Very high	95.2	Very high	75 Å²	75	37.5 Å²	37.5	52%	0.524	20%	0.201	S	C	.	.			trans	-103.7	5.3	168.5	88.7	0	0	0	0	113	D175 K212 P237	D175-S210 PolarHBondContact OD1-N 3.15Å; D175-S210 PolarHBondContact OD2-OG 3.44Å; S210-K212 PolarHBondContact O-N 3.29Å; S210-P237 VanDerWaalsContact O-CG 3.27Å; S210-P237 WeakPolarHBondContact O-CG 3.36Å
211	A	96.6	Very high	95.5	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.033	22%	0.218	C	C	.	.			trans	-52.9	137.5	-176	0	0	0	0	0	112.8	D175 S209 P237 I239 I264	D175-A211 HydrophobicContact CB-CB 4.34Å; S209-A211 WeakPolarHBondContact OG-CB 3.16Å; S209-A211 PolarHBondContact OG-N 3.4Å; A211-P237 WeakPolarHBondContact CA-O 3.36Å; A211-I239 HydrophobicContact CB-CD1 3.83Å; A211-I239 HydrophobicContact CB-CG1 3.72Å; A211-I264 HydrophobicContact CB-CD1 3.93Å
212	K	96.7	Very high	95.6	Very high	54 Å²	54	38.9 Å²	38.9	24%	0.235	22%	0.218	C	C	.	.	S	Bend	trans	-86	-26.4	176.6	-69.1	-61.1	-163.7	151.3	0	112.9	F9 I12 D13 S210 P237 P265	F9-K212 HydrophobicContact CD1-CB 3.67Å; F9-K212 HydrophobicContact CD1-CG 3.75Å; F9-K212 HydrophobicContact CE1-CB 3.73Å; F9-K212 HydrophobicContact CE1-CG 3.89Å; F9-K212 HydrophobicContact CG-CB 4.48Å; F9-K212 HydrophobicContact CG-CG 4.1Å; F9-K212 HydrophobicContact CZ-CG 4.36Å; I12-K212 HydrophobicContact CG2-CB 4.33Å; I12-K212 WeakPolarHBondContact CG2-O 3.3Å; D13-K212 IonicContact OD1-NZ 2.69Å; D13-K212 PolarHBondContact OD1-NZ 3.2Å; D13-K212 IonicContact OD2-NZ 3.33Å; D13-K212 PolarHBondContact OD2-NZ 3.29Å; S210-K212 PolarHBondContact O-N 3.29Å; K212-P237 HydrophobicContact CG-CG 3.99Å; K212-P237 PolarHBondContact N-O 3.17Å; K212-P265 WeakPolarHBondContact O-CD 3.36Å
213	F	97.8	Very high	96.1	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	164	178.8	67.1	-88.1	0	0	0	111.1	F9 I12 M215 L235 C238 I239 P265 F267 L384	F9-F213 HydrophobicContact CE1-CD1 4.15Å; F9-F213 AromaticContact CE1-CE1 3.92Å; F9-F213 HydrophobicContact CE1-CE1 3.92Å; I12-F213 HydrophobicContact CD1-CD1 3.8Å; I12-F213 HydrophobicContact CD1-CE1 4.21Å; I12-F213 HydrophobicContact CD1-CG 4.5Å; I12-F213 HydrophobicContact CG2-CB 4.24Å; F213-M215 HydrophobicContact CD2-CB 4.33Å; F213-M215 HydrophobicContact CE2-CB 4.05Å; F213-M215 HydrophobicContact CE2-CE 3.74Å; F213-M215 HydrophobicContact CZ-CE 4.35Å; F213-L235 HydrophobicContact CZ-CB 4.36Å; F213-C238 HydrophobicContact CD1-CB 4.13Å; F213-C238 HydrophobicContact CD2-CB 4.2Å; F213-C238 HydrophobicContact CE1-CB 3.59Å; F213-C238 HydrophobicContact CE2-CB 3.64Å; F213-C238 HydrophobicContact CG-CB 4.42Å; F213-C238 HydrophobicContact CZ-CB 3.32Å; F213-I239 PolarHBondContact O-N 3.2Å; F213-I239 VanDerWaalsContact O-N 3.15Å; F213-P265 CarbonylContact C-O 3.54Å; F213-P265 VanDerWaalsContact CA-O 3.3Å; F213-P265 WeakPolarHBondContact CA-O 3.49Å; F213-P265 HydrophobicContact CB-CB 4.37Å; F213-F267 HydrophobicContact CB-CD2 3.88Å; F213-F267 HydrophobicContact CB-CE2 3.73Å; F213-F267 AromaticContact CD2-CD2 3.78Å; F213-F267 HydrophobicContact CD2-CD2 3.78Å; F213-F267 HydrophobicContact CD2-CE2 4.29Å; F213-F267 HydrophobicContact CG-CD2 4Å; F213-F267 HydrophobicContact CG-CE2 4.05Å; F213-L384 HydrophobicContact CE1-CD1 4.15Å; F213-L384 HydrophobicContact CE2-CD1 4.33Å; F213-L384 HydrophobicContact CZ-CD1 3.74Å
214	I	98.4	Very high	96.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.4	170.4	-56.5	171.3	0	0	0	108.1	I239 I241 L258 I264 P265 I266 F267	I214-I239 CarbonylContact C-O 3.5Å; I214-I239 WeakPolarHBondContact CA-O 3.49Å; I214-I239 HydrophobicContact CG1-CB 4.23Å; I214-I239 HydrophobicContact CG1-CD1 4.34Å; I214-I239 HydrophobicContact CG2-CB 4.5Å; I214-I239 HydrophobicContact CG2-CG2 4.49Å; I214-I241 HydrophobicContact CG2-CD1 3.79Å; I214-I241 HydrophobicContact CG2-CG1 4.18Å; I214-L258 HydrophobicContact CD1-CB 3.6Å; I214-L258 HydrophobicContact CD1-CD1 4.06Å; I214-L258 HydrophobicContact CD1-CG 4.49Å; I214-I264 HydrophobicContact CD1-CD1 4.19Å; I214-I264 HydrophobicContact CD1-CG1 4.18Å; I214-I264 HydrophobicContact CG1-CD1 3.74Å; I214-I264 HydrophobicContact CG1-CG1 4.04Å; I214-P265 PolarHBondContact N-O 2.69Å; I214-I266 HydrophobicContact CB-CD1 4.38Å; I214-I266 HydrophobicContact CB-CG1 4.16Å; I214-I266 HydrophobicContact CB-CG2 4.32Å; I214-I266 HydrophobicContact CD1-CD1 3.87Å; I214-I266 HydrophobicContact CD1-CG1 4.27Å; I214-I266 HydrophobicContact CG2-CG2 4.46Å; I214-I266 CarbonylContact O-C 3.58Å; I214-I266 WeakPolarHBondContact O-CA 3.17Å; I214-F267 PolarHBondContact O-N 3.13Å
215	M	98.4	Very high	96.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.5	173.3	-171.6	-177.9	-57.3	0	0	110.4	F213 V217 I239 L240 I241 F267 L269 L305 L380 L384	F213-M215 HydrophobicContact CD2-CB 4.33Å; F213-M215 HydrophobicContact CE2-CB 4.05Å; F213-M215 HydrophobicContact CE2-CE 3.74Å; F213-M215 HydrophobicContact CZ-CE 4.35Å; M215-V217 HydrophobicContact CG-CG2 4.39Å; M215-I239 PolarHBondContact N-O 3.17Å; M215-L240 HydrophobicContact CB-CD2 3.7Å; M215-L240 HydrophobicContact CG-CD2 4.34Å; M215-L240 WeakPolarHBondContact O-CA 3.42Å; M215-L240 HydrophobicContact SD-CD2 4.22Å; M215-I241 PolarHBondContact O-N 2.73Å; M215-F267 CarbonylContact C-O 3.49Å; M215-F267 VanDerWaalsContact CA-O 3.32Å; M215-F267 WeakPolarHBondContact CA-O 3.25Å; M215-L269 HydrophobicContact CG-CB 4.15Å; M215-L269 HydrophobicContact SD-CB 4.14Å; M215-L269 HydrophobicContact SD-CD2 3.93Å; M215-L305 HydrophobicContact CE-CD2 3.52Å; M215-L305 HydrophobicContact CG-CD2 4.48Å; M215-L305 HydrophobicContact SD-CD2 4.09Å; M215-L380 HydrophobicContact CE-CD2 4.2Å; M215-L380 HydrophobicContact SD-CD1 4.47Å; M215-L380 HydrophobicContact SD-CD2 4.26Å; M215-L384 HydrophobicContact CE-CD1 4.23Å
216	I	98.7	Very high	96.3	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.6	172.5	-57.8	171.9	0	0	0	107.8	I241 V255 I266 F267 L269 Y283 V302	I216-I241 CarbonylContact C-O 3.6Å; I216-I241 VanDerWaalsContact CA-O 3.3Å; I216-I241 WeakPolarHBondContact CA-O 3.35Å; I216-V255 HydrophobicContact CD1-CG1 3.97Å; I216-V255 HydrophobicContact CD1-CG2 4.29Å; I216-V255 HydrophobicContact CG1-CG2 4.33Å; I216-I266 HydrophobicContact CD1-CG2 3.66Å; I216-I266 HydrophobicContact CG1-CG2 3.93Å; I216-F267 PolarHBondContact N-O 2.79Å; I216-L269 PolarHBondContact O-N 2.69Å; I216-Y283 HydrophobicContact CD1-CD1 3.83Å; I216-Y283 HydrophobicContact CD1-CD2 4.12Å; I216-Y283 HydrophobicContact CD1-CE1 4.11Å; I216-Y283 HydrophobicContact CD1-CE2 4.37Å; I216-Y283 HydrophobicContact CD1-CG 3.82Å; I216-Y283 HydrophobicContact CG2-CD2 3.97Å; I216-Y283 HydrophobicContact CG2-CE1 4.45Å; I216-Y283 HydrophobicContact CG2-CE2 3.41Å; I216-Y283 VanDerWaalsContact CG2-CE2 3.41Å; I216-V302 HydrophobicContact CD1-CG2 4.35Å
217	V	98.3	Very high	96.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.6	177.5	-174.5	0	0	0	0	109	M215 T222 F223 L226 I241 T242	M215-V217 HydrophobicContact CG-CG2 4.39Å; V217-T222 HydrophobicContact CG1-CG2 3.95Å; V217-F223 HydrophobicContact CB-CB 4.2Å; V217-F223 HydrophobicContact CB-CD2 4.17Å; V217-F223 HydrophobicContact CG1-CB 3.99Å; V217-F223 HydrophobicContact CG2-CD2 4.24Å; V217-L226 HydrophobicContact CG1-CD1 4.26Å; V217-L226 HydrophobicContact CG2-CD1 3.83Å; V217-I241 PolarHBondContact N-O 2.96Å; V217-T242 WeakPolarHBondContact O-CA 3.41Å; V217-T242 WeakPolarHBondContact O-CB 3.44Å; V217-T242 PolarHBondContact O-OG1 3.26Å
218	E	96.7	Very high	96	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.065	20%	0.203	C	C	.	.	S	Bend	trans	-59.7	-62.4	-175.5	-169.4	-165.6	140.2	0	0	112.7	T242 G245 L269 V270 D271 G276 I279	E218-T242 PolarHBondContact O-OG1 2.92Å; E218-G245 PolarHBondContact O-N 3.09Å; E218-L269 PolarHBondContact N-O 3.39Å; E218-V270 HydrophobicContact CB-CB 4.38Å; E218-V270 HydrophobicContact CB-CG1 4.17Å; E218-V270 WeakPolarHBondContact OE2-CB 3Å; E218-D271 PolarHBondContact OE2-N 3.19Å; E218-G276 WeakPolarHBondContact OE2-CA 3.33Å; E218-I279 HydrophobicContact CG-CD1 3.5Å; E218-I279 HydrophobicContact CG-CG2 4.29Å; E218-I279 WeakPolarHBondContact OE1-CD1 3.46Å
219	K	94.1	Very high	95.7	Very high	49 Å²	49	33 Å²	33	21%	0.213	18%	0.18	C	C	.	.			trans	-94.2	141.4	-169.9	-71.3	176.3	171.8	171.9	0	111.8	A221 T222 F223 D271 E363	K219-A221 PolarHBondContact O-N 2.89Å; K219-T222 PolarHBondContact O-N 3.34Å; K219-F223 WeakPolarHBondContact O-CB 3.3Å; K219-F223 PolarHBondContact O-N 2.76Å; K219-D271 WeakPolarHBondContact CE-OD2 3.18Å; K219-D271 IonicContact NZ-OD2 2.81Å; K219-D271 PolarHBondContact NZ-OD2 3.49Å; K219-E363 IonicContact NZ-OE1 3.22Å; K219-E363 PolarHBondContact NZ-OE1 2.89Å
220	D	95.3	Very high	95.4	Very high	48 Å²	48	36 Å²	36	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-59.7	-45	175	-166.9	22.2	0	0	0	111.2	T222 F223 Q224 K244	D220-T222 VanDerWaalsContact C-N 3.33Å; D220-T222 PolarHBondContact O-N 2.79Å; D220-F223 CarbonylContact O-C 3.52Å; D220-F223 WeakPolarHBondContact O-CA 3.27Å; D220-F223 WeakPolarHBondContact O-CB 3.47Å; D220-F223 PolarHBondContact O-N 3.19Å; D220-F223 VanDerWaalsContact O-N 3.08Å; D220-Q224 WeakPolarHBondContact O-CG 3.27Å; D220-Q224 PolarHBondContact O-N 3.3Å; D220-Q224 PolarHBondContact OD1-NE2 3.17Å; D220-K244 HydrophobicContact CB-CB 4.27Å; D220-K244 HydrophobicContact CB-CD 3.96Å; D220-K244 HydrophobicContact CB-CG 3.87Å; D220-K244 VanDerWaalsContact CG-CE 3.48Å; D220-K244 IonicContact OD1-NZ 2.66Å; D220-K244 VanDerWaalsContact OD2-CE 3.29Å; D220-K244 WeakPolarHBondContact OD2-CE 3.1Å; D220-K244 IonicContact OD2-NZ 3.68Å; D220-K244 PolarHBondContact OD2-NZ 3.11Å
221	A	93.8	Very high	95.2	Very high	69 Å²	69	32.4 Å²	32.4	57%	0.57	17%	0.168	S	C	*	.	H	α-helix	trans	-58.8	-42.5	179.3	0	0	0	0	0	112.7	K219 R225	K219-A221 PolarHBondContact O-N 2.89Å; A221-R225 WeakPolarHBondContact O-CB 3.48Å; A221-R225 PolarHBondContact O-N 2.93Å
222	T	95.4	Very high	94.9	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-45.1	174.4	-51.1	0	0	0	0	110.4	V217 K219 D220 Q224 R225 L226 L364 Q365 L375	V217-T222 HydrophobicContact CG1-CG2 3.95Å; K219-T222 PolarHBondContact O-N 3.34Å; D220-T222 VanDerWaalsContact C-N 3.33Å; D220-T222 PolarHBondContact O-N 2.79Å; T222-Q224 PolarHBondContact O-N 2.8Å; T222-R225 PolarHBondContact O-N 3.44Å; T222-L226 HydrophobicContact CG2-CD1 4.41Å; T222-L226 HydrophobicContact CG2-CG 4.44Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.37Å; T222-L226 PolarHBondContact O-N 2.85Å; T222-L364 HydrophobicContact CG2-CB 4.37Å; T222-L364 HydrophobicContact CG2-CD1 4.08Å; T222-Q365 PolarHBondContact OG1-NE2 3.04Å; T222-Q365 VanDerWaalsContact OG1-NE2 3.07Å; T222-L375 HydrophobicContact CG2-CD2 4.19Å
223	F	96.5	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.8	-47.9	177.8	177.9	-90.4	0	0	0	112.4	L171 A194 V217 K219 D220 L226 L227 L240 T242	L171-F223 HydrophobicContact CB-CE1 3.79Å; L171-F223 HydrophobicContact CB-CZ 4.02Å; L171-F223 HydrophobicContact CD1-CD1 4.35Å; L171-F223 HydrophobicContact CD1-CE1 4.11Å; A194-F223 HydrophobicContact CB-CE1 3.61Å; A194-F223 HydrophobicContact CB-CZ 4.08Å; V217-F223 HydrophobicContact CB-CB 4.2Å; V217-F223 HydrophobicContact CB-CD2 4.17Å; V217-F223 HydrophobicContact CG1-CB 3.99Å; V217-F223 HydrophobicContact CG2-CD2 4.24Å; K219-F223 WeakPolarHBondContact O-CB 3.3Å; K219-F223 PolarHBondContact O-N 2.76Å; D220-F223 CarbonylContact O-C 3.52Å; D220-F223 WeakPolarHBondContact O-CA 3.27Å; D220-F223 WeakPolarHBondContact O-CB 3.47Å; D220-F223 PolarHBondContact O-N 3.19Å; D220-F223 VanDerWaalsContact O-N 3.08Å; F223-L226 PolarHBondContact O-N 2.94Å; F223-L227 HydrophobicContact CD1-CD1 3.98Å; F223-L227 HydrophobicContact CE1-CD1 3.42Å; F223-L227 VanDerWaalsContact CE1-CD1 3.42Å; F223-L227 HydrophobicContact CE1-CG 4.24Å; F223-L227 HydrophobicContact CZ-CD1 3.91Å; F223-L227 WeakPolarHBondContact O-CG 3.43Å; F223-L227 PolarHBondContact O-N 3.44Å; F223-L227 VanDerWaalsContact O-N 3.14Å; F223-L240 HydrophobicContact CD2-CB 4.24Å; F223-L240 HydrophobicContact CE2-CB 3.63Å; F223-T242 HydrophobicContact CB-CG2 3.84Å; F223-T242 HydrophobicContact CD1-CG2 3.7Å; F223-T242 HydrophobicContact CD2-CG2 3.66Å; F223-T242 HydrophobicContact CE1-CG2 4.1Å; F223-T242 HydrophobicContact CE2-CG2 4.06Å; F223-T242 HydrophobicContact CG-CG2 3.45Å; F223-T242 VanDerWaalsContact CG-CG2 3.45Å; F223-T242 HydrophobicContact CZ-CG2 4.28Å
224	Q	94.9	Very high	94.2	Very high	66 Å²	66	38.6 Å²	38.6	31%	0.308	20%	0.202	S	C	.	.	H	α-helix	trans	-60.7	-46.2	176.1	-61.3	-53.8	-39.4	0	0	111.4	L171 D220 T222 L226 L227 D228	L171-Q224 VanDerWaalsContact CD1-NE2 3.31Å; D220-Q224 WeakPolarHBondContact O-CG 3.27Å; D220-Q224 PolarHBondContact O-N 3.3Å; D220-Q224 PolarHBondContact OD1-NE2 3.17Å; T222-Q224 PolarHBondContact O-N 2.8Å; Q224-L226 VanDerWaalsContact C-N 3.28Å; Q224-L226 PolarHBondContact O-N 2.77Å; Q224-L227 WeakPolarHBondContact O-CB 3.46Å; Q224-L227 PolarHBondContact O-N 3.37Å; Q224-D228 PolarHBondContact O-N 3.03Å
225	R	93.3	Very high	93.8	Very high	105 Å²	105	38.8 Å²	38.8	40%	0.396	20%	0.203	S	C	.	.	H	α-helix	trans	-57.3	-40.2	177.2	-175.1	77.7	-178	101	13.1	112.1	A221 T222 L227 D228 D229 D373	A221-R225 WeakPolarHBondContact O-CB 3.48Å; A221-R225 PolarHBondContact O-N 2.93Å; T222-R225 PolarHBondContact O-N 3.44Å; R225-L227 VanDerWaalsContact C-N 3.33Å; R225-D228 PolarHBondContact O-N 3.28Å; R225-D229 IonicContact CZ-OD1 2.85Å; R225-D229 IonicContact CZ-OD2 2.82Å; R225-D229 IonicContact NH1-OD1 2.91Å; R225-D229 PolarHBondContact NH1-OD1 3.39Å; R225-D229 IonicContact NH1-OD2 3.12Å; R225-D229 IonicContact NH2-OD1 2.61Å; R225-D229 IonicContact NH2-OD2 3.54Å; R225-D229 WeakPolarHBondContact O-CB 3.36Å; R225-D229 PolarHBondContact O-N 2.98Å; R225-D229 VanDerWaalsContact O-N 3.09Å; R225-D373 IonicContact NH2-OD1 2.74Å; R225-D373 PolarHBondContact NH2-OD1 2.85Å
226	L	94.5	Very high	93.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-34.2	176.9	-65.9	178.4	0	0	0	112.3	V217 T222 F223 Q224 L231 L240 L269 L375 T376 L380	V217-L226 HydrophobicContact CG1-CD1 4.26Å; V217-L226 HydrophobicContact CG2-CD1 3.83Å; T222-L226 HydrophobicContact CG2-CD1 4.41Å; T222-L226 HydrophobicContact CG2-CG 4.44Å; T222-L226 VanDerWaalsContact O-CG 3.28Å; T222-L226 WeakPolarHBondContact O-CG 3.37Å; T222-L226 PolarHBondContact O-N 2.85Å; F223-L226 PolarHBondContact O-N 2.94Å; Q224-L226 VanDerWaalsContact C-N 3.28Å; Q224-L226 PolarHBondContact O-N 2.77Å; L226-L231 HydrophobicContact CB-CB 4.21Å; L226-L231 HydrophobicContact CB-CD2 4.08Å; L226-L231 HydrophobicContact CD1-CD2 4Å; L226-L231 HydrophobicContact CD2-CD2 4.04Å; L226-L231 HydrophobicContact CG-CD2 4.24Å; L226-L231 WeakPolarHBondContact O-CB 3.31Å; L226-L231 PolarHBondContact O-N 3.08Å; L226-L240 HydrophobicContact CB-CD1 4.37Å; L226-L269 HydrophobicContact CD1-CD2 4.05Å; L226-L375 HydrophobicContact CD2-CD2 3.74Å; L226-L375 HydrophobicContact CD2-CG 4.06Å; L226-T376 HydrophobicContact CD2-CG2 3.37Å; L226-L380 HydrophobicContact CD2-CD1 4Å
227	L	93.6	Very high	93.2	Very high	29 Å²	29	42.5 Å²	42.5	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-70.9	-44.2	174.3	-65.1	-179.7	0	0	0	111.7	A194 F223 Q224 R225 D229 D230 L240	A194-L227 HydrophobicContact CB-CD1 3.73Å; F223-L227 HydrophobicContact CD1-CD1 3.98Å; F223-L227 HydrophobicContact CE1-CD1 3.42Å; F223-L227 VanDerWaalsContact CE1-CD1 3.42Å; F223-L227 HydrophobicContact CE1-CG 4.24Å; F223-L227 HydrophobicContact CZ-CD1 3.91Å; F223-L227 WeakPolarHBondContact O-CG 3.43Å; F223-L227 PolarHBondContact O-N 3.44Å; F223-L227 VanDerWaalsContact O-N 3.14Å; Q224-L227 WeakPolarHBondContact O-CB 3.46Å; Q224-L227 PolarHBondContact O-N 3.37Å; R225-L227 VanDerWaalsContact C-N 3.33Å; L227-D229 PolarHBondContact O-N 3.47Å; L227-D230 PolarHBondContact O-N 3.39Å; L227-L240 HydrophobicContact CD2-CD1 4Å
228	D	92.3	Very high	93.1	Very high	119 Å²	119	42.5 Å²	42.5	64%	0.636	23%	0.229	S	C	*	.	H	α-helix	trans	-59.9	-30	176.2	-65.7	-24.6	0	0	0	112.2	Q224 R225 D230	Q224-D228 PolarHBondContact O-N 3.03Å; R225-D228 PolarHBondContact O-N 3.28Å; D228-D230 VanDerWaalsContact C-N 3.27Å; D228-D230 PolarHBondContact O-N 2.85Å
229	D	91.7	Very high	93.2	Very high	21 Å²	21	41.9 Å²	41.9	11%	0.112	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	8.4	176	-78.8	-2.2	0	0	0	113.7	R225 L227 L231 K234 T376	R225-D229 IonicContact CZ-OD1 2.85Å; R225-D229 IonicContact CZ-OD2 2.82Å; R225-D229 IonicContact NH1-OD1 2.91Å; R225-D229 PolarHBondContact NH1-OD1 3.39Å; R225-D229 IonicContact NH1-OD2 3.12Å; R225-D229 IonicContact NH2-OD1 2.61Å; R225-D229 IonicContact NH2-OD2 3.54Å; R225-D229 WeakPolarHBondContact O-CB 3.36Å; R225-D229 PolarHBondContact O-N 2.98Å; R225-D229 VanDerWaalsContact O-N 3.09Å; L227-D229 PolarHBondContact O-N 3.47Å; D229-L231 PolarHBondContact O-N 2.68Å; D229-K234 WeakPolarHBondContact O-CD 3.29Å; D229-K234 WeakPolarHBondContact O-CE 3.37Å; D229-K234 PolarHBondContact O-NZ 2.95Å; D229-T376 HydrophobicContact CB-CG2 3.73Å; D229-T376 WeakPolarHBondContact OD2-CG2 3.43Å; D229-T376 PolarHBondContact OD2-OG1 3.46Å
230	D	90.9	Very high	93.3	Very high	95 Å²	95	39.5 Å²	39.5	51%	0.508	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	34.2	-177.7	-68.5	-51.5	0	0	0	113.7	L227 D228 C232 T233 K234	L227-D230 PolarHBondContact O-N 3.39Å; D228-D230 VanDerWaalsContact C-N 3.27Å; D228-D230 PolarHBondContact O-N 2.85Å; D230-C232 VanDerWaalsContact C-N 3.27Å; D230-C232 PolarHBondContact O-N 3.02Å; D230-T233 WeakPolarHBondContact O-CB 3.43Å; D230-T233 PolarHBondContact O-N 2.91Å; D230-K234 WeakPolarHBondContact O-CG 3.19Å; D230-K234 PolarHBondContact O-N 2.85Å
231	L	91.4	Very high	93.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.1	-42.3	-175.2	-173.3	75.8	0	0	0	112	L226 D229 T233 K234 L235 L240 T376 L380	L226-L231 HydrophobicContact CB-CB 4.21Å; L226-L231 HydrophobicContact CB-CD2 4.08Å; L226-L231 HydrophobicContact CD1-CD2 4Å; L226-L231 HydrophobicContact CD2-CD2 4.04Å; L226-L231 HydrophobicContact CG-CD2 4.24Å; L226-L231 WeakPolarHBondContact O-CB 3.31Å; L226-L231 PolarHBondContact O-N 3.08Å; D229-L231 PolarHBondContact O-N 2.68Å; L231-T233 PolarHBondContact O-N 2.98Å; L231-K234 PolarHBondContact O-N 3.29Å; L231-K234 VanDerWaalsContact O-N 3.16Å; L231-L235 HydrophobicContact CD1-CD1 3.45Å; L231-L235 VanDerWaalsContact CD1-CD1 3.45Å; L231-L235 HydrophobicContact CD1-CG 3.87Å; L231-L235 HydrophobicContact CD2-CD1 4.21Å; L231-L235 HydrophobicContact CG-CD1 3.81Å; L231-L235 HydrophobicContact CG-CG 4.25Å; L231-L235 WeakPolarHBondContact O-CB 3.49Å; L231-L235 PolarHBondContact O-N 2.85Å; L231-L240 HydrophobicContact CD2-CD1 4.13Å; L231-L240 HydrophobicContact CD2-CD2 4.19Å; L231-T376 HydrophobicContact CD1-CG2 4.11Å; L231-L380 HydrophobicContact CD1-CD1 3.94Å; L231-L380 HydrophobicContact CD2-CD1 3.76Å
232	C	89.9	Confident	93.7	Very high	4 Å²	4	34 Å²	34	3%	0.027	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-29.5	179.8	-63.9	0	0	0	0	112.8	P190 D230 S236 L240	P190-C232 HydrophobicContact CB-CB 3.9Å; P190-C232 HydrophobicContact CG-CB 3.47Å; P190-C232 VanDerWaalsContact CG-CB 3.47Å; D230-C232 VanDerWaalsContact C-N 3.27Å; D230-C232 PolarHBondContact O-N 3.02Å; C232-S236 VanDerWaalsContact O-CA 3.3Å; C232-S236 WeakPolarHBondContact O-CA 3.3Å; C232-S236 VanDerWaalsContact O-CB 3.25Å; C232-S236 WeakPolarHBondContact O-CB 3.46Å; C232-S236 PolarHBondContact O-N 3.03Å; C232-L240 WeakPolarHBondContact SG-CD1 3.29Å; C232-L240 VanDerWaalsContact SG-CG 3.56Å
233	T	89.7	Confident	93.7	Very high	88 Å²	88	33.8 Å²	33.8	54%	0.54	18%	0.175	S	C	.	.	H	α-helix	trans	-79.9	-43.5	175.3	-54.4	0	0	0	0	110.4	D230 L231 L235 S236	D230-T233 WeakPolarHBondContact O-CB 3.43Å; D230-T233 PolarHBondContact O-N 2.91Å; L231-T233 PolarHBondContact O-N 2.98Å; T233-L235 PolarHBondContact O-N 2.94Å; T233-S236 WeakPolarHBondContact O-CB 3.31Å; T233-S236 PolarHBondContact O-N 3.2Å
234	K	90.1	Very high	93.7	Very high	96 Å²	96	37.2 Å²	37.2	42%	0.417	19%	0.191	S	C	.	.	H	α-helix	trans	-65.8	-35.5	-180	-69.4	174.2	179.2	170.9	0	113.5	D229 D230 L231 N377	D229-K234 WeakPolarHBondContact O-CD 3.29Å; D229-K234 WeakPolarHBondContact O-CE 3.37Å; D229-K234 PolarHBondContact O-NZ 2.95Å; D230-K234 WeakPolarHBondContact O-CG 3.19Å; D230-K234 PolarHBondContact O-N 2.85Å; L231-K234 PolarHBondContact O-N 3.29Å; L231-K234 VanDerWaalsContact O-N 3.16Å; K234-N377 PolarHBondContact NZ-OD1 3.25Å
235	L	91.3	Very high	93.6	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	20.6	-179.4	-60.9	-176.8	0	0	0	112.7	L8 F213 L231 T233 L380 P381 L384	L8-L235 HydrophobicContact CD2-CD2 3.91Å; F213-L235 HydrophobicContact CZ-CB 4.36Å; L231-L235 HydrophobicContact CD1-CD1 3.45Å; L231-L235 VanDerWaalsContact CD1-CD1 3.45Å; L231-L235 HydrophobicContact CD1-CG 3.87Å; L231-L235 HydrophobicContact CD2-CD1 4.21Å; L231-L235 HydrophobicContact CG-CD1 3.81Å; L231-L235 HydrophobicContact CG-CG 4.25Å; L231-L235 WeakPolarHBondContact O-CB 3.49Å; L231-L235 PolarHBondContact O-N 2.85Å; T233-L235 PolarHBondContact O-N 2.94Å; L235-L380 HydrophobicContact CD1-CB 4.24Å; L235-P381 HydrophobicContact CD2-CB 4.36Å; L235-P381 HydrophobicContact CD2-CG 4.16Å; L235-L384 HydrophobicContact CD1-CD1 3.71Å; L235-L384 HydrophobicContact CD2-CD1 4.45Å
236	S	90.1	Very high	93.7	Very high	59 Å²	59	33.9 Å²	33.9	41%	0.413	19%	0.189	S	C	.	.			trans	-61.1	142.1	-177.5	-175	0	0	0	0	112.6	F9 C232 T233	F9-S236 WeakPolarHBondContact CE2-O 3.33Å; F9-S236 VanDerWaalsContact CZ-O 3.22Å; F9-S236 WeakPolarHBondContact CZ-O 3.32Å; C232-S236 VanDerWaalsContact O-CA 3.3Å; C232-S236 WeakPolarHBondContact O-CA 3.3Å; C232-S236 VanDerWaalsContact O-CB 3.25Å; C232-S236 WeakPolarHBondContact O-CB 3.46Å; C232-S236 PolarHBondContact O-N 3.03Å; T233-S236 WeakPolarHBondContact O-CB 3.31Å; T233-S236 PolarHBondContact O-N 3.2Å
237	P	93.9	Very high	93.7	Very high	21 Å²	21	34.4 Å²	34.4	14%	0.136	19%	0.193	C	C	.	.	S	Bend	cis	-93.3	128.9	-1.5	34.6	-31.5	0	0	0	112	D175 S210 A211 K212	D175-P237 HydrophobicContact CB-CB 4.01Å; D175-P237 VanDerWaalsContact OD2-CB 3.27Å; D175-P237 WeakPolarHBondContact OD2-CB 3.28Å; S210-P237 VanDerWaalsContact O-CG 3.27Å; S210-P237 WeakPolarHBondContact O-CG 3.36Å; A211-P237 WeakPolarHBondContact CA-O 3.36Å; K212-P237 HydrophobicContact CG-CG 3.99Å; K212-P237 PolarHBondContact N-O 3.17Å
238	C	95.9	Very high	93.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	163.2	177.8	69.9	0	0	0	0	112.2	G174 D175 F213	G174-C238 CarbonylContact C-O 3.51Å; G174-C238 VanDerWaalsContact CA-O 3.29Å; G174-C238 WeakPolarHBondContact CA-O 3.44Å; D175-C238 PolarHBondContact N-O 3.4Å; F213-C238 HydrophobicContact CD1-CB 4.13Å; F213-C238 HydrophobicContact CD2-CB 4.2Å; F213-C238 HydrophobicContact CE1-CB 3.59Å; F213-C238 HydrophobicContact CE2-CB 3.64Å; F213-C238 HydrophobicContact CG-CB 4.42Å; F213-C238 HydrophobicContact CZ-CB 3.32Å
239	I	97.6	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.7	172.3	-60.6	165.8	0	0	0	108.7	I172 D175 L176 A211 F213 I214 M215 I241 L262	I172-I239 HydrophobicContact CD1-CG2 3.81Å; I172-I239 HydrophobicContact CG1-CG2 3.82Å; D175-I239 WeakPolarHBondContact O-CD1 3.44Å; D175-I239 VanDerWaalsContact O-CG1 3.3Å; D175-I239 WeakPolarHBondContact O-CG1 3.33Å; L176-I239 HydrophobicContact CB-CD1 4.02Å; L176-I239 HydrophobicContact CB-CG1 4.17Å; L176-I239 HydrophobicContact CD1-CD1 4.43Å; L176-I239 HydrophobicContact CD2-CD1 4.5Å; A211-I239 HydrophobicContact CB-CD1 3.83Å; A211-I239 HydrophobicContact CB-CG1 3.72Å; F213-I239 PolarHBondContact O-N 3.2Å; F213-I239 VanDerWaalsContact O-N 3.15Å; I214-I239 CarbonylContact C-O 3.5Å; I214-I239 WeakPolarHBondContact CA-O 3.49Å; I214-I239 HydrophobicContact CG1-CB 4.23Å; I214-I239 HydrophobicContact CG1-CD1 4.34Å; I214-I239 HydrophobicContact CG2-CB 4.5Å; I214-I239 HydrophobicContact CG2-CG2 4.49Å; M215-I239 PolarHBondContact N-O 3.17Å; I239-I241 HydrophobicContact CG2-CD1 4.16Å; I239-I241 HydrophobicContact CG2-CG1 3.93Å; I239-L262 HydrophobicContact CD1-CD1 3.99Å
240	L	97.8	Very high	93.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.5	170.1	-57.6	-175.6	0	0	0	110	I172 S173 M215 F223 L226 L227 L231 C232	I172-L240 WeakPolarHBondContact CA-O 3.37Å; S173-L240 PolarHBondContact N-O 3.43Å; S173-L240 PolarHBondContact O-N 3.42Å; M215-L240 HydrophobicContact CB-CD2 3.7Å; M215-L240 HydrophobicContact CG-CD2 4.34Å; M215-L240 WeakPolarHBondContact O-CA 3.42Å; M215-L240 HydrophobicContact SD-CD2 4.22Å; F223-L240 HydrophobicContact CD2-CB 4.24Å; F223-L240 HydrophobicContact CE2-CB 3.63Å; L226-L240 HydrophobicContact CB-CD1 4.37Å; L227-L240 HydrophobicContact CD2-CD1 4Å; L231-L240 HydrophobicContact CD2-CD1 4.13Å; L231-L240 HydrophobicContact CD2-CD2 4.19Å; C232-L240 WeakPolarHBondContact SG-CD1 3.29Å; C232-L240 VanDerWaalsContact SG-CG 3.56Å
241	I	98.1	Very high	93.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.2	177.2	-60.6	-179.9	0	0	0	109.3	L171 I172 I197 I214 M215 I216 V217 I239 V255 L258	L171-I241 WeakPolarHBondContact O-CA 3.48Å; I172-I241 HydrophobicContact CB-CG1 4.3Å; I172-I241 HydrophobicContact CD1-CD1 3.69Å; I172-I241 HydrophobicContact CD1-CG1 3.72Å; I172-I241 HydrophobicContact CG1-CD1 4.33Å; I172-I241 HydrophobicContact CG1-CG1 3.79Å; I197-I241 HydrophobicContact CD1-CG2 3.89Å; I214-I241 HydrophobicContact CG2-CD1 3.79Å; I214-I241 HydrophobicContact CG2-CG1 4.18Å; M215-I241 PolarHBondContact O-N 2.73Å; I216-I241 CarbonylContact C-O 3.6Å; I216-I241 VanDerWaalsContact CA-O 3.3Å; I216-I241 WeakPolarHBondContact CA-O 3.35Å; V217-I241 PolarHBondContact N-O 2.96Å; I239-I241 HydrophobicContact CG2-CD1 4.16Å; I239-I241 HydrophobicContact CG2-CG1 3.93Å; I241-V255 HydrophobicContact CD1-CG2 3.94Å; I241-V255 HydrophobicContact CG2-CG2 4.07Å; I241-L258 HydrophobicContact CD1-CD1 3.56Å
242	T	98	Very high	94.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.5	169.1	-176.1	0	0	0	0	111.8	G170 L171 V217 E218 F223 K244	G170-T242 CarbonylContact C-O 3.31Å; G170-T242 WeakPolarHBondContact CA-O 3.42Å; L171-T242 HydrophobicContact CB-CG2 3.87Å; L171-T242 HydrophobicContact CG-CG2 4.4Å; L171-T242 PolarHBondContact N-O 2.77Å; L171-T242 PolarHBondContact O-N 2.86Å; V217-T242 WeakPolarHBondContact O-CA 3.41Å; V217-T242 WeakPolarHBondContact O-CB 3.44Å; V217-T242 PolarHBondContact O-OG1 3.26Å; E218-T242 PolarHBondContact O-OG1 2.92Å; F223-T242 HydrophobicContact CB-CG2 3.84Å; F223-T242 HydrophobicContact CD1-CG2 3.7Å; F223-T242 HydrophobicContact CD2-CG2 3.66Å; F223-T242 HydrophobicContact CE1-CG2 4.1Å; F223-T242 HydrophobicContact CE2-CG2 4.06Å; F223-T242 HydrophobicContact CG-CG2 3.45Å; F223-T242 VanDerWaalsContact CG-CG2 3.45Å; F223-T242 HydrophobicContact CZ-CG2 4.28Å; T242-K244 HydrophobicContact CG2-CG 4.32Å; T242-K244 PolarHBondContact OG1-N 2.76Å
243	G	96.6	Very high	94.4	Very high	1 Å²	1	26 Å²	26	1%	0.01	15%	0.148	C	C	.	.			trans	-93.7	2.8	168.9	0	0	0	0	0	113.4	K169	K169-G243 WeakPolarHBondContact CE-O 3.48Å; K169-G243 PolarHBondContact NZ-O 3.02Å
244	K	95.4	Very high	94.7	Very high	73 Å²	73	21.9 Å²	21.9	32%	0.317	12%	0.122	S	C	.	.	S	Bend	trans	52.5	63.6	-173.6	-49.4	-166.7	177	-154.9	0	111.9	K169 D220 T242	K169-K244 HydrophobicContact CD-CB 4.4Å; K169-K244 PolarHBondContact NZ-O 3.13Å; K169-K244 WeakPolarHBondContact O-CD 3.35Å; K169-K244 WeakPolarHBondContact O-CE 3.42Å; D220-K244 HydrophobicContact CB-CB 4.27Å; D220-K244 HydrophobicContact CB-CD 3.96Å; D220-K244 HydrophobicContact CB-CG 3.87Å; D220-K244 VanDerWaalsContact CG-CE 3.48Å; D220-K244 IonicContact OD1-NZ 2.66Å; D220-K244 VanDerWaalsContact OD2-CE 3.29Å; D220-K244 WeakPolarHBondContact OD2-CE 3.1Å; D220-K244 IonicContact OD2-NZ 3.68Å; D220-K244 PolarHBondContact OD2-NZ 3.11Å; T242-K244 HydrophobicContact CG2-CG 4.32Å; T242-K244 PolarHBondContact OG1-N 2.76Å
245	G	94.4	Very high	95.1	Very high	16 Å²	16	17.3 Å²	17.3	17%	0.165	10%	0.103	C	C	.	.	S	Bend	trans	88.7	-137.7	-172.7	0	0	0	0	0	111.9	E218	E218-G245 PolarHBondContact O-N 3.09Å
246	V	94.5	Very high	95.3	Very high	84 Å²	84	18.1 Å²	18.1	51%	0.509	11%	0.105	S	C	.	.	S	Bend	trans	-54.5	123	175.4	-179.7	0	0	0	0	109.6	K169 I279 I282	K169-V246 WeakPolarHBondContact CE-O 3.44Å; K169-V246 PolarHBondContact NZ-O 3.32Å; V246-I279 HydrophobicContact CG2-CD1 4.31Å; V246-I279 HydrophobicContact CG2-CG1 4.07Å; V246-I282 HydrophobicContact CG1-CD1 3.99Å
247	P	94.6	Very high	95.6	Very high	12 Å²	12	17.4 Å²	17.4	8%	0.078	10%	0.095	C	C	.	.	P	Polyproline II helix	trans	-75.1	139.5	-168.6	31.5	-38.3	0	0	0	111.8	R252 I282 Y283	P247-R252 HydrophobicContact CB-CG 3.97Å; P247-R252 HydrophobicContact CG-CG 3.98Å; P247-I282 HydrophobicContact CG-CB 4.42Å; P247-I282 HydrophobicContact CG-CG2 3.72Å; P247-Y283 HydrophobicContact CB-CD2 4.47Å; P247-Y283 HydrophobicContact CB-CE1 3.97Å; P247-Y283 HydrophobicContact CB-CE2 3.64Å; P247-Y283 WeakPolarHBondContact CB-OH 3.33Å; P247-Y283 HydrophobicContact CG-CD2 3.99Å; P247-Y283 HydrophobicContact CG-CE1 4.29Å; P247-Y283 HydrophobicContact CG-CE2 3.61Å
248	D	92	Very high	95.7	Very high	23 Å²	23	16.4 Å²	16.4	12%	0.123	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-75.6	172.5	170.1	68.9	78.4	0	0	0	111.7	K169 N250 S251 R252	K169-D248 HydrophobicContact CG-CB 4.32Å; K169-D248 WeakPolarHBondContact CG-OD2 3.3Å; K169-D248 PolarHBondContact N-OD2 3.01Å; D248-N250 VanDerWaalsContact C-N 3.35Å; D248-N250 PolarHBondContact O-N 3.27Å; D248-N250 WeakPolarHBondContact OD1-CA 3.49Å; D248-N250 WeakPolarHBondContact OD1-CB 3.4Å; D248-N250 PolarHBondContact OD1-N 3.18Å; D248-S251 PolarHBondContact O-N 3.34Å; D248-S251 PolarHBondContact OD1-N 3.12Å; D248-S251 PolarHBondContact OD2-OG 2.87Å; D248-R252 WeakPolarHBondContact O-CG 3.45Å; D248-R252 PolarHBondContact O-N 2.83Å
249	V	91	Very high	95.7	Very high	20 Å²	20	17.1 Å²	17.1	12%	0.121	9%	0.091	C	C	.	.	H	α-helix	trans	-59.9	-43.8	-177.7	-175.1	0	0	0	0	111.8	A166 R252 L253 M290 L297	A166-V249 HydrophobicContact CB-CB 3.94Å; A166-V249 HydrophobicContact CB-CG2 4.16Å; V249-R252 PolarHBondContact O-N 3.43Å; V249-L253 HydrophobicContact CG1-CD1 3.91Å; V249-L253 HydrophobicContact CG1-CG 4.28Å; V249-L253 WeakPolarHBondContact O-CB 3.46Å; V249-L253 WeakPolarHBondContact O-CG 3.41Å; V249-L253 PolarHBondContact O-N 3.39Å; V249-M290 HydrophobicContact CG2-CE 3.69Å; V249-L297 HydrophobicContact CG1-CD2 3.92Å
250	N	93.8	Very high	95.5	Very high	8 Å²	8	20.1 Å²	20.1	4%	0.043	11%	0.107	C	C	.	.	H	α-helix	trans	-72.5	-36.7	-175.1	-60.8	-26.8	0	0	0	110.9	A166 S168 I197 I201 D248 R252 L253 M254	A166-N250 PolarHBondContact O-ND2 3.24Å; S168-N250 PolarHBondContact N-ND2 2.78Å; I197-N250 HydrophobicContact CG2-CB 4.27Å; I201-N250 HydrophobicContact CG1-CB 4.21Å; D248-N250 VanDerWaalsContact C-N 3.35Å; D248-N250 PolarHBondContact O-N 3.27Å; D248-N250 WeakPolarHBondContact OD1-CA 3.49Å; D248-N250 WeakPolarHBondContact OD1-CB 3.4Å; D248-N250 PolarHBondContact OD1-N 3.18Å; N250-R252 VanDerWaalsContact C-N 3.32Å; N250-R252 PolarHBondContact O-N 3.18Å; N250-L253 PolarHBondContact O-N 2.76Å; N250-M254 WeakPolarHBondContact O-CB 3.44Å; N250-M254 PolarHBondContact O-N 3.23Å
251	S	96.4	Very high	95.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-45.5	171	-64.8	0	0	0	0	111.6	D248 M254 V255	D248-S251 PolarHBondContact O-N 3.34Å; D248-S251 PolarHBondContact OD1-N 3.12Å; D248-S251 PolarHBondContact OD2-OG 2.87Å; S251-M254 PolarHBondContact O-N 3.14Å; S251-V255 WeakPolarHBondContact O-CG2 3.05Å; S251-V255 PolarHBondContact O-N 2.92Å; S251-V255 VanDerWaalsContact O-N 3.15Å
252	R	95.9	Very high	95.2	Very high	3 Å²	3	24.5 Å²	24.5	1%	0.011	13%	0.133	C	C	.	.	H	α-helix	trans	-67.6	-44.4	177.5	-67.7	173.6	64.9	-170.9	-4.4	112.5	P247 D248 V249 N250 M254 V255 R256 Y283 G286 L297	P247-R252 HydrophobicContact CB-CG 3.97Å; P247-R252 HydrophobicContact CG-CG 3.98Å; D248-R252 WeakPolarHBondContact O-CG 3.45Å; D248-R252 PolarHBondContact O-N 2.83Å; V249-R252 PolarHBondContact O-N 3.43Å; N250-R252 VanDerWaalsContact C-N 3.32Å; N250-R252 PolarHBondContact O-N 3.18Å; R252-M254 VanDerWaalsContact C-N 3.29Å; R252-M254 PolarHBondContact O-N 2.91Å; R252-V255 PolarHBondContact O-N 2.98Å; R252-R256 WeakPolarHBondContact O-CB 3.22Å; R252-R256 PolarHBondContact O-N 3.38Å; R252-Y283 HydrophobicContact CG-CD1 4.17Å; R252-Y283 HydrophobicContact CG-CE1 4.07Å; R252-G286 VanDerWaalsContact NH2-CA 3.32Å; R252-L297 HydrophobicContact CB-CB 4.44Å; R252-L297 HydrophobicContact CB-CD2 4.16Å; R252-L297 PolarHBondContact NE-O 3.08Å; R252-L297 PolarHBondContact NH2-O 2.97Å
253	L	94.8	Very high	95	Very high	37 Å²	37	27 Å²	27	19%	0.194	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-40.7	175.3	-75	171.1	0	0	0	111.6	I201 V249 N250 R256 K257 S296 L297	I201-L253 HydrophobicContact CB-CB 3.96Å; I201-L253 HydrophobicContact CG1-CB 3.93Å; I201-L253 HydrophobicContact CG2-CB 3.88Å; V249-L253 HydrophobicContact CG1-CD1 3.91Å; V249-L253 HydrophobicContact CG1-CG 4.28Å; V249-L253 WeakPolarHBondContact O-CB 3.46Å; V249-L253 WeakPolarHBondContact O-CG 3.41Å; V249-L253 PolarHBondContact O-N 3.39Å; N250-L253 PolarHBondContact O-N 2.76Å; L253-R256 PolarHBondContact O-N 3.04Å; L253-K257 VanDerWaalsContact O-CB 3.28Å; L253-K257 WeakPolarHBondContact O-CB 3.37Å; L253-K257 PolarHBondContact O-N 3.18Å; L253-S296 WeakPolarHBondContact CD2-O 3.47Å; L253-L297 HydrophobicContact CD2-CD2 3.62Å; L253-L297 HydrophobicContact CG-CD2 3.59Å
254	M	97.3	Very high	95	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-48.1	179.7	-174.3	58	175.1	0	0	111.2	I172 L176 Y178 I197 I201 I204 N250 S251 R252 R256 K257 L258	I172-M254 HydrophobicContact CD1-CE 3.66Å; I172-M254 HydrophobicContact CD1-CG 4.33Å; L176-M254 HydrophobicContact CD2-CE 3.78Å; Y178-M254 HydrophobicContact CD1-CE 4.33Å; Y178-M254 HydrophobicContact CE1-CE 3.87Å; I197-M254 HydrophobicContact CD1-CB 4.49Å; I197-M254 HydrophobicContact CG2-CB 3.88Å; I197-M254 HydrophobicContact CG2-CG 4.23Å; I201-M254 HydrophobicContact CD1-CB 3.92Å; I201-M254 HydrophobicContact CD1-CG 4.42Å; I201-M254 HydrophobicContact CD1-SD 4.02Å; I204-M254 HydrophobicContact CD1-CE 4.41Å; I204-M254 HydrophobicContact CD1-SD 3.9Å; N250-M254 WeakPolarHBondContact O-CB 3.44Å; N250-M254 PolarHBondContact O-N 3.23Å; S251-M254 PolarHBondContact O-N 3.14Å; R252-M254 VanDerWaalsContact C-N 3.29Å; R252-M254 PolarHBondContact O-N 2.91Å; M254-R256 VanDerWaalsContact C-N 3.3Å; M254-R256 PolarHBondContact O-N 2.83Å; M254-K257 PolarHBondContact O-N 3.3Å; M254-L258 HydrophobicContact CE-CD1 4.04Å; M254-L258 HydrophobicContact CE-CD2 4.11Å; M254-L258 HydrophobicContact CE-CG 4.1Å; M254-L258 HydrophobicContact CG-CD1 4.28Å; M254-L258 WeakPolarHBondContact O-CB 3.41Å; M254-L258 WeakPolarHBondContact O-CG 3.32Å; M254-L258 PolarHBondContact O-N 2.8Å; M254-L258 HydrophobicContact SD-CG 4.36Å
255	V	97.6	Very high	95.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-44.3	175.6	174.9	0	0	0	0	110.6	I216 I241 S251 R252 L258 W259 I266 Y283 V299	I216-V255 HydrophobicContact CD1-CG1 3.97Å; I216-V255 HydrophobicContact CD1-CG2 4.29Å; I216-V255 HydrophobicContact CG1-CG2 4.33Å; I241-V255 HydrophobicContact CD1-CG2 3.94Å; I241-V255 HydrophobicContact CG2-CG2 4.07Å; S251-V255 WeakPolarHBondContact O-CG2 3.05Å; S251-V255 PolarHBondContact O-N 2.92Å; S251-V255 VanDerWaalsContact O-N 3.15Å; R252-V255 PolarHBondContact O-N 2.98Å; V255-L258 PolarHBondContact O-N 2.91Å; V255-W259 WeakPolarHBondContact O-CB 3.3Å; V255-W259 PolarHBondContact O-N 2.76Å; V255-I266 HydrophobicContact CG1-CD1 3.76Å; V255-I266 HydrophobicContact CG1-CG2 4.32Å; V255-Y283 HydrophobicContact CB-CD1 4.48Å; V255-Y283 HydrophobicContact CB-CE1 4.36Å; V255-Y283 HydrophobicContact CG1-CD1 4.46Å; V255-Y283 HydrophobicContact CG2-CD1 4.35Å; V255-Y283 HydrophobicContact CG2-CE1 3.82Å; V255-V299 HydrophobicContact CG1-CG2 4.01Å
256	R	95.8	Very high	95.2	Very high	22 Å²	22	22.8 Å²	22.8	8%	0.083	12%	0.121	C	C	.	.	H	α-helix	trans	-61.6	-48.8	176.7	177.9	54.6	-176.8	-106.8	-2.9	112.2	R252 L253 M254 L258 W259 D260 H295 S296 T298 V299	R252-R256 WeakPolarHBondContact O-CB 3.22Å; R252-R256 PolarHBondContact O-N 3.38Å; L253-R256 PolarHBondContact O-N 3.04Å; M254-R256 VanDerWaalsContact C-N 3.3Å; M254-R256 PolarHBondContact O-N 2.83Å; R256-L258 VanDerWaalsContact C-N 3.33Å; R256-L258 PolarHBondContact O-N 3.08Å; R256-W259 WeakPolarHBondContact O-CB 3.42Å; R256-W259 PolarHBondContact O-N 3.14Å; R256-W259 VanDerWaalsContact O-N 3.12Å; R256-D260 WeakPolarHBondContact CD-OD2 3.46Å; R256-D260 WeakPolarHBondContact CG-OD2 3.33Å; R256-D260 IonicContact CZ-OD1 3.52Å; R256-D260 IonicContact CZ-OD2 3.84Å; R256-D260 IonicContact NE-OD1 2.73Å; R256-D260 PolarHBondContact NE-OD1 2.98Å; R256-D260 IonicContact NE-OD2 2.8Å; R256-D260 PolarHBondContact NE-OD2 3Å; R256-D260 IonicContact NH2-OD1 3.45Å; R256-D260 PolarHBondContact NH2-OD1 3.16Å; R256-D260 IonicContact NH2-OD2 3.93Å; R256-D260 PolarHBondContact O-N 3.24Å; R256-H295 PolarHBondContact NH1-O 3.21Å; R256-H295 PolarHBondContact NH2-O 2.9Å; R256-S296 WeakPolarHBondContact CG-O 3.3Å; R256-T298 WeakPolarHBondContact CD-O 3.3Å; R256-T298 PolarHBondContact NH1-O 3.25Å; R256-V299 HydrophobicContact CB-CG2 4.06Å
257	K	95.8	Very high	95.4	Very high	44 Å²	44	18.8 Å²	18.8	19%	0.191	10%	0.097	C	C	.	.	H	α-helix	trans	-60.6	-41.7	179.8	-175.2	164.8	-173.5	142.7	0	112.4	I201 G202 I204 I207 L253 M254 T261	I201-K257 HydrophobicContact CG2-CB 4.08Å; I201-K257 HydrophobicContact CG2-CD 3.68Å; I201-K257 VanDerWaalsContact O-CD 3.3Å; I201-K257 WeakPolarHBondContact O-CD 3.17Å; I201-K257 WeakPolarHBondContact O-CE 3.3Å; I201-K257 PolarHBondContact O-NZ 3.46Å; G202-K257 PolarHBondContact O-NZ 3.26Å; G202-K257 VanDerWaalsContact O-NZ 3.17Å; I204-K257 HydrophobicContact CB-CD 4.28Å; I204-K257 VanDerWaalsContact O-CE 3.22Å; I204-K257 WeakPolarHBondContact O-CE 3.34Å; I204-K257 PolarHBondContact O-NZ 3.15Å; I207-K257 HydrophobicContact CD1-CD 4.37Å; I207-K257 HydrophobicContact CD1-CG 3.99Å; L253-K257 VanDerWaalsContact O-CB 3.28Å; L253-K257 WeakPolarHBondContact O-CB 3.37Å; L253-K257 PolarHBondContact O-N 3.18Å; M254-K257 PolarHBondContact O-N 3.3Å; K257-T261 WeakPolarHBondContact O-CB 3.49Å; K257-T261 PolarHBondContact O-N 2.76Å; K257-T261 VanDerWaalsContact O-N 3.1Å; K257-T261 PolarHBondContact O-OG1 2.91Å
258	L	97.3	Very high	95.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-39.3	175.3	-69.4	174.4	0	0	0	111.7	I172 L176 I207 I214 I241 M254 V255 R256 T261 L262	I172-L258 HydrophobicContact CD1-CD1 3.95Å; L176-L258 HydrophobicContact CD1-CD2 3.82Å; L176-L258 HydrophobicContact CD2-CD1 4.4Å; L176-L258 HydrophobicContact CD2-CD2 4.07Å; I207-L258 HydrophobicContact CD1-CD2 4.38Å; I207-L258 HydrophobicContact CG2-CD2 4.1Å; I214-L258 HydrophobicContact CD1-CB 3.6Å; I214-L258 HydrophobicContact CD1-CD1 4.06Å; I214-L258 HydrophobicContact CD1-CG 4.49Å; I241-L258 HydrophobicContact CD1-CD1 3.56Å; M254-L258 HydrophobicContact CE-CD1 4.04Å; M254-L258 HydrophobicContact CE-CD2 4.11Å; M254-L258 HydrophobicContact CE-CG 4.1Å; M254-L258 HydrophobicContact CG-CD1 4.28Å; M254-L258 WeakPolarHBondContact O-CB 3.41Å; M254-L258 WeakPolarHBondContact O-CG 3.32Å; M254-L258 PolarHBondContact O-N 2.8Å; M254-L258 HydrophobicContact SD-CG 4.36Å; V255-L258 PolarHBondContact O-N 2.91Å; R256-L258 VanDerWaalsContact C-N 3.33Å; R256-L258 PolarHBondContact O-N 3.08Å; L258-T261 PolarHBondContact O-N 2.93Å; L258-L262 HydrophobicContact CB-CD1 4.48Å; L258-L262 HydrophobicContact CD2-CD1 4.18Å; L258-L262 VanDerWaalsContact O-CB 3.26Å; L258-L262 WeakPolarHBondContact O-CB 3.25Å; L258-L262 WeakPolarHBondContact O-CG 3.4Å; L258-L262 PolarHBondContact O-N 2.98Å
259	W	95.4	Very high	95.9	Very high	16 Å²	16	17.2 Å²	17.2	6%	0.061	9%	0.088	C	C	.	.	H	α-helix	trans	-62.2	-51.6	175.4	-178.1	65.3	0	0	0	112.1	V255 R256 T261 H263 I266 V299 S301	V255-W259 WeakPolarHBondContact O-CB 3.3Å; V255-W259 PolarHBondContact O-N 2.76Å; R256-W259 WeakPolarHBondContact O-CB 3.42Å; R256-W259 PolarHBondContact O-N 3.14Å; R256-W259 VanDerWaalsContact O-N 3.12Å; W259-T261 PolarHBondContact O-N 2.78Å; W259-H263 WeakPolarHBondContact O-CA 3.4Å; W259-H263 PolarHBondContact O-N 2.75Å; W259-I266 HydrophobicContact CB-CD1 3.82Å; W259-I266 HydrophobicContact CG-CD1 4.22Å; W259-V299 HydrophobicContact CB-CG1 4Å; W259-V299 HydrophobicContact CB-CG2 4.15Å; W259-V299 HydrophobicContact CD2-CG1 3.64Å; W259-V299 HydrophobicContact CE3-CG1 4.2Å; W259-V299 HydrophobicContact CG-CG1 3.51Å; W259-V299 HydrophobicContact CG-CG2 4.42Å; W259-S301 PolarHBondContact NE1-OG 3.39Å
260	D	92.6	Very high	96.3	Very high	62 Å²	62	16.3 Å²	16.3	33%	0.332	8%	0.082	S	C	.	.	H	α-helix	trans	-60.5	-25.9	178.6	-68.9	-30	0	0	0	112.3	R256 H263	R256-D260 WeakPolarHBondContact CD-OD2 3.46Å; R256-D260 WeakPolarHBondContact CG-OD2 3.33Å; R256-D260 IonicContact CZ-OD1 3.52Å; R256-D260 IonicContact CZ-OD2 3.84Å; R256-D260 IonicContact NE-OD1 2.73Å; R256-D260 PolarHBondContact NE-OD1 2.98Å; R256-D260 IonicContact NE-OD2 2.8Å; R256-D260 PolarHBondContact NE-OD2 3Å; R256-D260 IonicContact NH2-OD1 3.45Å; R256-D260 PolarHBondContact NH2-OD1 3.16Å; R256-D260 IonicContact NH2-OD2 3.93Å; R256-D260 PolarHBondContact O-N 3.24Å; D260-H263 PolarHBondContact O-CE1 3.15Å; D260-H263 PolarHBondContact O-NE2 3.18Å
261	T	94.6	Very high	96.4	Very high	69 Å²	69	15.9 Å²	15.9	42%	0.423	8%	0.08	S	C	.	.	H	α-helix	trans	-91.8	-48.7	-178.5	-53.1	0	0	0	0	112.1	I207 K257 L258 W259 H263	I207-T261 HydrophobicContact CB-CG2 4.12Å; I207-T261 HydrophobicContact CD1-CG2 4.34Å; I207-T261 HydrophobicContact CG2-CG2 4.2Å; K257-T261 WeakPolarHBondContact O-CB 3.49Å; K257-T261 PolarHBondContact O-N 2.76Å; K257-T261 VanDerWaalsContact O-N 3.1Å; K257-T261 PolarHBondContact O-OG1 2.91Å; L258-T261 PolarHBondContact O-N 2.93Å; W259-T261 PolarHBondContact O-N 2.78Å; T261-H263 PolarHBondContact O-ND1 3.44Å
262	L	95.2	Very high	96.5	Very high	23 Å²	23	16 Å²	16	12%	0.12	8%	0.081	C	C	.	.	H	α-helix	trans	-92.9	-25.1	-168.4	-58.1	179.1	0	0	0	112.8	R16 I207 I239 L258 I264	R16-L262 PolarHBondContact NH2-O 2.82Å; I207-L262 HydrophobicContact CG2-CD2 4.1Å; I239-L262 HydrophobicContact CD1-CD1 3.99Å; L258-L262 HydrophobicContact CB-CD1 4.48Å; L258-L262 HydrophobicContact CD2-CD1 4.18Å; L258-L262 VanDerWaalsContact O-CB 3.26Å; L258-L262 WeakPolarHBondContact O-CB 3.25Å; L258-L262 WeakPolarHBondContact O-CG 3.4Å; L258-L262 PolarHBondContact O-N 2.98Å; L262-I264 VanDerWaalsContact C-N 3.25Å; L262-I264 HydrophobicContact CB-CD1 4.01Å; L262-I264 HydrophobicContact CB-CG1 3.88Å; L262-I264 HydrophobicContact CB-CG2 4.27Å; L262-I264 HydrophobicContact CD1-CD1 3.81Å; L262-I264 HydrophobicContact CD1-CG1 4.47Å; L262-I264 PolarHBondContact O-N 2.93Å
263	H	94.1	Very high	96.6	Very high	54 Å²	54	16.7 Å²	16.7	25%	0.25	9%	0.085	C	C	.	.			trans	50.1	47	-176.1	-56.6	91.1	0	0	0	112.2	R16 L20 W259 D260 T261	R16-H263 WeakPolarHBondContact CG-O 3.33Å; R16-H263 PolarHBondContact NE-O 3.21Å; L20-H263 HydrophobicContact CD2-CB 3.6Å; W259-H263 WeakPolarHBondContact O-CA 3.4Å; W259-H263 PolarHBondContact O-N 2.75Å; D260-H263 PolarHBondContact O-CE1 3.15Å; D260-H263 PolarHBondContact O-NE2 3.18Å; T261-H263 PolarHBondContact O-ND1 3.44Å
264	I	95.8	Very high	96.7	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.076	C	C	.	.			trans	-110.7	153.1	178.6	58.6	-178.3	0	0	0	111.3	R16 A211 I214 L262	R16-I264 VanDerWaalsContact CZ-CG2 3.48Å; A211-I264 HydrophobicContact CB-CD1 3.93Å; I214-I264 HydrophobicContact CD1-CD1 4.19Å; I214-I264 HydrophobicContact CD1-CG1 4.18Å; I214-I264 HydrophobicContact CG1-CD1 3.74Å; I214-I264 HydrophobicContact CG1-CG1 4.04Å; L262-I264 VanDerWaalsContact C-N 3.25Å; L262-I264 HydrophobicContact CB-CD1 4.01Å; L262-I264 HydrophobicContact CB-CG1 3.88Å; L262-I264 HydrophobicContact CB-CG2 4.27Å; L262-I264 HydrophobicContact CD1-CD1 3.81Å; L262-I264 HydrophobicContact CD1-CG1 4.47Å; L262-I264 PolarHBondContact O-N 2.93Å
265	P	97.3	Very high	96.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.			trans	-52.3	142.6	174.4	-31	38.3	0	0	0	113.8	I12 L15 R16 L19 K212 F213 I214 F267 M303	I12-P265 HydrophobicContact CG2-CG 4.04Å; L15-P265 HydrophobicContact CB-CG 4.31Å; L15-P265 HydrophobicContact CD2-CB 3.66Å; L15-P265 HydrophobicContact CD2-CG 3.71Å; L15-P265 HydrophobicContact CG-CB 4.41Å; L15-P265 HydrophobicContact CG-CG 3.97Å; R16-P265 HydrophobicContact CB-CG 4.29Å; L19-P265 HydrophobicContact CD1-CB 4.45Å; L19-P265 HydrophobicContact CD1-CG 4.1Å; K212-P265 WeakPolarHBondContact O-CD 3.36Å; F213-P265 CarbonylContact C-O 3.54Å; F213-P265 VanDerWaalsContact CA-O 3.3Å; F213-P265 WeakPolarHBondContact CA-O 3.49Å; F213-P265 HydrophobicContact CB-CB 4.37Å; I214-P265 PolarHBondContact N-O 2.69Å; P265-F267 HydrophobicContact CB-CE2 3.9Å; P265-F267 HydrophobicContact CB-CZ 3.89Å; P265-M303 HydrophobicContact CB-CE 4.11Å
266	I	98.3	Very high	96.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.4	176.6	-52.3	-159	0	0	0	109.9	I214 I216 V255 W259 V299 V302 M303	I214-I266 HydrophobicContact CB-CD1 4.38Å; I214-I266 HydrophobicContact CB-CG1 4.16Å; I214-I266 HydrophobicContact CB-CG2 4.32Å; I214-I266 HydrophobicContact CD1-CD1 3.87Å; I214-I266 HydrophobicContact CD1-CG1 4.27Å; I214-I266 HydrophobicContact CG2-CG2 4.46Å; I214-I266 CarbonylContact O-C 3.58Å; I214-I266 WeakPolarHBondContact O-CA 3.17Å; I216-I266 HydrophobicContact CD1-CG2 3.66Å; I216-I266 HydrophobicContact CG1-CG2 3.93Å; V255-I266 HydrophobicContact CG1-CD1 3.76Å; V255-I266 HydrophobicContact CG1-CG2 4.32Å; W259-I266 HydrophobicContact CB-CD1 3.82Å; W259-I266 HydrophobicContact CG-CD1 4.22Å; I266-V299 HydrophobicContact CD1-CG1 4.02Å; I266-V302 HydrophobicContact CB-CG2 4.25Å; I266-V302 HydrophobicContact CG2-CG2 3.95Å; I266-V302 WeakPolarHBondContact O-CA 3.5Å; I266-M303 PolarHBondContact O-N 3.08Å
267	F	98.6	Very high	96.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.2	-175	-67.5	-58.1	0	0	0	110.7	I12 L15 F213 I214 M215 I216 P265 M303 L305 L384 W389	I12-F267 HydrophobicContact CD1-CE2 4.48Å; I12-F267 HydrophobicContact CG1-CE2 4.3Å; I12-F267 HydrophobicContact CG1-CZ 4.4Å; L15-F267 HydrophobicContact CD2-CE1 4.28Å; L15-F267 HydrophobicContact CD2-CZ 4.05Å; F213-F267 HydrophobicContact CB-CD2 3.88Å; F213-F267 HydrophobicContact CB-CE2 3.73Å; F213-F267 AromaticContact CD2-CD2 3.78Å; F213-F267 HydrophobicContact CD2-CD2 3.78Å; F213-F267 HydrophobicContact CD2-CE2 4.29Å; F213-F267 HydrophobicContact CG-CD2 4Å; F213-F267 HydrophobicContact CG-CE2 4.05Å; I214-F267 PolarHBondContact O-N 3.13Å; M215-F267 CarbonylContact C-O 3.49Å; M215-F267 VanDerWaalsContact CA-O 3.32Å; M215-F267 WeakPolarHBondContact CA-O 3.25Å; I216-F267 PolarHBondContact N-O 2.79Å; P265-F267 HydrophobicContact CB-CE2 3.9Å; P265-F267 HydrophobicContact CB-CZ 3.89Å; F267-M303 CarbonylContact C-O 3.58Å; F267-M303 WeakPolarHBondContact CA-O 3.33Å; F267-M303 HydrophobicContact CD1-CB 4.21Å; F267-M303 HydrophobicContact CD1-CE 3.79Å; F267-M303 HydrophobicContact CE1-CB 4.44Å; F267-M303 HydrophobicContact CE1-CE 3.36Å; F267-M303 HydrophobicContact CE1-SD 4.05Å; F267-M303 HydrophobicContact CZ-CE 4.01Å; F267-L305 HydrophobicContact CB-CB 3.97Å; F267-L305 HydrophobicContact CB-CD2 4.12Å; F267-L305 HydrophobicContact CD1-CB 4.45Å; F267-L305 HydrophobicContact CG-CB 4.49Å; F267-L384 HydrophobicContact CD2-CD2 3.93Å; F267-L384 HydrophobicContact CE2-CD2 3.88Å; F267-L384 HydrophobicContact CZ-CD2 4.46Å; F267-W389 HydrophobicContact CD1-CB 4.22Å; F267-W389 HydrophobicContact CD1-CD2 4.29Å; F267-W389 HydrophobicContact CD1-CE3 4.47Å; F267-W389 HydrophobicContact CD1-CG 4.17Å; F267-W389 HydrophobicContact CE1-CB 4.11Å; F267-W389 AromaticContact CE1-CD2 3.36Å; F267-W389 HydrophobicContact CE1-CD2 3.36Å; F267-W389 AromaticContact CE1-CE2 3.76Å; F267-W389 AromaticContact CE1-CE3 3.62Å; F267-W389 HydrophobicContact CE1-CE3 3.62Å; F267-W389 AromaticContact CE1-CG 3.57Å; F267-W389 HydrophobicContact CE1-CG 3.57Å; F267-W389 HydrophobicContact CE1-CZ2 4.33Å; F267-W389 HydrophobicContact CE1-CZ3 4.17Å; F267-W389 AromaticContact CZ-CD2 3.89Å; F267-W389 HydrophobicContact CZ-CD2 3.89Å; F267-W389 AromaticContact CZ-CE3 3.81Å; F267-W389 HydrophobicContact CZ-CE3 3.81Å; F267-W389 HydrophobicContact CZ-CH2 4.04Å; F267-W389 HydrophobicContact CZ-CZ2 4.15Å; F267-W389 AromaticContact CZ-CZ3 3.87Å; F267-W389 HydrophobicContact CZ-CZ3 3.87Å
268	A	98.6	Very high	96.8	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.008	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.1	172.5	0	0	0	0	0	110.4	V270 M280 V302 M303 L305 G306	A268-V270 HydrophobicContact CB-CG1 4.34Å; A268-M280 HydrophobicContact CB-CB 4.19Å; A268-M280 HydrophobicContact CB-CG 3.76Å; A268-M280 HydrophobicContact CB-SD 4.04Å; A268-V302 HydrophobicContact CB-CG1 4.01Å; A268-M303 PolarHBondContact N-O 3.27Å; A268-L305 WeakPolarHBondContact O-CB 3.4Å; A268-L305 PolarHBondContact O-N 3.19Å; A268-G306 PolarHBondContact O-N 2.91Å
269	L	98.5	Very high	96.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	100.1	171.2	-173	69.8	0	0	0	108.6	M215 I216 E218 L226 G306 L364 Y379 L380	M215-L269 HydrophobicContact CG-CB 4.15Å; M215-L269 HydrophobicContact SD-CB 4.14Å; M215-L269 HydrophobicContact SD-CD2 3.93Å; I216-L269 PolarHBondContact O-N 2.69Å; E218-L269 PolarHBondContact N-O 3.39Å; L226-L269 HydrophobicContact CD1-CD2 4.05Å; L269-G306 CarbonylContact C-O 3.4Å; L269-G306 WeakPolarHBondContact CA-O 3.37Å; L269-L364 HydrophobicContact CD1-CD1 4.43Å; L269-L364 HydrophobicContact CD1-CD2 3.7Å; L269-L364 HydrophobicContact CD2-CD1 4.38Å; L269-L364 HydrophobicContact CG-CD1 3.84Å; L269-L364 HydrophobicContact CG-CD2 4.01Å; L269-Y379 HydrophobicContact CD1-CE1 4.31Å; L269-L380 HydrophobicContact CD1-CD2 3.81Å; L269-L380 HydrophobicContact CD2-CD1 4.33Å; L269-L380 HydrophobicContact CD2-CD2 3.93Å; L269-L380 HydrophobicContact CG-CD2 4.49Å
270	V	98	Very high	96.9	Very high	1 Å²	1	18 Å²	18	1%	0.006	9%	0.092	C	C	.	.			trans	-125.1	166	-174.4	-59.4	0	0	0	0	110.3	E218 A268 M280 G306 L307	E218-V270 HydrophobicContact CB-CB 4.38Å; E218-V270 HydrophobicContact CB-CG1 4.17Å; E218-V270 WeakPolarHBondContact OE2-CB 3Å; A268-V270 HydrophobicContact CB-CG1 4.34Å; V270-M280 HydrophobicContact CG1-CB 4.43Å; V270-G306 PolarHBondContact N-O 3.45Å; V270-G306 CarbonylContact O-C 3.26Å; V270-G306 VanDerWaalsContact O-C 3.26Å; V270-L307 PolarHBondContact O-N 3.17Å
271	D	97.6	Very high	97	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.077	C	C	.	.			trans	-70.7	156.5	173.9	-70.3	-19.1	0	0	0	111.6	E218 K219 D273 L364	E218-D271 PolarHBondContact OE2-N 3.19Å; K219-D271 WeakPolarHBondContact CE-OD2 3.18Å; K219-D271 IonicContact NZ-OD2 2.81Å; K219-D271 PolarHBondContact NZ-OD2 3.49Å; D271-D273 PolarHBondContact O-N 3.23Å; D271-L364 WeakPolarHBondContact OD1-CB 3.24Å; D271-L364 WeakPolarHBondContact OD1-CD1 3.39Å; D271-L364 VanDerWaalsContact OD1-CG 3.25Å; D271-L364 WeakPolarHBondContact OD1-CG 3.39Å; D271-L364 PolarHBondContact OD1-N 3.14Å
272	A	97.5	Very high	97.1	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.008	6%	0.062	C	C	.	.	B	Isolated β-bridge	trans	-79.1	63	174.7	0	0	0	0	0	109.8	L307 L312 M355 K361 A362	A272-L307 HydrophobicContact CB-CB 4.07Å; A272-L307 HydrophobicContact CB-CD2 4.08Å; A272-L307 HydrophobicContact CB-CG 3.92Å; A272-L307 WeakPolarHBondContact CB-O 3.47Å; A272-L312 HydrophobicContact CB-CD1 4.34Å; A272-M355 VanDerWaalsContact C-CE 3.43Å; A272-M355 WeakPolarHBondContact O-CE 3.42Å; A272-K361 VanDerWaalsContact O-CA 3.25Å; A272-K361 WeakPolarHBondContact O-CA 2.99Å; A272-K361 WeakPolarHBondContact O-CB 3.48Å; A272-A362 HydrophobicContact CB-CB 4.35Å; A272-A362 PolarHBondContact N-O 2.91Å; A272-A362 PolarHBondContact O-N 3.27Å; A272-A362 VanDerWaalsContact O-N 3.15Å
273	D	97.9	Very high	97.2	Very high	19 Å²	19	11.9 Å²	11.9	10%	0.102	6%	0.057	C	C	.	.	S	Bend	trans	-144.1	167.9	179.9	81.6	27.2	0	0	0	112.6	D271 H275 G276 I277 K361	D271-D273 PolarHBondContact O-N 3.23Å; D273-H275 PolarHBondContact O-N 3.42Å; D273-H275 VanDerWaalsContact OD1-CA 3.32Å; D273-H275 WeakPolarHBondContact OD1-CA 3.17Å; D273-H275 WeakPolarHBondContact OD1-CB 3.29Å; D273-H275 PolarHBondContact OD1-N 2.74Å; D273-G276 PolarHBondContact O-N 3.46Å; D273-G276 PolarHBondContact OD1-N 3.02Å; D273-I277 WeakPolarHBondContact O-CD1 3.1Å; D273-I277 WeakPolarHBondContact O-CG1 3.46Å; D273-I277 PolarHBondContact O-N 2.97Å; D273-K361 HydrophobicContact CB-CB 3.82Å; D273-K361 HydrophobicContact CB-CD 3.87Å; D273-K361 HydrophobicContact CB-CG 4.39Å
274	P	97.9	Very high	97.2	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-65.3	-24.2	-177.9	-18.2	30.5	0	0	0	114.2	E278 D329 K332 L333 L336 M355	P274-E278 PolarHBondContact O-N 3.47Å; P274-D329 HydrophobicContact CG-CB 3.85Å; P274-K332 HydrophobicContact CB-CB 3.83Å; P274-K332 HydrophobicContact CB-CG 3.6Å; P274-L333 HydrophobicContact CB-CD2 3.95Å; P274-L333 HydrophobicContact CB-CG 4.05Å; P274-L333 HydrophobicContact CG-CD1 4.13Å; P274-L333 HydrophobicContact CG-CD2 3.82Å; P274-L333 HydrophobicContact CG-CG 3.68Å; P274-L336 HydrophobicContact CB-CD1 4.34Å; P274-L336 WeakPolarHBondContact O-CD1 3.19Å; P274-M355 HydrophobicContact CG-SD 4.36Å
275	H	97.3	Very high	97.2	Very high	98 Å²	98	10.3 Å²	10.3	45%	0.454	5%	0.049	S	C	.	.	H	α-helix	trans	-80	-41.5	-179.8	-72.9	-76.3	0	0	0	111.4	D273 I277 E278 I279	D273-H275 PolarHBondContact O-N 3.42Å; D273-H275 VanDerWaalsContact OD1-CA 3.32Å; D273-H275 WeakPolarHBondContact OD1-CA 3.17Å; D273-H275 WeakPolarHBondContact OD1-CB 3.29Å; D273-H275 PolarHBondContact OD1-N 2.74Å; H275-I277 VanDerWaalsContact C-N 3.31Å; H275-I277 PolarHBondContact O-N 3.16Å; H275-E278 PolarHBondContact O-N 3.1Å; H275-E278 VanDerWaalsContact O-N 3.12Å; H275-I279 WeakPolarHBondContact O-CG1 3.49Å; H275-I279 PolarHBondContact O-N 3.28Å
276	G	97.4	Very high	96.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-57	-44.4	171.8	0	0	0	0	0	111.6	E218 D273 E278 I279 M280	E218-G276 WeakPolarHBondContact OE2-CA 3.33Å; D273-G276 PolarHBondContact O-N 3.46Å; D273-G276 PolarHBondContact OD1-N 3.02Å; G276-E278 PolarHBondContact O-N 3.31Å; G276-I279 PolarHBondContact O-N 3.1Å; G276-M280 PolarHBondContact O-N 3.47Å
277	I	97.1	Very high	96.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.6	-44.5	173.9	-63.5	159.1	0	0	0	111.4	D273 H275 M280 C281 W304 L333 L336 I352 M355	D273-I277 WeakPolarHBondContact O-CD1 3.1Å; D273-I277 WeakPolarHBondContact O-CG1 3.46Å; D273-I277 PolarHBondContact O-N 2.97Å; H275-I277 VanDerWaalsContact C-N 3.31Å; H275-I277 PolarHBondContact O-N 3.16Å; I277-M280 PolarHBondContact O-N 3.39Å; I277-C281 PolarHBondContact O-N 2.78Å; I277-C281 PolarHBondContact O-SG 2.89Å; I277-W304 HydrophobicContact CD1-CH2 3.88Å; I277-W304 HydrophobicContact CG1-CH2 3.57Å; I277-W304 HydrophobicContact CG1-CZ2 3.93Å; I277-W304 HydrophobicContact CG1-CZ3 4.12Å; I277-L333 HydrophobicContact CD1-CD2 4.25Å; I277-L336 HydrophobicContact CB-CD1 4.15Å; I277-L336 HydrophobicContact CG2-CD1 3.93Å; I277-I352 HydrophobicContact CD1-CG1 3.91Å; I277-I352 HydrophobicContact CG2-CD1 4.26Å; I277-M355 HydrophobicContact CD1-CE 3.8Å
278	E	96.8	Very high	95.9	Very high	40 Å²	40	12.3 Å²	12.3	19%	0.187	6%	0.063	C	C	.	.	H	α-helix	trans	-65	-39.6	177.8	-176.1	171.1	-127.7	0	0	112.2	P274 H275 G276 M280 C281 I282 K332 L336	P274-E278 PolarHBondContact O-N 3.47Å; H275-E278 PolarHBondContact O-N 3.1Å; H275-E278 VanDerWaalsContact O-N 3.12Å; G276-E278 PolarHBondContact O-N 3.31Å; E278-M280 VanDerWaalsContact C-N 3.33Å; E278-M280 PolarHBondContact O-N 3.37Å; E278-C281 WeakPolarHBondContact O-CB 3.48Å; E278-C281 PolarHBondContact O-N 3.32Å; E278-C281 VanDerWaalsContact O-N 3.15Å; E278-I282 HydrophobicContact CG-CD1 4.22Å; E278-I282 WeakPolarHBondContact O-CG1 3.4Å; E278-I282 PolarHBondContact O-N 3.03Å; E278-K332 WeakPolarHBondContact OE1-CE 3.38Å; E278-K332 IonicContact OE1-NZ 3.52Å; E278-K332 PolarHBondContact OE1-NZ 3.14Å; E278-K332 WeakPolarHBondContact OE2-CE 3.39Å; E278-K332 IonicContact OE2-NZ 3.69Å; E278-K332 PolarHBondContact OE2-NZ 3.09Å; E278-L336 HydrophobicContact CB-CD2 4.36Å
279	I	97.1	Very high	94.9	Very high	7 Å²	7	14.5 Å²	14.5	4%	0.036	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-45.6	177.1	-73	168.8	0	0	0	110.6	E218 V246 H275 G276 C281 I282 Y283	E218-I279 HydrophobicContact CG-CD1 3.5Å; E218-I279 HydrophobicContact CG-CG2 4.29Å; E218-I279 WeakPolarHBondContact OE1-CD1 3.46Å; V246-I279 HydrophobicContact CG2-CD1 4.31Å; V246-I279 HydrophobicContact CG2-CG1 4.07Å; H275-I279 WeakPolarHBondContact O-CG1 3.49Å; H275-I279 PolarHBondContact O-N 3.28Å; G276-I279 PolarHBondContact O-N 3.1Å; I279-C281 PolarHBondContact O-N 3.48Å; I279-I282 WeakPolarHBondContact O-CB 3.09Å; I279-I282 PolarHBondContact O-N 3.46Å; I279-Y283 HydrophobicContact CG2-CD2 4.36Å; I279-Y283 HydrophobicContact CG2-CE2 4.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.21Å; I279-Y283 PolarHBondContact O-N 3.15Å
280	M	96.5	Very high	94.1	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-44	173.7	178.8	-177.7	58.1	0	0	111.8	A268 V270 G276 I277 E278 I282 Y283 K284 V302 W304 W348	A268-M280 HydrophobicContact CB-CB 4.19Å; A268-M280 HydrophobicContact CB-CG 3.76Å; A268-M280 HydrophobicContact CB-SD 4.04Å; V270-M280 HydrophobicContact CG1-CB 4.43Å; G276-M280 PolarHBondContact O-N 3.47Å; I277-M280 PolarHBondContact O-N 3.39Å; E278-M280 VanDerWaalsContact C-N 3.33Å; E278-M280 PolarHBondContact O-N 3.37Å; M280-I282 PolarHBondContact O-N 3.41Å; M280-Y283 PolarHBondContact O-N 2.96Å; M280-Y283 VanDerWaalsContact O-N 3.16Å; M280-K284 PolarHBondContact O-N 3.49Å; M280-V302 HydrophobicContact CG-CG1 4.04Å; M280-W304 HydrophobicContact CE-CB 3.91Å; M280-W304 HydrophobicContact CE-CD2 3.75Å; M280-W304 HydrophobicContact CE-CE3 3.79Å; M280-W304 HydrophobicContact CE-CG 3.82Å; M280-W304 HydrophobicContact SD-CB 3.37Å; M280-W304 WeakPolarHBondContact SD-CB 3.24Å; M280-W304 HydrophobicContact SD-CD2 4.21Å; M280-W304 HydrophobicContact SD-CG 3.61Å; M280-W348 HydrophobicContact CE-CD2 3.87Å; M280-W348 HydrophobicContact CE-CE3 3.59Å; M280-W348 HydrophobicContact CE-CH2 3.28Å; M280-W348 HydrophobicContact CE-CZ2 3.57Å; M280-W348 HydrophobicContact CE-CZ3 3.3Å; M280-W348 HydrophobicContact CG-CH2 3.76Å; M280-W348 HydrophobicContact CG-CZ2 4.34Å; M280-W348 HydrophobicContact CG-CZ3 4.4Å; M280-W348 HydrophobicContact SD-CH2 3.48Å; M280-W348 WeakPolarHBondContact SD-CH2 3.39Å; M280-W348 HydrophobicContact SD-CZ2 3.54Å; M280-W348 VanDerWaalsContact SD-CZ2 3.54Å; M280-W348 HydrophobicContact SD-CZ3 4.16Å
281	C	95.7	Very high	93.3	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-59.1	-35.3	175.7	-67.8	0	0	0	0	112.1	I277 E278 I279 K284 Y285 G286 Y341	I277-C281 PolarHBondContact O-N 2.78Å; I277-C281 PolarHBondContact O-SG 2.89Å; E278-C281 WeakPolarHBondContact O-CB 3.48Å; E278-C281 PolarHBondContact O-N 3.32Å; E278-C281 VanDerWaalsContact O-N 3.15Å; I279-C281 PolarHBondContact O-N 3.48Å; C281-K284 PolarHBondContact O-N 2.76Å; C281-Y285 HydrophobicContact CB-CD2 4.33Å; C281-Y285 WeakPolarHBondContact O-CA 3.49Å; C281-Y285 WeakPolarHBondContact O-CB 3.46Å; C281-Y285 PolarHBondContact O-N 2.78Å; C281-G286 PolarHBondContact O-N 2.88Å; C281-Y341 HydrophobicContact CB-CE2 4.2Å
282	I	96.1	Very high	92.5	Very high	20 Å²	20	18.6 Å²	18.6	10%	0.103	10%	0.097	C	C	.	.	H	α-helix	trans	-66.4	-39.2	177.6	-69.3	165.8	0	0	0	111.4	V246 P247 E278 I279 M280 G286	V246-I282 HydrophobicContact CG1-CD1 3.99Å; P247-I282 HydrophobicContact CG-CB 4.42Å; P247-I282 HydrophobicContact CG-CG2 3.72Å; E278-I282 HydrophobicContact CG-CD1 4.22Å; E278-I282 WeakPolarHBondContact O-CG1 3.4Å; E278-I282 PolarHBondContact O-N 3.03Å; I279-I282 WeakPolarHBondContact O-CB 3.09Å; I279-I282 PolarHBondContact O-N 3.46Å; M280-I282 PolarHBondContact O-N 3.41Å; I282-G286 WeakPolarHBondContact O-CA 3.46Å; I282-G286 PolarHBondContact O-N 3.24Å; I282-G286 VanDerWaalsContact O-N 3.08Å
283	Y	96.9	Very high	91.7	Very high	4 Å²	4	19.5 Å²	19.5	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-43	173.6	-81.2	-74.2	0	0	0	112.1	I216 P247 R252 V255 I279 M280 T298 V299	I216-Y283 HydrophobicContact CD1-CD1 3.83Å; I216-Y283 HydrophobicContact CD1-CD2 4.12Å; I216-Y283 HydrophobicContact CD1-CE1 4.11Å; I216-Y283 HydrophobicContact CD1-CE2 4.37Å; I216-Y283 HydrophobicContact CD1-CG 3.82Å; I216-Y283 HydrophobicContact CG2-CD2 3.97Å; I216-Y283 HydrophobicContact CG2-CE1 4.45Å; I216-Y283 HydrophobicContact CG2-CE2 3.41Å; I216-Y283 VanDerWaalsContact CG2-CE2 3.41Å; P247-Y283 HydrophobicContact CB-CD2 4.47Å; P247-Y283 HydrophobicContact CB-CE1 3.97Å; P247-Y283 HydrophobicContact CB-CE2 3.64Å; P247-Y283 WeakPolarHBondContact CB-OH 3.33Å; P247-Y283 HydrophobicContact CG-CD2 3.99Å; P247-Y283 HydrophobicContact CG-CE1 4.29Å; P247-Y283 HydrophobicContact CG-CE2 3.61Å; R252-Y283 HydrophobicContact CG-CD1 4.17Å; R252-Y283 HydrophobicContact CG-CE1 4.07Å; V255-Y283 HydrophobicContact CB-CD1 4.48Å; V255-Y283 HydrophobicContact CB-CE1 4.36Å; V255-Y283 HydrophobicContact CG1-CD1 4.46Å; V255-Y283 HydrophobicContact CG2-CD1 4.35Å; V255-Y283 HydrophobicContact CG2-CE1 3.82Å; I279-Y283 HydrophobicContact CG2-CD2 4.36Å; I279-Y283 HydrophobicContact CG2-CE2 4.26Å; I279-Y283 WeakPolarHBondContact O-CD2 3.21Å; I279-Y283 PolarHBondContact O-N 3.15Å; M280-Y283 PolarHBondContact O-N 2.96Å; M280-Y283 VanDerWaalsContact O-N 3.16Å; Y283-T298 CarbonylContact O-C 3.58Å; Y283-T298 WeakPolarHBondContact O-CA 3.5Å; Y283-V299 PolarHBondContact O-N 3.32Å
284	K	95.4	Very high	90.9	Very high	17 Å²	17	18.6 Å²	18.6	7%	0.074	10%	0.096	C	C	.	.	H	α-helix	trans	-78.1	-46.2	-174.8	-168.2	171.2	-178.9	145.3	0	114	M280 C281 T298 V299 P300 V302 W348	M280-K284 PolarHBondContact O-N 3.49Å; C281-K284 PolarHBondContact O-N 2.76Å; K284-T298 WeakPolarHBondContact O-CB 3.45Å; K284-V299 WeakPolarHBondContact CA-O 3.41Å; K284-P300 WeakPolarHBondContact CE-O 3.36Å; K284-V302 HydrophobicContact CB-CB 4.06Å; K284-V302 HydrophobicContact CB-CG1 4.49Å; K284-V302 HydrophobicContact CD-CB 4.48Å; K284-V302 WeakPolarHBondContact CD-O 3.5Å; K284-V302 WeakPolarHBondContact CE-O 3.32Å; K284-V302 HydrophobicContact CG-CB 4.27Å; K284-V302 PolarHBondContact NZ-O 3.25Å; K284-W348 HydrophobicContact CD-CH2 3.5Å; K284-W348 HydrophobicContact CD-CZ2 3.93Å; K284-W348 HydrophobicContact CD-CZ3 4.37Å
285	Y	94	Very high	90.2	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-119.3	-10.4	-169.4	-53.4	-57.4	0	0	0	113.6	F77 L83 C281 T298 Y341 Q345 W348	F77-Y285 AromaticContact CE2-CD1 3.62Å; F77-Y285 HydrophobicContact CE2-CD1 3.62Å; F77-Y285 AromaticContact CE2-CE1 3.91Å; F77-Y285 HydrophobicContact CE2-CE1 3.91Å; F77-Y285 HydrophobicContact CE2-CG 4.39Å; F77-Y285 HydrophobicContact CZ-CD1 4.2Å; F77-Y285 HydrophobicContact CZ-CE1 4.01Å; L83-Y285 WeakPolarHBondContact CB-O 3.39Å; L83-Y285 WeakPolarHBondContact CG-O 3.33Å; L83-Y285 PolarHBondContact N-O 2.9Å; C281-Y285 HydrophobicContact CB-CD2 4.33Å; C281-Y285 WeakPolarHBondContact O-CA 3.49Å; C281-Y285 WeakPolarHBondContact O-CB 3.46Å; C281-Y285 PolarHBondContact O-N 2.78Å; Y285-T298 VanDerWaalsContact C-CG2 3.44Å; Y285-Y341 HydrophobicContact CD1-CG 4.37Å; Y285-Y341 AromaticContact CD2-CD1 3.95Å; Y285-Y341 HydrophobicContact CD2-CD1 3.95Å; Y285-Y341 AromaticContact CD2-CD2 3.33Å; Y285-Y341 HydrophobicContact CD2-CD2 3.33Å; Y285-Y341 HydrophobicContact CD2-CE1 4.2Å; Y285-Y341 AromaticContact CD2-CE2 3.63Å; Y285-Y341 HydrophobicContact CD2-CE2 3.63Å; Y285-Y341 AromaticContact CD2-CG 3.51Å; Y285-Y341 HydrophobicContact CD2-CG 3.51Å; Y285-Y341 AromaticContact CE2-CD2 3.36Å; Y285-Y341 HydrophobicContact CE2-CD2 3.36Å; Y285-Y341 AromaticContact CE2-CE2 3.95Å; Y285-Y341 HydrophobicContact CE2-CE2 3.95Å; Y285-Y341 AromaticContact CE2-CG 3.77Å; Y285-Y341 HydrophobicContact CE2-CG 3.77Å; Y285-Y341 AromaticContact CG-CD1 3.98Å; Y285-Y341 HydrophobicContact CG-CD1 3.98Å; Y285-Y341 HydrophobicContact CG-CD2 4.14Å; Y285-Y341 HydrophobicContact CG-CE1 4.41Å; Y285-Y341 AromaticContact CG-CG 3.83Å; Y285-Y341 HydrophobicContact CG-CG 3.83Å; Y285-Q345 VanDerWaalsContact OH-CD 3.24Å; Y285-Q345 WeakPolarHBondContact OH-CG 3.3Å; Y285-Q345 PolarHBondContact OH-NE2 2.71Å; Y285-W348 HydrophobicContact CE2-CH2 4.28Å; Y285-W348 AromaticContact CE2-CZ3 3.86Å; Y285-W348 HydrophobicContact CE2-CZ3 3.86Å
286	G	92.4	Very high	89.6	Confident	3 Å²	3	20.5 Å²	20.5	3%	0.031	11%	0.11	C	C	.	.			trans	83.9	-170.3	-179.9	0	0	0	0	0	113.7	R252 C281 I282	R252-G286 VanDerWaalsContact NH2-CA 3.32Å; C281-G286 PolarHBondContact O-N 2.88Å; I282-G286 WeakPolarHBondContact O-CA 3.46Å; I282-G286 PolarHBondContact O-N 3.24Å; I282-G286 VanDerWaalsContact O-N 3.08Å
287	S	89.6	Confident	89.3	Confident	20 Å²	20	20.6 Å²	20.6	14%	0.14	11%	0.111	C	C	.	.			trans	-121.7	146.5	-178.8	65.9	0	0	0	0	110.2	S289 M290 S291	S287-S289 PolarHBondContact O-N 3.49Å; S287-S289 PolarHBondContact OG-OG 3.16Å; S287-S289 VanDerWaalsContact OG-OG 3.14Å; S287-M290 CarbonylContact O-C 3.52Å; S287-M290 PolarHBondContact O-N 2.83Å; S287-M290 WeakPolarHBondContact OG-CB 3.5Å; S287-S291 PolarHBondContact O-N 2.76Å
288	V	85.1	Confident	89.1	Confident	20 Å²	20	20.6 Å²	20.6	12%	0.121	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-50.1	-47.3	176.2	170.8	0	0	0	0	111.3	R69 W72 I75 L83 M290 S291	R69-V288 CarbonylContact O-C 3.55Å; R69-V288 WeakPolarHBondContact O-CG1 3.31Å; W72-V288 HydrophobicContact CD2-CG2 3.84Å; W72-V288 HydrophobicContact CE3-CG2 4.25Å; W72-V288 HydrophobicContact CG-CG2 4.41Å; W72-V288 HydrophobicContact CH2-CG2 3.67Å; W72-V288 HydrophobicContact CZ2-CG2 3.13Å; W72-V288 HydrophobicContact CZ3-CG2 4.21Å; I75-V288 HydrophobicContact CD1-CG1 4.21Å; I75-V288 HydrophobicContact CG1-CB 4.46Å; I75-V288 HydrophobicContact CG1-CG1 3.89Å; I75-V288 HydrophobicContact CG1-CG2 4.35Å; L83-V288 HydrophobicContact CD1-CG2 4.28Å; V288-M290 PolarHBondContact O-N 3.23Å; V288-M290 VanDerWaalsContact O-N 3.13Å; V288-S291 WeakPolarHBondContact O-CB 3.49Å; V288-S291 PolarHBondContact O-N 3.05Å; V288-S291 PolarHBondContact O-OG 3.46Å
289	S	78.8	Confident	89	Confident	47 Å²	47	18.8 Å²	18.8	33%	0.329	10%	0.102	S	C	.	.	G	3₁₀ helix	trans	-61	-22.4	-179.6	55.9	0	0	0	0	114.8	R69 S287	R69-S289 PolarHBondContact NH1-O 2.96Å; S287-S289 PolarHBondContact O-N 3.49Å; S287-S289 PolarHBondContact OG-OG 3.16Å; S287-S289 VanDerWaalsContact OG-OG 3.14Å
290	M	80.6	Confident	88.7	Confident	26 Å²	26	19.8 Å²	19.8	13%	0.128	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-126.1	22.7	-174.6	-59.6	161.5	66	0	0	111.6	V249 S287 V288 F292 E293 A294 L297	V249-M290 HydrophobicContact CG2-CE 3.69Å; S287-M290 CarbonylContact O-C 3.52Å; S287-M290 PolarHBondContact O-N 2.83Å; S287-M290 WeakPolarHBondContact OG-CB 3.5Å; V288-M290 PolarHBondContact O-N 3.23Å; V288-M290 VanDerWaalsContact O-N 3.13Å; M290-F292 PolarHBondContact O-N 2.95Å; M290-E293 PolarHBondContact O-N 3.01Å; M290-E293 VanDerWaalsContact O-N 3.09Å; M290-A294 PolarHBondContact O-N 2.89Å; M290-L297 HydrophobicContact CE-CD1 3.6Å
291	S	81.5	Confident	88.5	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.014	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-62.6	-25.5	-178.5	49.2	0	0	0	0	113.3	I75 L83 M85 S287 V288 E293 A294	I75-S291 WeakPolarHBondContact CD1-OG 3.35Å; L83-S291 WeakPolarHBondContact O-CA 3.48Å; L83-S291 WeakPolarHBondContact O-CB 3.44Å; M85-S291 VanDerWaalsContact CG-OG 3.26Å; M85-S291 WeakPolarHBondContact CG-OG 3.48Å; M85-S291 PolarHBondContact SD-OG 3.33Å; M85-S291 VanDerWaalsContact SD-OG 3.4Å; S287-S291 PolarHBondContact O-N 2.76Å; V288-S291 WeakPolarHBondContact O-CB 3.49Å; V288-S291 PolarHBondContact O-N 3.05Å; V288-S291 PolarHBondContact O-OG 3.46Å; S291-E293 VanDerWaalsContact C-N 3.29Å; S291-E293 PolarHBondContact O-N 3.31Å; S291-A294 WeakPolarHBondContact O-CB 3.36Å; S291-A294 PolarHBondContact O-N 2.74Å
292	F	80.2	Confident	88.5	Confident	59 Å²	59	20.2 Å²	20.2	26%	0.259	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-59.7	-38.3	171.9	176.2	-110.1	0	0	0	112.6	M85 K156 M290	M85-F292 HydrophobicContact CG-CB 4.48Å; K156-F292 HydrophobicContact CB-CE2 4.07Å; K156-F292 HydrophobicContact CB-CZ 4Å; K156-F292 HydrophobicContact CG-CE2 4.44Å; M290-F292 PolarHBondContact O-N 2.95Å
293	E	80.9	Confident	88.6	Confident	20 Å²	20	20.1 Å²	20.1	9%	0.093	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-101.9	16.2	-178.8	-68.6	176.2	-68.3	0	0	112.5	P158 R159 M290 S291 H295 S296 L297	P158-E293 WeakPolarHBondContact CA-OE2 3.49Å; R159-E293 IonicContact CZ-OE1 3.5Å; R159-E293 PolarHBondContact N-OE2 3.19Å; R159-E293 IonicContact NE-OE1 3.51Å; R159-E293 PolarHBondContact NE-OE1 3.26Å; R159-E293 IonicContact NE-OE2 2.89Å; R159-E293 IonicContact NH2-OE1 3.6Å; R159-E293 PolarHBondContact NH2-OE1 3.45Å; M290-E293 PolarHBondContact O-N 3.01Å; M290-E293 VanDerWaalsContact O-N 3.09Å; S291-E293 VanDerWaalsContact C-N 3.29Å; S291-E293 PolarHBondContact O-N 3.31Å; E293-H295 PolarHBondContact O-N 3.02Å; E293-S296 PolarHBondContact O-N 3.14Å; E293-S296 VanDerWaalsContact O-N 3.17Å; E293-S296 PolarHBondContact O-OG 3.46Å; E293-S296 VanDerWaalsContact O-OG 3.12Å; E293-L297 HydrophobicContact CB-CD1 3.72Å; E293-L297 HydrophobicContact CB-CG 4.32Å; E293-L297 VanDerWaalsContact O-CG 3.3Å; E293-L297 WeakPolarHBondContact O-CG 3.49Å; E293-L297 PolarHBondContact O-N 2.83Å
294	A	82.5	Confident	88.6	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-55.7	-40.7	-175.6	0	0	0	0	0	112.4	V81 L83 M290 S291 S296 L297 T298	V81-A294 HydrophobicContact CG1-CB 4.16Å; L83-A294 WeakPolarHBondContact O-CB 3.46Å; M290-A294 PolarHBondContact O-N 2.89Å; S291-A294 WeakPolarHBondContact O-CB 3.36Å; S291-A294 PolarHBondContact O-N 2.74Å; A294-S296 PolarHBondContact O-N 3.28Å; A294-L297 PolarHBondContact O-N 3.26Å; A294-T298 HydrophobicContact CB-CG2 4.1Å; A294-T298 WeakPolarHBondContact O-CG2 3.12Å; A294-T298 PolarHBondContact O-N 3.24Å; A294-T298 PolarHBondContact O-OG1 3.33Å
295	H	82.6	Confident	88.7	Confident	89 Å²	89	19.1 Å²	19.1	41%	0.412	11%	0.108	S	C	.	.	H	α-helix	trans	-51	-34	179.1	-64	89.9	0	0	0	114.9	V81 Q84 R256 E293	V81-H295 HydrophobicContact CG1-CB 4.31Å; V81-H295 VanDerWaalsContact CG1-CD2 3.43Å; V81-H295 WeakPolarHBondContact CG1-CD2 3.45Å; Q84-H295 PolarHBondContact NE2-CE1 3.48Å; Q84-H295 PolarHBondContact NE2-NE2 3.11Å; R256-H295 PolarHBondContact NH1-O 3.21Å; R256-H295 PolarHBondContact NH2-O 2.9Å; E293-H295 PolarHBondContact O-N 3.02Å
296	S	84.8	Confident	88.8	Confident	48 Å²	48	18.9 Å²	18.9	34%	0.336	11%	0.107	S	C	.	.	H	α-helix	trans	-98.2	-4.3	-179.7	57.3	0	0	0	0	113.3	L253 R256 E293 A294	L253-S296 WeakPolarHBondContact CD2-O 3.47Å; R256-S296 WeakPolarHBondContact CG-O 3.3Å; E293-S296 PolarHBondContact O-N 3.14Å; E293-S296 VanDerWaalsContact O-N 3.17Å; E293-S296 PolarHBondContact O-OG 3.46Å; E293-S296 VanDerWaalsContact O-OG 3.12Å; A294-S296 PolarHBondContact O-N 3.28Å
297	L	90.4	Very high	89	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-126.2	-1.7	-167.9	-61.9	177.3	0	0	0	114.7	V249 R252 L253 M290 E293 A294	V249-L297 HydrophobicContact CG1-CD2 3.92Å; R252-L297 HydrophobicContact CB-CB 4.44Å; R252-L297 HydrophobicContact CB-CD2 4.16Å; R252-L297 PolarHBondContact NE-O 3.08Å; R252-L297 PolarHBondContact NH2-O 2.97Å; L253-L297 HydrophobicContact CD2-CD2 3.62Å; L253-L297 HydrophobicContact CG-CD2 3.59Å; M290-L297 HydrophobicContact CE-CD1 3.6Å; E293-L297 HydrophobicContact CB-CD1 3.72Å; E293-L297 HydrophobicContact CB-CG 4.32Å; E293-L297 VanDerWaalsContact O-CG 3.3Å; E293-L297 WeakPolarHBondContact O-CG 3.49Å; E293-L297 PolarHBondContact O-N 2.83Å; A294-L297 PolarHBondContact O-N 3.26Å
298	T	93.4	Very high	89.4	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.			trans	-114.1	147.4	-179.1	58.5	0	0	0	0	111	V81 R256 Y283 K284 Y285 A294	V81-T298 VanDerWaalsContact O-CB 3.27Å; V81-T298 WeakPolarHBondContact O-CB 3.36Å; V81-T298 WeakPolarHBondContact O-CG2 3.31Å; V81-T298 PolarHBondContact O-OG1 3.06Å; R256-T298 WeakPolarHBondContact CD-O 3.3Å; R256-T298 PolarHBondContact NH1-O 3.25Å; Y283-T298 CarbonylContact O-C 3.58Å; Y283-T298 WeakPolarHBondContact O-CA 3.5Å; K284-T298 WeakPolarHBondContact O-CB 3.45Å; Y285-T298 VanDerWaalsContact C-CG2 3.44Å; A294-T298 HydrophobicContact CB-CG2 4.1Å; A294-T298 WeakPolarHBondContact O-CG2 3.12Å; A294-T298 PolarHBondContact O-N 3.24Å; A294-T298 PolarHBondContact O-OG1 3.33Å
299	V	94.4	Very high	90	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.012	10%	0.096	C	C	.	.			trans	-126.2	100.3	171.8	-179.9	0	0	0	0	109.4	V255 R256 W259 I266 Y283 K284 S301 V302	V255-V299 HydrophobicContact CG1-CG2 4.01Å; R256-V299 HydrophobicContact CB-CG2 4.06Å; W259-V299 HydrophobicContact CB-CG1 4Å; W259-V299 HydrophobicContact CB-CG2 4.15Å; W259-V299 HydrophobicContact CD2-CG1 3.64Å; W259-V299 HydrophobicContact CE3-CG1 4.2Å; W259-V299 HydrophobicContact CG-CG1 3.51Å; W259-V299 HydrophobicContact CG-CG2 4.42Å; I266-V299 HydrophobicContact CD1-CG1 4.02Å; Y283-V299 PolarHBondContact O-N 3.32Å; K284-V299 WeakPolarHBondContact CA-O 3.41Å; V299-S301 WeakPolarHBondContact CG1-OG 3.38Å; V299-S301 PolarHBondContact O-N 3.46Å; V299-S301 VanDerWaalsContact O-N 3.08Å; V299-V302 HydrophobicContact CB-CG2 3.92Å; V299-V302 HydrophobicContact CG1-CG2 4.12Å; V299-V302 VanDerWaalsContact O-CG2 3.3Å; V299-V302 WeakPolarHBondContact O-CG2 3.48Å; V299-V302 PolarHBondContact O-N 3.09Å
300	P	90.8	Very high	90.9	Very high	28 Å²	28	17 Å²	17	18%	0.182	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.4	-176.8	-22.9	31.2	0	0	0	114.3	A80 K284 V302	A80-P300 WeakPolarHBondContact O-CG 3.37Å; K284-P300 WeakPolarHBondContact CE-O 3.36Å; P300-V302 VanDerWaalsContact C-N 3.3Å; P300-V302 PolarHBondContact O-N 3.19Å
301	S	91.6	Very high	91.7	Very high	13 Å²	13	16 Å²	16	9%	0.091	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.8	-178.9	74.4	0	0	0	0	114.6	W259 V299 M303	W259-S301 PolarHBondContact NE1-OG 3.39Å; V299-S301 WeakPolarHBondContact CG1-OG 3.38Å; V299-S301 PolarHBondContact O-N 3.46Å; V299-S301 VanDerWaalsContact O-N 3.08Å; S301-M303 PolarHBondContact O-N 2.77Å
302	V	96.7	Very high	92.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	131	177.3	171	0	0	0	0	109.6	I216 I266 A268 M280 K284 V299 P300	I216-V302 HydrophobicContact CD1-CG2 4.35Å; I266-V302 HydrophobicContact CB-CG2 4.25Å; I266-V302 HydrophobicContact CG2-CG2 3.95Å; I266-V302 WeakPolarHBondContact O-CA 3.5Å; A268-V302 HydrophobicContact CB-CG1 4.01Å; M280-V302 HydrophobicContact CG-CG1 4.04Å; K284-V302 HydrophobicContact CB-CB 4.06Å; K284-V302 HydrophobicContact CB-CG1 4.49Å; K284-V302 HydrophobicContact CD-CB 4.48Å; K284-V302 WeakPolarHBondContact CD-O 3.5Å; K284-V302 WeakPolarHBondContact CE-O 3.32Å; K284-V302 HydrophobicContact CG-CB 4.27Å; K284-V302 PolarHBondContact NZ-O 3.25Å; V299-V302 HydrophobicContact CB-CG2 3.92Å; V299-V302 HydrophobicContact CG1-CG2 4.12Å; V299-V302 VanDerWaalsContact O-CG2 3.3Å; V299-V302 WeakPolarHBondContact O-CG2 3.48Å; V299-V302 PolarHBondContact O-N 3.09Å; P300-V302 VanDerWaalsContact C-N 3.3Å; P300-V302 PolarHBondContact O-N 3.19Å
303	M	97.3	Very high	93	Very high	18 Å²	18	21.1 Å²	21.1	9%	0.089	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.5	174.9	-61.9	155.5	-71.4	0	0	110.8	L15 P265 I266 F267 A268 S301 L305 W389 V390	L15-M303 HydrophobicContact CD1-SD 4.06Å; L15-M303 HydrophobicContact CD2-CE 3.28Å; L15-M303 HydrophobicContact CD2-SD 3.42Å; L15-M303 WeakPolarHBondContact CD2-SD 3.44Å; L15-M303 HydrophobicContact CG-CE 4.43Å; L15-M303 HydrophobicContact CG-SD 4.36Å; P265-M303 HydrophobicContact CB-CE 4.11Å; I266-M303 PolarHBondContact O-N 3.08Å; F267-M303 CarbonylContact C-O 3.58Å; F267-M303 WeakPolarHBondContact CA-O 3.33Å; F267-M303 HydrophobicContact CD1-CB 4.21Å; F267-M303 HydrophobicContact CD1-CE 3.79Å; F267-M303 HydrophobicContact CE1-CB 4.44Å; F267-M303 HydrophobicContact CE1-CE 3.36Å; F267-M303 HydrophobicContact CE1-SD 4.05Å; F267-M303 HydrophobicContact CZ-CE 4.01Å; A268-M303 PolarHBondContact N-O 3.27Å; S301-M303 PolarHBondContact O-N 2.77Å; M303-L305 PolarHBondContact O-N 2.91Å; M303-W389 HydrophobicContact CB-CB 4.36Å; M303-W389 HydrophobicContact CB-CG 4.41Å; M303-W389 HydrophobicContact SD-CG 4.29Å; M303-W389 PolarHBondContact SD-NE1 3.44Å; M303-V390 CarbonylContact C-O 3.58Å; M303-V390 WeakPolarHBondContact CA-O 3.41Å; M303-V390 WeakPolarHBondContact CB-O 3.27Å
304	W	98	Very high	93.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	106.2	176.8	-164.1	-3.3	0	0	0	109.7	I277 M280 G306 L308 P309 W348 E351 W389 V390	I277-W304 HydrophobicContact CD1-CH2 3.88Å; I277-W304 HydrophobicContact CG1-CH2 3.57Å; I277-W304 HydrophobicContact CG1-CZ2 3.93Å; I277-W304 HydrophobicContact CG1-CZ3 4.12Å; M280-W304 HydrophobicContact CE-CB 3.91Å; M280-W304 HydrophobicContact CE-CD2 3.75Å; M280-W304 HydrophobicContact CE-CE3 3.79Å; M280-W304 HydrophobicContact CE-CG 3.82Å; M280-W304 HydrophobicContact SD-CB 3.37Å; M280-W304 WeakPolarHBondContact SD-CB 3.24Å; M280-W304 HydrophobicContact SD-CD2 4.21Å; M280-W304 HydrophobicContact SD-CG 3.61Å; W304-G306 PolarHBondContact NE1-O 3.04Å; W304-L308 HydrophobicContact CB-CD2 4.22Å; W304-L308 HydrophobicContact CD2-CD2 3.44Å; W304-L308 VanDerWaalsContact CD2-CD2 3.44Å; W304-L308 HydrophobicContact CE3-CD2 3.98Å; W304-L308 HydrophobicContact CG-CD2 3.55Å; W304-L308 HydrophobicContact CZ2-CD2 4.19Å; W304-P309 HydrophobicContact CH2-CG 4.15Å; W304-W348 HydrophobicContact CB-CZ2 4.49Å; W304-W348 HydrophobicContact CE3-CG 4.44Å; W304-E351 HydrophobicContact CE3-CB 4.5Å; W304-E351 HydrophobicContact CH2-CB 4.06Å; W304-E351 HydrophobicContact CZ3-CB 3.66Å; W304-E351 HydrophobicContact CZ3-CG 4.23Å; W304-W389 CarbonylContact O-C 3.59Å; W304-W389 VanDerWaalsContact O-CA 3.24Å; W304-W389 WeakPolarHBondContact O-CA 3.49Å; W304-W389 WeakPolarHBondContact O-CB 3.25Å; W304-V390 HydrophobicContact CB-CG2 3.81Å; W304-V390 HydrophobicContact CE3-CG2 4.24Å; W304-V390 HydrophobicContact CG-CG2 4.46Å; W304-V390 PolarHBondContact N-O 3.38Å; W304-V390 PolarHBondContact O-N 3.43Å
305	L	98.2	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-44.3	176.1	-178.3	63.4	0	0	0	110.8	M215 F267 A268 M303 L380 K383 L384 W389	M215-L305 HydrophobicContact CE-CD2 3.52Å; M215-L305 HydrophobicContact CG-CD2 4.48Å; M215-L305 HydrophobicContact SD-CD2 4.09Å; F267-L305 HydrophobicContact CB-CB 3.97Å; F267-L305 HydrophobicContact CB-CD2 4.12Å; F267-L305 HydrophobicContact CD1-CB 4.45Å; F267-L305 HydrophobicContact CG-CB 4.49Å; A268-L305 WeakPolarHBondContact O-CB 3.4Å; A268-L305 PolarHBondContact O-N 3.19Å; M303-L305 PolarHBondContact O-N 2.91Å; L305-L380 HydrophobicContact CD2-CD2 3.87Å; L305-K383 HydrophobicContact CD1-CB 3.84Å; L305-K383 WeakPolarHBondContact O-CE 3.18Å; L305-K383 PolarHBondContact O-NZ 3.09Å; L305-L384 HydrophobicContact CD1-CD2 3.98Å; L305-L384 HydrophobicContact CD1-CG 4.47Å; L305-L384 HydrophobicContact CD2-CD2 4.2Å; L305-W389 HydrophobicContact CD1-CB 4.28Å; L305-W389 HydrophobicContact CD1-CE3 4.39Å
306	G	95.4	Very high	94.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.3	-179.5	-177.1	0	0	0	0	0	111	A268 L269 V270 W304 Y379	A268-G306 PolarHBondContact O-N 2.91Å; L269-G306 CarbonylContact C-O 3.4Å; L269-G306 WeakPolarHBondContact CA-O 3.37Å; V270-G306 PolarHBondContact N-O 3.45Å; V270-G306 CarbonylContact O-C 3.26Å; V270-G306 VanDerWaalsContact O-C 3.26Å; W304-G306 PolarHBondContact NE1-O 3.04Å; G306-Y379 VanDerWaalsContact CA-OH 3.25Å; G306-Y379 WeakPolarHBondContact CA-OH 2.97Å
307	L	97.3	Very high	95.4	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.15	C	C	.	.			cis	-71.6	122.8	-11.3	-177.4	57.8	0	0	0	109.5	V270 A272 D311 L312 A362 L364 L367 Y379	V270-L307 PolarHBondContact O-N 3.17Å; A272-L307 HydrophobicContact CB-CB 4.07Å; A272-L307 HydrophobicContact CB-CD2 4.08Å; A272-L307 HydrophobicContact CB-CG 3.92Å; A272-L307 WeakPolarHBondContact CB-O 3.47Å; L307-D311 HydrophobicContact CD1-CB 3.82Å; L307-L312 HydrophobicContact CD1-CD2 4.27Å; L307-L312 HydrophobicContact CD2-CD2 3.61Å; L307-L312 HydrophobicContact CG-CD2 3.92Å; L307-A362 HydrophobicContact CD2-CB 4.07Å; L307-L364 HydrophobicContact CB-CD2 3.85Å; L307-L364 HydrophobicContact CB-CG 4.48Å; L307-L367 HydrophobicContact CD1-CD1 4.28Å; L307-L367 HydrophobicContact CD1-CD2 4.1Å; L307-L367 HydrophobicContact CD1-CG 4.46Å; L307-Y379 HydrophobicContact CD1-CE2 4.17Å
308	L	97.9	Very high	95.6	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	17%	0.165	C	C	.	.			trans	-80.6	142.5	178.2	-56.2	-178	0	0	0	109.9	W304 S310 D311 V390	W304-L308 HydrophobicContact CB-CD2 4.22Å; W304-L308 HydrophobicContact CD2-CD2 3.44Å; W304-L308 VanDerWaalsContact CD2-CD2 3.44Å; W304-L308 HydrophobicContact CE3-CD2 3.98Å; W304-L308 HydrophobicContact CG-CD2 3.55Å; W304-L308 HydrophobicContact CZ2-CD2 4.19Å; L308-S310 PolarHBondContact O-N 2.82Å; L308-D311 HydrophobicContact CB-CB 4.32Å; L308-D311 WeakPolarHBondContact CB-OD2 3.15Å; L308-D311 PolarHBondContact N-OD2 2.95Å; L308-D311 WeakPolarHBondContact O-CA 3.39Å; L308-D311 VanDerWaalsContact O-CB 3.27Å; L308-D311 WeakPolarHBondContact O-CB 3.48Å; L308-D311 PolarHBondContact O-N 3.44Å; L308-V390 HydrophobicContact CD1-CG2 4.48Å; L308-V390 HydrophobicContact CD2-CG2 4.01Å
309	P	97.4	Very high	95.6	Very high	6 Å²	6	43.3 Å²	43.3	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-48.5	-39.7	167.7	-31.7	38.1	0	0	0	113.4	W304 D311 L312 E351 L354 M355	W304-P309 HydrophobicContact CH2-CG 4.15Å; P309-D311 VanDerWaalsContact C-N 3.29Å; P309-D311 PolarHBondContact O-N 2.67Å; P309-L312 WeakPolarHBondContact O-CB 3.15Å; P309-L312 PolarHBondContact O-N 3.1Å; P309-E351 WeakPolarHBondContact CB-O 3.38Å; P309-E351 WeakPolarHBondContact CB-OE2 3.24Å; P309-E351 VanDerWaalsContact CD-OE2 3.22Å; P309-E351 WeakPolarHBondContact CD-OE2 3.5Å; P309-E351 HydrophobicContact CG-CB 4.18Å; P309-E351 WeakPolarHBondContact CG-O 3.43Å; P309-L354 HydrophobicContact CB-CB 4.42Å; P309-L354 HydrophobicContact CB-CD2 4.25Å; P309-L354 HydrophobicContact CB-CG 4.42Å; P309-M355 HydrophobicContact CB-CB 4.14Å; P309-M355 HydrophobicContact CG-CB 3.99Å; P309-M355 HydrophobicContact CG-CE 3.55Å
310	S	97.3	Very high	95.6	Very high	37 Å²	37	51 Å²	51	26%	0.259	24%	0.243	S	C	.	.	H	α-helix	trans	-67.1	-25.9	175.9	62.7	0	0	0	0	114	L308 L312 R314 E351 L354	L308-S310 PolarHBondContact O-N 2.82Å; S310-L312 VanDerWaalsContact C-N 3.3Å; S310-L312 PolarHBondContact O-N 3.02Å; S310-R314 WeakPolarHBondContact O-CB 3.17Å; S310-R314 PolarHBondContact O-N 3.31Å; S310-E351 VanDerWaalsContact CB-OE1 3.26Å; S310-E351 WeakPolarHBondContact CB-OE1 3.33Å; S310-E351 WeakPolarHBondContact CB-OE2 3.29Å; S310-E351 PolarHBondContact N-OE2 3.12Å; S310-E351 VanDerWaalsContact OG-CD 3.28Å; S310-E351 PolarHBondContact OG-OE1 3.15Å; S310-E351 PolarHBondContact OG-OE2 2.94Å; S310-L354 VanDerWaalsContact CA-CD2 3.43Å
311	D	97.3	Very high	95.8	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-67.9	-31.4	175.9	-70.5	-41.7	0	0	0	111.8	L307 L308 P309 Q313 R314 L315 Y379 K383	L307-D311 HydrophobicContact CD1-CB 3.82Å; L308-D311 HydrophobicContact CB-CB 4.32Å; L308-D311 WeakPolarHBondContact CB-OD2 3.15Å; L308-D311 PolarHBondContact N-OD2 2.95Å; L308-D311 WeakPolarHBondContact O-CA 3.39Å; L308-D311 VanDerWaalsContact O-CB 3.27Å; L308-D311 WeakPolarHBondContact O-CB 3.48Å; L308-D311 PolarHBondContact O-N 3.44Å; P309-D311 VanDerWaalsContact C-N 3.29Å; P309-D311 PolarHBondContact O-N 2.67Å; D311-Q313 PolarHBondContact O-N 2.98Å; D311-R314 PolarHBondContact O-N 3.47Å; D311-R314 IonicContact OD1-CZ 3.84Å; D311-R314 IonicContact OD1-NE 3.97Å; D311-R314 PolarHBondContact OD1-NE 2.92Å; D311-R314 IonicContact OD1-NH2 3.62Å; D311-R314 PolarHBondContact OD1-NH2 3.41Å; D311-L315 HydrophobicContact CB-CD1 4.08Å; D311-L315 VanDerWaalsContact O-CB 3.23Å; D311-L315 WeakPolarHBondContact O-CB 3.45Å; D311-L315 WeakPolarHBondContact O-CG 2.72Å; D311-L315 PolarHBondContact O-N 3.27Å; D311-Y379 HydrophobicContact CB-CE2 4.16Å; D311-Y379 WeakPolarHBondContact OD2-CE2 3.48Å; D311-Y379 PolarHBondContact OD2-OH 2.96Å; D311-K383 IonicContact OD1-NZ 2.87Å; D311-K383 IonicContact OD2-NZ 3.47Å; D311-K383 PolarHBondContact OD2-NZ 3.48Å
312	L	96.1	Very high	96.1	Very high	12 Å²	12	52.7 Å²	52.7	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-58.8	-48	-178.1	-56.2	-178.4	0	0	0	111.6	A272 L307 P309 S310 R316 V317 L322 A362	A272-L312 HydrophobicContact CB-CD1 4.34Å; L307-L312 HydrophobicContact CD1-CD2 4.27Å; L307-L312 HydrophobicContact CD2-CD2 3.61Å; L307-L312 HydrophobicContact CG-CD2 3.92Å; P309-L312 WeakPolarHBondContact O-CB 3.15Å; P309-L312 PolarHBondContact O-N 3.1Å; S310-L312 VanDerWaalsContact C-N 3.3Å; S310-L312 PolarHBondContact O-N 3.02Å; L312-R316 PolarHBondContact O-N 3.43Å; L312-V317 HydrophobicContact CD2-CG2 4.15Å; L312-V317 PolarHBondContact O-N 2.87Å; L312-V317 VanDerWaalsContact O-N 3.12Å; L312-L322 HydrophobicContact CD1-CD2 4.24Å; L312-L322 HydrophobicContact CD2-CD2 4.31Å; L312-A362 HydrophobicContact CD1-CB 4.02Å; L312-A362 HydrophobicContact CD2-CB 3.59Å; L312-A362 HydrophobicContact CG-CB 4.48Å
313	Q	92.6	Very high	96.1	Very high	157 Å²	157	55.9 Å²	55.9	73%	0.734	27%	0.269	S	S	*	.	H	α-helix	trans	-71.1	-44	177.8	-172.1	-178.2	15.6	0	0	111.5	D311 L315 R316	D311-Q313 PolarHBondContact O-N 2.98Å; Q313-L315 VanDerWaalsContact C-N 3.31Å; Q313-L315 PolarHBondContact O-N 3.36Å; Q313-R316 PolarHBondContact O-N 2.99Å
314	R	95.3	Very high	96.2	Very high	148 Å²	148	59.5 Å²	59.5	56%	0.558	29%	0.294	S	S	*	.	H	α-helix	trans	-61.6	-39.3	-177.8	-175.1	179	64.9	78.2	-0.9	112.3	S310 D311	S310-R314 WeakPolarHBondContact O-CB 3.17Å; S310-R314 PolarHBondContact O-N 3.31Å; D311-R314 PolarHBondContact O-N 3.47Å; D311-R314 IonicContact OD1-CZ 3.84Å; D311-R314 IonicContact OD1-NE 3.97Å; D311-R314 PolarHBondContact OD1-NE 2.92Å; D311-R314 IonicContact OD1-NH2 3.62Å; D311-R314 PolarHBondContact OD1-NH2 3.41Å
315	L	95.6	Very high	96.2	Very high	33 Å²	33	60.6 Å²	60.6	17%	0.173	30%	0.299	C	S	.	.	H	α-helix	trans	-86.9	-7.3	-179.6	-61	174.5	0	0	0	113.1	D311 Q313 V317 L367 I370 F374 Y379	D311-L315 HydrophobicContact CB-CD1 4.08Å; D311-L315 VanDerWaalsContact O-CB 3.23Å; D311-L315 WeakPolarHBondContact O-CB 3.45Å; D311-L315 WeakPolarHBondContact O-CG 2.72Å; D311-L315 PolarHBondContact O-N 3.27Å; Q313-L315 VanDerWaalsContact C-N 3.31Å; Q313-L315 PolarHBondContact O-N 3.36Å; L315-V317 VanDerWaalsContact C-N 3.32Å; L315-V317 HydrophobicContact CB-CG2 4.23Å; L315-V317 PolarHBondContact O-N 3.33Å; L315-L367 HydrophobicContact CD1-CD2 3.89Å; L315-I370 HydrophobicContact CB-CD1 4.06Å; L315-F374 HydrophobicContact CD1-CE1 4.1Å; L315-F374 HydrophobicContact CD2-CE1 4.16Å; L315-F374 HydrophobicContact CD2-CZ 3.99Å; L315-Y379 HydrophobicContact CD1-CD2 3.71Å; L315-Y379 HydrophobicContact CD1-CE2 3.87Å
316	R	94.6	Very high	96.2	Very high	218 Å²	218	63.9 Å²	63.9	82%	0.823	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	50.5	-174.5	-56.7	-179.1	179.1	-179.1	-1.2	111.4	L312 Q313	L312-R316 PolarHBondContact O-N 3.43Å; Q313-R316 PolarHBondContact O-N 2.99Å
317	V	95.6	Very high	96.3	Very high	9 Å²	9	70.2 Å²	70.2	6%	0.055	35%	0.347	C	S	.	.			trans	-57.4	127.8	175.2	-179.5	0	0	0	0	108.4	L312 L315 E319 L322 L367 I370	L312-V317 HydrophobicContact CD2-CG2 4.15Å; L312-V317 PolarHBondContact O-N 2.87Å; L312-V317 VanDerWaalsContact O-N 3.12Å; L315-V317 VanDerWaalsContact C-N 3.32Å; L315-V317 HydrophobicContact CB-CG2 4.23Å; L315-V317 PolarHBondContact O-N 3.33Å; V317-E319 PolarHBondContact O-N 3.31Å; V317-L322 HydrophobicContact CB-CD2 4.22Å; V317-L322 HydrophobicContact CG1-CD2 3.83Å; V317-L322 HydrophobicContact CG1-CG 4.49Å; V317-L367 HydrophobicContact CG2-CD2 4.01Å; V317-I370 HydrophobicContact CG2-CD1 4.14Å
318	P	95.3	Very high	96.3	Very high	50 Å²	50	73.5 Å²	73.5	33%	0.325	37%	0.374	S	S	.	.			trans	-51.4	134.1	178.6	-28.5	34.4	0	0	0	112.7	D320 S321 S369	P318-D320 PolarHBondContact O-N 2.96Å; P318-S321 WeakPolarHBondContact O-CB 3.36Å; P318-S321 PolarHBondContact O-N 2.95Å; P318-S369 VanDerWaalsContact CD-OG 3.25Å; P318-S369 WeakPolarHBondContact CD-OG 3.32Å
319	E	93.3	Very high	96.3	Very high	168 Å²	168	73.4 Å²	73.4	79%	0.785	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-58.9	-34.3	-176.9	-66.2	-176.7	179.5	0	0	112.6	V317 S321 L322	V317-E319 PolarHBondContact O-N 3.31Å; E319-S321 PolarHBondContact O-N 3.4Å; E319-S321 VanDerWaalsContact O-N 3.16Å; E319-L322 WeakPolarHBondContact O-CB 3.25Å; E319-L322 PolarHBondContact O-N 2.78Å
320	D	94.7	Very high	96.3	Very high	164 Å²	164	75 Å²	75	88%	0.877	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-64.6	-17.8	177.1	-63.6	-28.3	0	0	0	113.5	P318	P318-D320 PolarHBondContact O-N 2.96Å
321	S	94.9	Very high	96.3	Very high	38 Å²	38	77.5 Å²	77.5	27%	0.266	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-94.2	-4.5	175.2	-58.7	0	0	0	0	113	P318 E319 S369	P318-S321 WeakPolarHBondContact O-CB 3.36Å; P318-S321 PolarHBondContact O-N 2.95Å; E319-S321 PolarHBondContact O-N 3.4Å; E319-S321 VanDerWaalsContact O-N 3.16Å; S321-S369 VanDerWaalsContact OG-CB 3.27Å; S321-S369 WeakPolarHBondContact OG-CB 3.45Å; S321-S369 PolarHBondContact OG-OG 2.87Å
322	L	96.9	Very high	96.3	Very high	37 Å²	37	79.5 Å²	79.5	19%	0.194	40%	0.399	C	S	.	.			trans	-93.6	144.7	177.9	-57	179.5	0	0	0	110.2	L312 V317 E319 V360 A362	L312-L322 HydrophobicContact CD1-CD2 4.24Å; L312-L322 HydrophobicContact CD2-CD2 4.31Å; V317-L322 HydrophobicContact CB-CD2 4.22Å; V317-L322 HydrophobicContact CG1-CD2 3.83Å; V317-L322 HydrophobicContact CG1-CG 4.49Å; E319-L322 WeakPolarHBondContact O-CB 3.25Å; E319-L322 PolarHBondContact O-N 2.78Å; L322-V360 HydrophobicContact CB-CB 4.29Å; L322-V360 HydrophobicContact CB-CG1 4.38Å; L322-V360 HydrophobicContact CD1-CG2 4.3Å; L322-A362 HydrophobicContact CD2-CB 3.86Å
323	I	97.9	Very high	96.4	Very high	67 Å²	67	78.9 Å²	78.9	34%	0.344	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.8	-176	-55.1	170.2	0	0	0	108.2	V360 K361 E363	I323-V360 CarbonylContact O-C 3.52Å; I323-V360 WeakPolarHBondContact O-CA 3.48Å; I323-K361 HydrophobicContact CB-CG 3.89Å; I323-K361 HydrophobicContact CG2-CG 4.23Å; I323-K361 PolarHBondContact N-O 3.15Å; I323-K361 WeakPolarHBondContact O-CG 3.25Å; I323-K361 PolarHBondContact O-N 3.47Å; I323-E363 HydrophobicContact CD1-CG 4.19Å
324	P	98.1	Very high	96.5	Very high	95 Å²	95	74.8 Å²	74.8	62%	0.617	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59	141.2	174.1	-24.8	34.3	0	0	0	112.2	T326	P324-T326 PolarHBondContact O-N 3.25Å
325	L	98.1	Very high	96.5	Very high	23 Å²	23	70 Å²	70	12%	0.12	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-65.3	134.4	174.2	-67.1	-177.1	0	0	0	110.7	D329 L333 M355 K359 K361	L325-D329 HydrophobicContact CB-CB 4.21Å; L325-D329 HydrophobicContact CD2-CB 3.91Å; L325-L333 HydrophobicContact CD1-CD1 3.76Å; L325-M355 HydrophobicContact CD1-CG 4.36Å; L325-M355 HydrophobicContact CD2-CG 4.48Å; L325-M355 HydrophobicContact CD2-SD 4.46Å; L325-K359 PolarHBondContact N-O 3.16Å; L325-K361 HydrophobicContact CD2-CB 3.71Å; L325-K361 HydrophobicContact CD2-CD 4.09Å; L325-K361 HydrophobicContact CD2-CG 4Å
326	T	98.2	Very high	96.5	Very high	68 Å²	68	68.4 Å²	68.4	42%	0.417	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-82.4	166.3	169.9	70.1	0	0	0	0	110.8	P324 A328 D329 E330	P324-T326 PolarHBondContact O-N 3.25Å; T326-A328 PolarHBondContact O-N 3.12Å; T326-A328 PolarHBondContact OG1-N 3.43Å; T326-D329 WeakPolarHBondContact CB-OD2 3.48Å; T326-D329 WeakPolarHBondContact CG2-OD2 3.43Å; T326-D329 PolarHBondContact N-OD2 3.06Å; T326-D329 WeakPolarHBondContact O-CB 3.37Å; T326-D329 PolarHBondContact O-N 3.26Å; T326-D329 VanDerWaalsContact O-N 3.08Å; T326-D329 PolarHBondContact OG1-N 3.44Å; T326-D329 PolarHBondContact OG1-OD2 3.03Å; T326-E330 PolarHBondContact O-N 2.75Å
327	K	97.8	Very high	96.5	Very high	134 Å²	134	60.4 Å²	60.4	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-60.6	-33.3	174.4	-168.9	65.4	-169.1	170.5	0	112.9	E330 N331	K327-E330 WeakPolarHBondContact CD-OE2 3Å; K327-E330 IonicContact NZ-OE2 2.83Å; K327-E330 PolarHBondContact NZ-OE2 2.63Å; K327-E330 PolarHBondContact O-N 2.78Å; K327-N331 WeakPolarHBondContact O-CB 3.26Å; K327-N331 PolarHBondContact O-N 3.01Å; K327-N331 PolarHBondContact O-ND2 2.91Å
328	A	97.8	Very high	96.3	Very high	68 Å²	68	68.3 Å²	68.3	56%	0.562	37%	0.367	S	S	*	.	H	α-helix	trans	-65	-41.4	175.5	0	0	0	0	0	111.3	T326 N331 K332	T326-A328 PolarHBondContact O-N 3.12Å; T326-A328 PolarHBondContact OG1-N 3.43Å; A328-N331 PolarHBondContact O-N 3.33Å; A328-K332 WeakPolarHBondContact O-CB 3.28Å; A328-K332 PolarHBondContact O-N 3.07Å
329	D	98.2	Very high	96.1	Very high	5 Å²	5	67.4 Å²	67.4	3%	0.027	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-46.9	175.6	-61.9	-49.7	0	0	0	111.1	P274 L325 T326 N331 K332 L333 K361	P274-D329 HydrophobicContact CG-CB 3.85Å; L325-D329 HydrophobicContact CB-CB 4.21Å; L325-D329 HydrophobicContact CD2-CB 3.91Å; T326-D329 WeakPolarHBondContact CB-OD2 3.48Å; T326-D329 WeakPolarHBondContact CG2-OD2 3.43Å; T326-D329 PolarHBondContact N-OD2 3.06Å; T326-D329 WeakPolarHBondContact O-CB 3.37Å; T326-D329 PolarHBondContact O-N 3.26Å; T326-D329 VanDerWaalsContact O-N 3.08Å; T326-D329 PolarHBondContact OG1-N 3.44Å; T326-D329 PolarHBondContact OG1-OD2 3.03Å; D329-N331 VanDerWaalsContact C-N 3.35Å; D329-N331 PolarHBondContact O-N 3.01Å; D329-K332 WeakPolarHBondContact O-CB 3.31Å; D329-K332 PolarHBondContact O-N 2.8Å; D329-K332 VanDerWaalsContact O-N 3.11Å; D329-L333 WeakPolarHBondContact O-CG 3.49Å; D329-L333 PolarHBondContact O-N 2.96Å; D329-K361 VanDerWaalsContact CG-NZ 3.3Å; D329-K361 IonicContact OD1-NZ 3.39Å; D329-K361 PolarHBondContact OD1-NZ 2.75Å; D329-K361 VanDerWaalsContact OD1-NZ 3.12Å; D329-K361 WeakPolarHBondContact OD2-CE 3.21Å; D329-K361 IonicContact OD2-NZ 2.7Å; D329-K361 PolarHBondContact OD2-NZ 2.98Å
330	E	97.6	Very high	96	Very high	39 Å²	39	62 Å²	62	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-44.9	176.7	-65	-169.5	146.9	0	0	112.4	T326 K327 K332 L333 N334 K359	T326-E330 PolarHBondContact O-N 2.75Å; K327-E330 WeakPolarHBondContact CD-OE2 3Å; K327-E330 IonicContact NZ-OE2 2.83Å; K327-E330 PolarHBondContact NZ-OE2 2.63Å; K327-E330 PolarHBondContact O-N 2.78Å; E330-K332 VanDerWaalsContact C-N 3.26Å; E330-K332 PolarHBondContact O-N 2.66Å; E330-L333 PolarHBondContact O-N 3.27Å; E330-N334 WeakPolarHBondContact O-CB 3.37Å; E330-N334 PolarHBondContact O-N 3.12Å; E330-N334 PolarHBondContact O-ND2 3.42Å; E330-N334 VanDerWaalsContact O-ND2 3.14Å; E330-K359 IonicContact OE1-NZ 3.39Å; E330-K359 PolarHBondContact OE1-NZ 3.25Å
331	N	97.4	Very high	95.7	Very high	90 Å²	90	54.3 Å²	54.3	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-36.8	177.3	-70.6	-18.9	0	0	0	111.2	K327 A328 D329 S335	K327-N331 WeakPolarHBondContact O-CB 3.26Å; K327-N331 PolarHBondContact O-N 3.01Å; K327-N331 PolarHBondContact O-ND2 2.91Å; A328-N331 PolarHBondContact O-N 3.33Å; D329-N331 VanDerWaalsContact C-N 3.35Å; D329-N331 PolarHBondContact O-N 3.01Å; N331-S335 PolarHBondContact O-N 2.88Å
332	K	97.1	Very high	95.5	Very high	46 Å²	46	52.6 Å²	52.6	20%	0.2	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-46.6	176.3	-170.3	68.1	173.6	-169.7	0	111.7	P274 E278 A328 D329 E330 N334 S335 L336	P274-K332 HydrophobicContact CB-CB 3.83Å; P274-K332 HydrophobicContact CB-CG 3.6Å; E278-K332 WeakPolarHBondContact OE1-CE 3.38Å; E278-K332 IonicContact OE1-NZ 3.52Å; E278-K332 PolarHBondContact OE1-NZ 3.14Å; E278-K332 WeakPolarHBondContact OE2-CE 3.39Å; E278-K332 IonicContact OE2-NZ 3.69Å; E278-K332 PolarHBondContact OE2-NZ 3.09Å; A328-K332 WeakPolarHBondContact O-CB 3.28Å; A328-K332 PolarHBondContact O-N 3.07Å; D329-K332 WeakPolarHBondContact O-CB 3.31Å; D329-K332 PolarHBondContact O-N 2.8Å; D329-K332 VanDerWaalsContact O-N 3.11Å; E330-K332 VanDerWaalsContact C-N 3.26Å; E330-K332 PolarHBondContact O-N 2.66Å; K332-N334 VanDerWaalsContact C-N 3.33Å; K332-N334 PolarHBondContact O-N 3.32Å; K332-S335 CarbonylContact O-C 3.51Å; K332-S335 WeakPolarHBondContact O-CA 3.32Å; K332-S335 WeakPolarHBondContact O-CB 3.09Å; K332-S335 PolarHBondContact O-N 3.44Å; K332-L336 HydrophobicContact CG-CD1 4.39Å; K332-L336 WeakPolarHBondContact O-CG 3.46Å; K332-L336 PolarHBondContact O-N 2.85Å
333	L	97	Very high	95	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-45.7	175.6	-67.7	165.9	0	0	0	111.3	P274 I277 L325 D329 E330 S335 L336 L337 I352 M355 Q356	P274-L333 HydrophobicContact CB-CD2 3.95Å; P274-L333 HydrophobicContact CB-CG 4.05Å; P274-L333 HydrophobicContact CG-CD1 4.13Å; P274-L333 HydrophobicContact CG-CD2 3.82Å; P274-L333 HydrophobicContact CG-CG 3.68Å; I277-L333 HydrophobicContact CD1-CD2 4.25Å; L325-L333 HydrophobicContact CD1-CD1 3.76Å; D329-L333 WeakPolarHBondContact O-CG 3.49Å; D329-L333 PolarHBondContact O-N 2.96Å; E330-L333 PolarHBondContact O-N 3.27Å; L333-S335 VanDerWaalsContact C-N 3.26Å; L333-S335 PolarHBondContact O-N 3.06Å; L333-L336 PolarHBondContact O-N 3.24Å; L333-L336 VanDerWaalsContact O-N 3.1Å; L333-L337 PolarHBondContact O-N 3.19Å; L333-I352 HydrophobicContact CB-CG2 4.48Å; L333-I352 HydrophobicContact CD2-CG2 3.92Å; L333-M355 HydrophobicContact CD1-CG 4.34Å; L333-M355 HydrophobicContact CD1-SD 4.01Å; L333-M355 HydrophobicContact CD2-SD 3.75Å; L333-M355 HydrophobicContact CG-SD 4.47Å; L333-Q356 HydrophobicContact CB-CG 4Å; L333-Q356 HydrophobicContact CD1-CG 3.77Å; L333-Q356 HydrophobicContact CG-CG 4.42Å
334	N	96.2	Very high	94.4	Very high	70 Å²	70	56.5 Å²	56.5	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-33.2	175.3	-72.3	-34.5	0	0	0	112.8	E330 K332 K338 Q356	E330-N334 WeakPolarHBondContact O-CB 3.37Å; E330-N334 PolarHBondContact O-N 3.12Å; E330-N334 PolarHBondContact O-ND2 3.42Å; E330-N334 VanDerWaalsContact O-ND2 3.14Å; K332-N334 VanDerWaalsContact C-N 3.33Å; K332-N334 PolarHBondContact O-N 3.32Å; N334-K338 WeakPolarHBondContact O-CD 3.47Å; N334-K338 WeakPolarHBondContact O-CG 3.28Å; N334-Q356 PolarHBondContact OD1-NE2 3.21Å
335	S	94.8	Very high	94.1	Very high	47 Å²	47	53.6 Å²	53.6	33%	0.329	29%	0.293	S	S	.	.	H	α-helix	trans	-72.5	-35.9	173.8	179.5	0	0	0	0	112.3	N331 K332 L333 K338 R339	N331-S335 PolarHBondContact O-N 2.88Å; K332-S335 CarbonylContact O-C 3.51Å; K332-S335 WeakPolarHBondContact O-CA 3.32Å; K332-S335 WeakPolarHBondContact O-CB 3.09Å; K332-S335 PolarHBondContact O-N 3.44Å; L333-S335 VanDerWaalsContact C-N 3.26Å; L333-S335 PolarHBondContact O-N 3.06Å; S335-K338 PolarHBondContact O-N 2.84Å; S335-R339 PolarHBondContact O-NE 3Å; S335-R339 PolarHBondContact OG-NH2 3.32Å
336	L	94.6	Very high	93.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.1	-46	177.3	-72.9	169	0	0	0	111.2	P274 I277 E278 K332 L333 K338 R339 L342	P274-L336 HydrophobicContact CB-CD1 4.34Å; P274-L336 WeakPolarHBondContact O-CD1 3.19Å; I277-L336 HydrophobicContact CB-CD1 4.15Å; I277-L336 HydrophobicContact CG2-CD1 3.93Å; E278-L336 HydrophobicContact CB-CD2 4.36Å; K332-L336 HydrophobicContact CG-CD1 4.39Å; K332-L336 WeakPolarHBondContact O-CG 3.46Å; K332-L336 PolarHBondContact O-N 2.85Å; L333-L336 PolarHBondContact O-N 3.24Å; L333-L336 VanDerWaalsContact O-N 3.1Å; L336-K338 PolarHBondContact O-N 2.62Å; L336-K338 VanDerWaalsContact O-N 3.09Å; L336-R339 WeakPolarHBondContact O-CB 3.01Å; L336-R339 WeakPolarHBondContact O-CG 3.44Å; L336-R339 PolarHBondContact O-N 2.97Å; L336-L342 HydrophobicContact CB-CD1 4.48Å; L336-L342 WeakPolarHBondContact O-CD1 3.41Å
337	L	94.1	Very high	93.8	Very high	50 Å²	50	56.4 Å²	56.4	26%	0.262	31%	0.309	S	S	.	.	H	α-helix	trans	-58.6	-23.4	176.8	-73.3	172.7	0	0	0	113.9	L333 R339 L342 I352	L333-L337 PolarHBondContact O-N 3.19Å; L337-R339 VanDerWaalsContact C-N 3.34Å; L337-L342 HydrophobicContact CD2-CD1 4.46Å; L337-I352 HydrophobicContact CD1-CG2 4.02Å; L337-I352 HydrophobicContact CD2-CB 4.15Å; L337-I352 HydrophobicContact CD2-CG2 3.63Å; L337-I352 HydrophobicContact CG-CG2 3.67Å
338	K	92.8	Very high	93.7	Very high	176 Å²	176	50 Å²	50	77%	0.765	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.2	176.4	-68.1	174.6	-175.9	-175.5	0	113.7	N334 S335 L336	N334-K338 WeakPolarHBondContact O-CD 3.47Å; N334-K338 WeakPolarHBondContact O-CG 3.28Å; S335-K338 PolarHBondContact O-N 2.84Å; L336-K338 PolarHBondContact O-N 2.62Å; L336-K338 VanDerWaalsContact O-N 3.09Å
339	R	91.6	Very high	93.6	Very high	30 Å²	30	47.9 Å²	47.9	11%	0.113	26%	0.263	C	S	.	.	S	Bend	trans	-73.3	138	-178.2	-59.8	-74.6	168.5	115.5	-5	109.6	S335 L336 L337 Y341 L342	S335-R339 PolarHBondContact O-NE 3Å; S335-R339 PolarHBondContact OG-NH2 3.32Å; L336-R339 WeakPolarHBondContact O-CB 3.01Å; L336-R339 WeakPolarHBondContact O-CG 3.44Å; L336-R339 PolarHBondContact O-N 2.97Å; L337-R339 VanDerWaalsContact C-N 3.34Å; R339-Y341 HydrophobicContact CB-CD1 4.3Å; R339-Y341 HydrophobicContact CB-CD2 4.17Å; R339-Y341 HydrophobicContact CB-CE1 3.85Å; R339-Y341 HydrophobicContact CB-CE2 3.7Å; R339-Y341 HydrophobicContact CB-CG 4.45Å; R339-Y341 HydrophobicContact CG-CE1 4.34Å; R339-Y341 HydrophobicContact CG-CE2 4.23Å; R339-Y341 PolarHBondContact O-N 3.37Å; R339-L342 PolarHBondContact O-N 3Å
340	P	89.8	Confident	93.6	Very high	56 Å²	56	53.4 Å²	53.4	36%	0.364	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-62.1	-31.2	-173	24.4	-34.6	0	0	0	113.3	W72 F77 L83	W72-P340 HydrophobicContact CZ3-CG 4.01Å; F77-P340 HydrophobicContact CB-CB 4.05Å; F77-P340 HydrophobicContact CB-CG 3.91Å; L83-P340 HydrophobicContact CD2-CG 4.46Å
341	Y	89.9	Confident	93.6	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.008	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-75.8	-20.4	-178.1	49.3	-106.9	0	0	0	114.2	W72 F77 L83 C281 Y285 R339 T343 S344	W72-Y341 HydrophobicContact CH2-CE1 4.14Å; F77-Y341 HydrophobicContact CD2-CD1 4.35Å; F77-Y341 VanDerWaalsContact CE2-CB 3.44Å; F77-Y341 HydrophobicContact CE2-CG 4.45Å; F77-Y341 VanDerWaalsContact CZ-CB 3.42Å; L83-Y341 HydrophobicContact CD1-CE1 4.23Å; L83-Y341 HydrophobicContact CD2-CD1 3.85Å; L83-Y341 HydrophobicContact CD2-CE1 3.95Å; L83-Y341 HydrophobicContact CG-CD1 4.42Å; L83-Y341 HydrophobicContact CG-CE1 4.28Å; C281-Y341 HydrophobicContact CB-CE2 4.2Å; Y285-Y341 HydrophobicContact CD1-CG 4.37Å; Y285-Y341 AromaticContact CD2-CD1 3.95Å; Y285-Y341 HydrophobicContact CD2-CD1 3.95Å; Y285-Y341 AromaticContact CD2-CD2 3.33Å; Y285-Y341 HydrophobicContact CD2-CD2 3.33Å; Y285-Y341 HydrophobicContact CD2-CE1 4.2Å; Y285-Y341 AromaticContact CD2-CE2 3.63Å; Y285-Y341 HydrophobicContact CD2-CE2 3.63Å; Y285-Y341 AromaticContact CD2-CG 3.51Å; Y285-Y341 HydrophobicContact CD2-CG 3.51Å; Y285-Y341 AromaticContact CE2-CD2 3.36Å; Y285-Y341 HydrophobicContact CE2-CD2 3.36Å; Y285-Y341 AromaticContact CE2-CE2 3.95Å; Y285-Y341 HydrophobicContact CE2-CE2 3.95Å; Y285-Y341 AromaticContact CE2-CG 3.77Å; Y285-Y341 HydrophobicContact CE2-CG 3.77Å; Y285-Y341 AromaticContact CG-CD1 3.98Å; Y285-Y341 HydrophobicContact CG-CD1 3.98Å; Y285-Y341 HydrophobicContact CG-CD2 4.14Å; Y285-Y341 HydrophobicContact CG-CE1 4.41Å; Y285-Y341 AromaticContact CG-CG 3.83Å; Y285-Y341 HydrophobicContact CG-CG 3.83Å; R339-Y341 HydrophobicContact CB-CD1 4.3Å; R339-Y341 HydrophobicContact CB-CD2 4.17Å; R339-Y341 HydrophobicContact CB-CE1 3.85Å; R339-Y341 HydrophobicContact CB-CE2 3.7Å; R339-Y341 HydrophobicContact CB-CG 4.45Å; R339-Y341 HydrophobicContact CG-CE1 4.34Å; R339-Y341 HydrophobicContact CG-CE2 4.23Å; R339-Y341 PolarHBondContact O-N 3.37Å; Y341-T343 VanDerWaalsContact C-N 3.27Å; Y341-T343 PolarHBondContact O-N 3.44Å; Y341-S344 PolarHBondContact O-N 3.31Å; Y341-S344 PolarHBondContact O-OG 3.05Å
342	L	90.5	Very high	93.5	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-71	-24.5	-179.9	-75.9	-160.7	0	0	0	112.9	L336 L337 R339 S344 Q345 W348 C349 I352	L336-L342 HydrophobicContact CB-CD1 4.48Å; L336-L342 WeakPolarHBondContact O-CD1 3.41Å; L337-L342 HydrophobicContact CD2-CD1 4.46Å; R339-L342 PolarHBondContact O-N 3Å; L342-S344 PolarHBondContact O-N 3Å; L342-S344 VanDerWaalsContact O-N 3.15Å; L342-Q345 HydrophobicContact CD2-CB 4.5Å; L342-Q345 CarbonylContact O-C 3.59Å; L342-Q345 PolarHBondContact O-N 2.82Å; L342-W348 HydrophobicContact CD2-CB 4.36Å; L342-W348 HydrophobicContact CD2-CE3 3.92Å; L342-C349 PolarHBondContact O-SG 3.11Å; L342-I352 HydrophobicContact CD1-CD1 3.48Å; L342-I352 VanDerWaalsContact CD1-CD1 3.48Å
343	T	84.8	Confident	93.5	Very high	128 Å²	128	50.3 Å²	50.3	79%	0.785	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-59	-27.9	172.7	-49.1	0	0	0	0	112.2	Y341 Q345	Y341-T343 VanDerWaalsContact C-N 3.27Å; Y341-T343 PolarHBondContact O-N 3.44Å; T343-Q345 VanDerWaalsContact C-N 3.34Å
344	S	85.9	Confident	93.5	Very high	59 Å²	59	52.5 Å²	52.5	41%	0.413	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-85.5	-1.1	175.6	73.9	0	0	0	0	114.4	Y341 L342	Y341-S344 PolarHBondContact O-N 3.31Å; Y341-S344 PolarHBondContact O-OG 3.05Å; L342-S344 PolarHBondContact O-N 3Å; L342-S344 VanDerWaalsContact O-N 3.15Å
345	Q	92.1	Very high	93.6	Very high	34 Å²	34	49.2 Å²	49.2	16%	0.159	26%	0.264	C	S	.	.			trans	-127.4	71.3	-174.2	-59.4	-62.3	-49	0	0	110.7	Y285 L342 T343 D347 W348 C349	Y285-Q345 VanDerWaalsContact OH-CD 3.24Å; Y285-Q345 WeakPolarHBondContact OH-CG 3.3Å; Y285-Q345 PolarHBondContact OH-NE2 2.71Å; L342-Q345 HydrophobicContact CD2-CB 4.5Å; L342-Q345 CarbonylContact O-C 3.59Å; L342-Q345 PolarHBondContact O-N 2.82Å; T343-Q345 VanDerWaalsContact C-N 3.34Å; Q345-D347 PolarHBondContact O-N 2.55Å; Q345-W348 HydrophobicContact CB-CB 3.87Å; Q345-W348 HydrophobicContact CB-CD2 4.21Å; Q345-W348 HydrophobicContact CB-CG 3.9Å; Q345-W348 HydrophobicContact CG-CD2 4.34Å; Q345-W348 HydrophobicContact CG-CE3 4.49Å; Q345-W348 PolarHBondContact O-N 2.9Å; Q345-C349 PolarHBondContact O-N 3.46Å; Q345-C349 VanDerWaalsContact O-N 3.09Å
346	P	94.1	Very high	93.7	Very high	79 Å²	79	49 Å²	49	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-34.7	-175.6	24	-33.9	0	0	0	112.8	C349 K350	P346-C349 WeakPolarHBondContact O-CB 3.46Å; P346-C349 PolarHBondContact O-N 3.27Å; P346-K350 WeakPolarHBondContact O-CG 3.28Å; P346-K350 PolarHBondContact O-N 2.82Å; P346-K350 VanDerWaalsContact O-N 3.08Å
347	D	95.7	Very high	93.8	Very high	70 Å²	70	55.7 Å²	55.7	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-72.5	-34.8	-180	-61.9	-42	0	0	0	112.2	Q345 C349 K350 E351 V390	Q345-D347 PolarHBondContact O-N 2.55Å; D347-C349 VanDerWaalsContact C-N 3.35Å; D347-K350 PolarHBondContact O-N 3.4Å; D347-K350 IonicContact OD1-NZ 2.71Å; D347-K350 PolarHBondContact OD1-NZ 3.24Å; D347-E351 WeakPolarHBondContact O-CG 3.4Å; D347-E351 PolarHBondContact O-N 3.09Å; D347-E351 VanDerWaalsContact O-N 3.12Å; D347-V390 HydrophobicContact CB-CB 4.02Å; D347-V390 HydrophobicContact CB-CG1 4.05Å
348	W	95.9	Very high	93.9	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.5	-38.9	172.7	-67	22.8	0	0	0	111.3	M280 K284 Y285 W304 L342 Q345 E351 I352 V390	M280-W348 HydrophobicContact CE-CD2 3.87Å; M280-W348 HydrophobicContact CE-CE3 3.59Å; M280-W348 HydrophobicContact CE-CH2 3.28Å; M280-W348 HydrophobicContact CE-CZ2 3.57Å; M280-W348 HydrophobicContact CE-CZ3 3.3Å; M280-W348 HydrophobicContact CG-CH2 3.76Å; M280-W348 HydrophobicContact CG-CZ2 4.34Å; M280-W348 HydrophobicContact CG-CZ3 4.4Å; M280-W348 HydrophobicContact SD-CH2 3.48Å; M280-W348 WeakPolarHBondContact SD-CH2 3.39Å; M280-W348 HydrophobicContact SD-CZ2 3.54Å; M280-W348 VanDerWaalsContact SD-CZ2 3.54Å; M280-W348 HydrophobicContact SD-CZ3 4.16Å; K284-W348 HydrophobicContact CD-CH2 3.5Å; K284-W348 HydrophobicContact CD-CZ2 3.93Å; K284-W348 HydrophobicContact CD-CZ3 4.37Å; Y285-W348 HydrophobicContact CE2-CH2 4.28Å; Y285-W348 AromaticContact CE2-CZ3 3.86Å; Y285-W348 HydrophobicContact CE2-CZ3 3.86Å; W304-W348 HydrophobicContact CB-CZ2 4.49Å; W304-W348 HydrophobicContact CE3-CG 4.44Å; L342-W348 HydrophobicContact CD2-CB 4.36Å; L342-W348 HydrophobicContact CD2-CE3 3.92Å; Q345-W348 HydrophobicContact CB-CB 3.87Å; Q345-W348 HydrophobicContact CB-CD2 4.21Å; Q345-W348 HydrophobicContact CB-CG 3.9Å; Q345-W348 HydrophobicContact CG-CD2 4.34Å; Q345-W348 HydrophobicContact CG-CE3 4.49Å; Q345-W348 PolarHBondContact O-N 2.9Å; W348-E351 PolarHBondContact O-N 2.85Å; W348-I352 WeakPolarHBondContact O-CD1 3.27Å; W348-I352 VanDerWaalsContact O-CG1 3.24Å; W348-I352 WeakPolarHBondContact O-CG1 3.22Å; W348-I352 PolarHBondContact O-N 3.34Å; W348-V390 PolarHBondContact NE1-O 2.98Å; W348-V390 PolarHBondContact NE1-OXT 3.16Å; W348-V390 VanDerWaalsContact NE1-OXT 3.13Å
349	C	96.1	Very high	94.1	Very high	24 Å²	24	52.4 Å²	52.4	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-45.1	174.1	-70.6	0	0	0	0	111.6	L342 Q345 P346 D347 E351 I352 E353	L342-C349 PolarHBondContact O-SG 3.11Å; Q345-C349 PolarHBondContact O-N 3.46Å; Q345-C349 VanDerWaalsContact O-N 3.09Å; P346-C349 WeakPolarHBondContact O-CB 3.46Å; P346-C349 PolarHBondContact O-N 3.27Å; D347-C349 VanDerWaalsContact C-N 3.35Å; C349-E351 VanDerWaalsContact C-N 3.34Å; C349-E351 PolarHBondContact O-N 3.48Å; C349-I352 PolarHBondContact O-N 2.92Å; C349-E353 WeakPolarHBondContact O-CB 3.46Å; C349-E353 VanDerWaalsContact O-CG 3.28Å; C349-E353 WeakPolarHBondContact O-CG 3.22Å; C349-E353 PolarHBondContact O-N 3.35Å
350	K	96.7	Very high	94.4	Very high	121 Å²	121	52.6 Å²	52.6	53%	0.526	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-44.7	176.3	-68.9	170.2	-164.8	159.4	0	112	P346 D347 E353 L354	P346-K350 WeakPolarHBondContact O-CG 3.28Å; P346-K350 PolarHBondContact O-N 2.82Å; P346-K350 VanDerWaalsContact O-N 3.08Å; D347-K350 PolarHBondContact O-N 3.4Å; D347-K350 IonicContact OD1-NZ 2.71Å; D347-K350 PolarHBondContact OD1-NZ 3.24Å; K350-E353 PolarHBondContact O-N 2.93Å; K350-L354 VanDerWaalsContact O-CB 3.3Å; K350-L354 WeakPolarHBondContact O-CB 3.26Å; K350-L354 PolarHBondContact O-N 3.41Å
351	E	97.8	Very high	94.8	Very high	21 Å²	21	51.6 Å²	51.6	10%	0.098	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-42.6	177.8	-69.2	-60.1	159.3	0	0	111.9	W304 P309 S310 D347 W348 C349 L354 M355	W304-E351 HydrophobicContact CE3-CB 4.5Å; W304-E351 HydrophobicContact CH2-CB 4.06Å; W304-E351 HydrophobicContact CZ3-CB 3.66Å; W304-E351 HydrophobicContact CZ3-CG 4.23Å; P309-E351 WeakPolarHBondContact CB-O 3.38Å; P309-E351 WeakPolarHBondContact CB-OE2 3.24Å; P309-E351 VanDerWaalsContact CD-OE2 3.22Å; P309-E351 WeakPolarHBondContact CD-OE2 3.5Å; P309-E351 HydrophobicContact CG-CB 4.18Å; P309-E351 WeakPolarHBondContact CG-O 3.43Å; S310-E351 VanDerWaalsContact CB-OE1 3.26Å; S310-E351 WeakPolarHBondContact CB-OE1 3.33Å; S310-E351 WeakPolarHBondContact CB-OE2 3.29Å; S310-E351 PolarHBondContact N-OE2 3.12Å; S310-E351 VanDerWaalsContact OG-CD 3.28Å; S310-E351 PolarHBondContact OG-OE1 3.15Å; S310-E351 PolarHBondContact OG-OE2 2.94Å; D347-E351 WeakPolarHBondContact O-CG 3.4Å; D347-E351 PolarHBondContact O-N 3.09Å; D347-E351 VanDerWaalsContact O-N 3.12Å; W348-E351 PolarHBondContact O-N 2.85Å; C349-E351 VanDerWaalsContact C-N 3.34Å; C349-E351 PolarHBondContact O-N 3.48Å; E351-L354 PolarHBondContact O-N 2.89Å; E351-M355 PolarHBondContact O-N 2.88Å
352	I	97	Very high	95.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.3	-45.1	177.1	-68.9	165.6	0	0	0	111.2	I277 L333 L337 L342 W348 C349 L354 M355 Q356	I277-I352 HydrophobicContact CD1-CG1 3.91Å; I277-I352 HydrophobicContact CG2-CD1 4.26Å; L333-I352 HydrophobicContact CB-CG2 4.48Å; L333-I352 HydrophobicContact CD2-CG2 3.92Å; L337-I352 HydrophobicContact CD1-CG2 4.02Å; L337-I352 HydrophobicContact CD2-CB 4.15Å; L337-I352 HydrophobicContact CD2-CG2 3.63Å; L337-I352 HydrophobicContact CG-CG2 3.67Å; L342-I352 HydrophobicContact CD1-CD1 3.48Å; L342-I352 VanDerWaalsContact CD1-CD1 3.48Å; W348-I352 WeakPolarHBondContact O-CD1 3.27Å; W348-I352 VanDerWaalsContact O-CG1 3.24Å; W348-I352 WeakPolarHBondContact O-CG1 3.22Å; W348-I352 PolarHBondContact O-N 3.34Å; C349-I352 PolarHBondContact O-N 2.92Å; I352-L354 VanDerWaalsContact C-N 3.33Å; I352-M355 WeakPolarHBondContact O-CB 3.43Å; I352-M355 PolarHBondContact O-N 2.77Å; I352-Q356 WeakPolarHBondContact O-CG 3.38Å; I352-Q356 PolarHBondContact O-N 3.22Å
353	E	96.4	Very high	95.4	Very high	89 Å²	89	55.3 Å²	55.3	42%	0.416	29%	0.291	S	S	.	.	H	α-helix	trans	-63	-40.5	176.7	-73.7	171.5	-177	0	0	111.4	C349 K350 M355 Q356 Q357	C349-E353 WeakPolarHBondContact O-CB 3.46Å; C349-E353 VanDerWaalsContact O-CG 3.28Å; C349-E353 WeakPolarHBondContact O-CG 3.22Å; C349-E353 PolarHBondContact O-N 3.35Å; K350-E353 PolarHBondContact O-N 2.93Å; E353-M355 VanDerWaalsContact C-N 3.34Å; E353-M355 PolarHBondContact O-N 2.85Å; E353-Q356 WeakPolarHBondContact O-CB 3.43Å; E353-Q356 PolarHBondContact O-N 3.24Å; E353-Q356 VanDerWaalsContact O-N 3.15Å; E353-Q357 VanDerWaalsContact O-CG 3.28Å; E353-Q357 WeakPolarHBondContact O-CG 3.44Å; E353-Q357 PolarHBondContact O-N 3.33Å
354	L	97.4	Very high	95.9	Very high	46 Å²	46	49.3 Å²	49.3	24%	0.241	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-42.8	175.1	-176.6	64.2	0	0	0	111.4	P309 S310 K350 E351 I352 Q356 Q357 S358	P309-L354 HydrophobicContact CB-CB 4.42Å; P309-L354 HydrophobicContact CB-CD2 4.25Å; P309-L354 HydrophobicContact CB-CG 4.42Å; S310-L354 VanDerWaalsContact CA-CD2 3.43Å; K350-L354 VanDerWaalsContact O-CB 3.3Å; K350-L354 WeakPolarHBondContact O-CB 3.26Å; K350-L354 PolarHBondContact O-N 3.41Å; E351-L354 PolarHBondContact O-N 2.89Å; I352-L354 VanDerWaalsContact C-N 3.33Å; L354-Q356 VanDerWaalsContact C-N 3.33Å; L354-Q356 PolarHBondContact O-N 2.98Å; L354-Q357 PolarHBondContact O-N 3.29Å; L354-S358 WeakPolarHBondContact O-CB 3.48Å; L354-S358 PolarHBondContact O-N 3.22Å; L354-S358 PolarHBondContact O-OG 3.18Å
355	M	97.4	Very high	96.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-40.1	173.6	-169	-170.6	-65.9	0	0	111.9	A272 P274 I277 P309 L325 L333 E351 I352 E353 Q357 S358 K359 V360	A272-M355 VanDerWaalsContact C-CE 3.43Å; A272-M355 WeakPolarHBondContact O-CE 3.42Å; P274-M355 HydrophobicContact CG-SD 4.36Å; I277-M355 HydrophobicContact CD1-CE 3.8Å; P309-M355 HydrophobicContact CB-CB 4.14Å; P309-M355 HydrophobicContact CG-CB 3.99Å; P309-M355 HydrophobicContact CG-CE 3.55Å; L325-M355 HydrophobicContact CD1-CG 4.36Å; L325-M355 HydrophobicContact CD2-CG 4.48Å; L325-M355 HydrophobicContact CD2-SD 4.46Å; L333-M355 HydrophobicContact CD1-CG 4.34Å; L333-M355 HydrophobicContact CD1-SD 4.01Å; L333-M355 HydrophobicContact CD2-SD 3.75Å; L333-M355 HydrophobicContact CG-SD 4.47Å; E351-M355 PolarHBondContact O-N 2.88Å; I352-M355 WeakPolarHBondContact O-CB 3.43Å; I352-M355 PolarHBondContact O-N 2.77Å; E353-M355 VanDerWaalsContact C-N 3.34Å; E353-M355 PolarHBondContact O-N 2.85Å; M355-Q357 VanDerWaalsContact C-N 3.33Å; M355-Q357 PolarHBondContact O-N 3.47Å; M355-S358 PolarHBondContact O-OG 2.61Å; M355-K359 PolarHBondContact O-N 2.91Å; M355-K359 VanDerWaalsContact O-N 3.08Å; M355-V360 WeakPolarHBondContact CG-O 3.46Å
356	Q	96.9	Very high	96.5	Very high	41 Å²	41	48.7 Å²	48.7	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-35.4	175.8	-72.6	-171.5	-38.1	0	0	113	L333 N334 I352 E353 L354 K359	L333-Q356 HydrophobicContact CB-CG 4Å; L333-Q356 HydrophobicContact CD1-CG 3.77Å; L333-Q356 HydrophobicContact CG-CG 4.42Å; N334-Q356 PolarHBondContact OD1-NE2 3.21Å; I352-Q356 WeakPolarHBondContact O-CG 3.38Å; I352-Q356 PolarHBondContact O-N 3.22Å; E353-Q356 WeakPolarHBondContact O-CB 3.43Å; E353-Q356 PolarHBondContact O-N 3.24Å; E353-Q356 VanDerWaalsContact O-N 3.15Å; L354-Q356 VanDerWaalsContact C-N 3.33Å; L354-Q356 PolarHBondContact O-N 2.98Å; Q356-K359 WeakPolarHBondContact O-CD 3.43Å; Q356-K359 WeakPolarHBondContact O-CE 3.43Å; Q356-K359 PolarHBondContact O-NZ 3.46Å
357	Q	97	Very high	96.5	Very high	142 Å²	142	44.9 Å²	44.9	66%	0.664	22%	0.221	S	C	*	.	H	α-helix	trans	-74.4	-44.7	178.6	-71.3	170.6	21.5	0	0	111.8	E353 L354 M355 K359	E353-Q357 VanDerWaalsContact O-CG 3.28Å; E353-Q357 WeakPolarHBondContact O-CG 3.44Å; E353-Q357 PolarHBondContact O-N 3.33Å; L354-Q357 PolarHBondContact O-N 3.29Å; M355-Q357 VanDerWaalsContact C-N 3.33Å; M355-Q357 PolarHBondContact O-N 3.47Å; Q357-K359 VanDerWaalsContact C-N 3.27Å; Q357-K359 PolarHBondContact O-N 3.28Å
358	S	96.1	Very high	96.4	Very high	55 Å²	55	44.8 Å²	44.8	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-72.2	-21.7	-179	69.4	0	0	0	0	113	L354 M355 V360	L354-S358 WeakPolarHBondContact O-CB 3.48Å; L354-S358 PolarHBondContact O-N 3.22Å; L354-S358 PolarHBondContact O-OG 3.18Å; M355-S358 PolarHBondContact O-OG 2.61Å; S358-V360 PolarHBondContact O-N 2.89Å; S358-V360 WeakPolarHBondContact OG-CG2 3.25Å
359	K	97.1	Very high	96.3	Very high	101 Å²	101	47.1 Å²	47.1	44%	0.439	24%	0.243	S	C	.	.			trans	59	24	179.8	-60.3	-66.6	-177.3	-174.3	0	114	L325 E330 M355 Q356 Q357	L325-K359 PolarHBondContact N-O 3.16Å; E330-K359 IonicContact OE1-NZ 3.39Å; E330-K359 PolarHBondContact OE1-NZ 3.25Å; M355-K359 PolarHBondContact O-N 2.91Å; M355-K359 VanDerWaalsContact O-N 3.08Å; Q356-K359 WeakPolarHBondContact O-CD 3.43Å; Q356-K359 WeakPolarHBondContact O-CE 3.43Å; Q356-K359 PolarHBondContact O-NZ 3.46Å; Q357-K359 VanDerWaalsContact C-N 3.27Å; Q357-K359 PolarHBondContact O-N 3.28Å
360	V	97.6	Very high	96.2	Very high	34 Å²	34	48.9 Å²	48.9	21%	0.206	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153	177.3	-64	0	0	0	0	111.5	L322 I323 M355 S358	L322-V360 HydrophobicContact CB-CB 4.29Å; L322-V360 HydrophobicContact CB-CG1 4.38Å; L322-V360 HydrophobicContact CD1-CG2 4.3Å; I323-V360 CarbonylContact O-C 3.52Å; I323-V360 WeakPolarHBondContact O-CA 3.48Å; M355-V360 WeakPolarHBondContact CG-O 3.46Å; S358-V360 PolarHBondContact O-N 2.89Å; S358-V360 WeakPolarHBondContact OG-CG2 3.25Å
361	K	97.4	Very high	96	Very high	36 Å²	36	44.9 Å²	44.9	16%	0.157	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	162.7	167.4	61.5	-177.8	178.1	-173.4	0	109.7	A272 D273 I323 L325 D329	A272-K361 VanDerWaalsContact O-CA 3.25Å; A272-K361 WeakPolarHBondContact O-CA 2.99Å; A272-K361 WeakPolarHBondContact O-CB 3.48Å; D273-K361 HydrophobicContact CB-CB 3.82Å; D273-K361 HydrophobicContact CB-CD 3.87Å; D273-K361 HydrophobicContact CB-CG 4.39Å; I323-K361 HydrophobicContact CB-CG 3.89Å; I323-K361 HydrophobicContact CG2-CG 4.23Å; I323-K361 PolarHBondContact N-O 3.15Å; I323-K361 WeakPolarHBondContact O-CG 3.25Å; I323-K361 PolarHBondContact O-N 3.47Å; L325-K361 HydrophobicContact CD2-CB 3.71Å; L325-K361 HydrophobicContact CD2-CD 4.09Å; L325-K361 HydrophobicContact CD2-CG 4Å; D329-K361 VanDerWaalsContact CG-NZ 3.3Å; D329-K361 IonicContact OD1-NZ 3.39Å; D329-K361 PolarHBondContact OD1-NZ 2.75Å; D329-K361 VanDerWaalsContact OD1-NZ 3.12Å; D329-K361 WeakPolarHBondContact OD2-CE 3.21Å; D329-K361 IonicContact OD2-NZ 2.7Å; D329-K361 PolarHBondContact OD2-NZ 2.98Å
362	A	97.8	Very high	95.7	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.008	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-145.6	140	178.5	0	0	0	0	0	111.7	A272 L307 L312 L322	A272-A362 HydrophobicContact CB-CB 4.35Å; A272-A362 PolarHBondContact N-O 2.91Å; A272-A362 PolarHBondContact O-N 3.27Å; A272-A362 VanDerWaalsContact O-N 3.15Å; L307-A362 HydrophobicContact CD2-CB 4.07Å; L312-A362 HydrophobicContact CD1-CB 4.02Å; L312-A362 HydrophobicContact CD2-CB 3.59Å; L312-A362 HydrophobicContact CG-CB 4.48Å; L322-A362 HydrophobicContact CD2-CB 3.86Å
363	E	96.7	Very high	95.4	Very high	80 Å²	80	51.7 Å²	51.7	37%	0.374	28%	0.282	S	S	.	.			trans	-78.3	154.5	168.8	-51.1	-166.2	129.4	0	0	110.2	K219 I323 Q365 S366	K219-E363 IonicContact NZ-OE1 3.22Å; K219-E363 PolarHBondContact NZ-OE1 2.89Å; I323-E363 HydrophobicContact CD1-CG 4.19Å; E363-Q365 VanDerWaalsContact CB-OE1 3.3Å; E363-Q365 PolarHBondContact O-N 3.41Å; E363-S366 WeakPolarHBondContact O-CB 3.41Å; E363-S366 PolarHBondContact O-N 3.4Å; E363-S366 PolarHBondContact O-OG 3.27Å
364	L	95.2	Very high	95.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-56.3	-32.1	173.4	-79.5	161.2	0	0	0	112.2	T222 L269 D271 L307 S366 L367 L375	T222-L364 HydrophobicContact CG2-CB 4.37Å; T222-L364 HydrophobicContact CG2-CD1 4.08Å; L269-L364 HydrophobicContact CD1-CD1 4.43Å; L269-L364 HydrophobicContact CD1-CD2 3.7Å; L269-L364 HydrophobicContact CD2-CD1 4.38Å; L269-L364 HydrophobicContact CG-CD1 3.84Å; L269-L364 HydrophobicContact CG-CD2 4.01Å; D271-L364 WeakPolarHBondContact OD1-CB 3.24Å; D271-L364 WeakPolarHBondContact OD1-CD1 3.39Å; D271-L364 VanDerWaalsContact OD1-CG 3.25Å; D271-L364 WeakPolarHBondContact OD1-CG 3.39Å; D271-L364 PolarHBondContact OD1-N 3.14Å; L307-L364 HydrophobicContact CB-CD2 3.85Å; L307-L364 HydrophobicContact CB-CG 4.48Å; L364-S366 PolarHBondContact O-N 2.85Å; L364-L367 PolarHBondContact O-N 3.39Å; L364-L375 HydrophobicContact CD2-CD1 4.31Å
365	Q	93.9	Very high	95.3	Very high	69 Å²	69	47.3 Å²	47.3	32%	0.322	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-62.8	-21.8	175.7	-64.7	86.9	4.9	0	0	113	T222 E363 L367 S368	T222-Q365 PolarHBondContact OG1-NE2 3.04Å; T222-Q365 VanDerWaalsContact OG1-NE2 3.07Å; E363-Q365 VanDerWaalsContact CB-OE1 3.3Å; E363-Q365 PolarHBondContact O-N 3.41Å; Q365-L367 PolarHBondContact O-N 3.06Å; Q365-L367 VanDerWaalsContact O-N 3.11Å; Q365-S368 VanDerWaalsContact O-CB 3.3Å; Q365-S368 WeakPolarHBondContact O-CB 3.39Å; Q365-S368 PolarHBondContact O-N 3.31Å; Q365-S368 PolarHBondContact O-OG 3.28Å
366	S	95.3	Very high	95.1	Very high	10 Å²	10	47.3 Å²	47.3	7%	0.07	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-57.5	-27.3	177.5	66.6	0	0	0	0	112.6	E363 L364 S368 S369	E363-S366 WeakPolarHBondContact O-CB 3.41Å; E363-S366 PolarHBondContact O-N 3.4Å; E363-S366 PolarHBondContact O-OG 3.27Å; L364-S366 PolarHBondContact O-N 2.85Å; S366-S368 PolarHBondContact O-N 3.04Å; S366-S369 VanDerWaalsContact O-CB 3.31Å; S366-S369 WeakPolarHBondContact O-CB 3.46Å; S366-S369 PolarHBondContact O-N 3.36Å; S366-S369 VanDerWaalsContact O-N 3.12Å; S366-S369 PolarHBondContact O-OG 3.08Å
367	L	95.6	Very high	95	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-64.2	-23.1	176.5	-62.6	-174.8	0	0	0	113.3	L307 L315 V317 L364 Q365 S369 I370 F374 L375 Y379	L307-L367 HydrophobicContact CD1-CD1 4.28Å; L307-L367 HydrophobicContact CD1-CD2 4.1Å; L307-L367 HydrophobicContact CD1-CG 4.46Å; L315-L367 HydrophobicContact CD1-CD2 3.89Å; V317-L367 HydrophobicContact CG2-CD2 4.01Å; L364-L367 PolarHBondContact O-N 3.39Å; Q365-L367 PolarHBondContact O-N 3.06Å; Q365-L367 VanDerWaalsContact O-N 3.11Å; L367-S369 PolarHBondContact O-N 2.62Å; L367-I370 HydrophobicContact CD2-CD1 4.28Å; L367-I370 WeakPolarHBondContact O-CB 3.47Å; L367-I370 PolarHBondContact O-N 3.47Å; L367-I370 VanDerWaalsContact O-N 3.11Å; L367-F374 HydrophobicContact CB-CD1 4.11Å; L367-F374 HydrophobicContact CD1-CD1 4.41Å; L367-F374 HydrophobicContact CD2-CD1 4.49Å; L367-F374 WeakPolarHBondContact O-CB 3.23Å; L367-L375 HydrophobicContact CD1-CB 4.49Å; L367-L375 HydrophobicContact CD1-CD1 3.98Å; L367-Y379 HydrophobicContact CD1-CD1 4.02Å; L367-Y379 HydrophobicContact CD1-CD2 4.14Å; L367-Y379 HydrophobicContact CD1-CE1 4.47Å; L367-Y379 HydrophobicContact CD1-CG 3.82Å
368	S	93.4	Very high	94.9	Very high	67 Å²	67	46 Å²	46	47%	0.469	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-64.7	-20.8	175.7	67.8	0	0	0	0	113.2	Q365 S366 I370 A371	Q365-S368 VanDerWaalsContact O-CB 3.3Å; Q365-S368 WeakPolarHBondContact O-CB 3.39Å; Q365-S368 PolarHBondContact O-N 3.31Å; Q365-S368 PolarHBondContact O-OG 3.28Å; S366-S368 PolarHBondContact O-N 3.04Å; S368-I370 VanDerWaalsContact C-N 3.25Å; S368-I370 PolarHBondContact O-N 2.78Å; S368-A371 WeakPolarHBondContact CA-O 3.19Å; S368-A371 CarbonylContact O-C 3.23Å; S368-A371 VanDerWaalsContact O-C 3.23Å; S368-A371 PolarHBondContact O-N 2.81Å
369	S	92.9	Very high	94.9	Very high	50 Å²	50	43.5 Å²	43.5	35%	0.35	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-68.6	-23.2	174.3	68.8	0	0	0	0	113.1	P318 S321 S366 L367	P318-S369 VanDerWaalsContact CD-OG 3.25Å; P318-S369 WeakPolarHBondContact CD-OG 3.32Å; S321-S369 VanDerWaalsContact OG-CB 3.27Å; S321-S369 WeakPolarHBondContact OG-CB 3.45Å; S321-S369 PolarHBondContact OG-OG 2.87Å; S366-S369 VanDerWaalsContact O-CB 3.31Å; S366-S369 WeakPolarHBondContact O-CB 3.46Å; S366-S369 PolarHBondContact O-N 3.36Å; S366-S369 VanDerWaalsContact O-N 3.12Å; S366-S369 PolarHBondContact O-OG 3.08Å; L367-S369 PolarHBondContact O-N 2.62Å
370	I	93.9	Very high	94.9	Very high	61 Å²	61	38.7 Å²	38.7	31%	0.313	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-51.3	173.2	-59.4	167.7	0	0	0	109.3	L315 V317 L367 S368 F374	L315-I370 HydrophobicContact CB-CD1 4.06Å; V317-I370 HydrophobicContact CG2-CD1 4.14Å; L367-I370 HydrophobicContact CD2-CD1 4.28Å; L367-I370 WeakPolarHBondContact O-CB 3.47Å; L367-I370 PolarHBondContact O-N 3.47Å; L367-I370 VanDerWaalsContact O-N 3.11Å; S368-I370 VanDerWaalsContact C-N 3.25Å; S368-I370 PolarHBondContact O-N 2.78Å; I370-F374 HydrophobicContact CB-CD2 3.96Å; I370-F374 HydrophobicContact CB-CE2 4.34Å; I370-F374 HydrophobicContact CB-CG 4.16Å; I370-F374 HydrophobicContact CD1-CD1 4.3Å; I370-F374 HydrophobicContact CD1-CE1 4.1Å; I370-F374 HydrophobicContact CD1-CE2 4.48Å; I370-F374 HydrophobicContact CD1-CZ 4.2Å; I370-F374 HydrophobicContact CG2-CD2 3.51Å; I370-F374 HydrophobicContact CG2-CE2 3.58Å; I370-F374 HydrophobicContact CG2-CG 4.21Å; I370-F374 HydrophobicContact CG2-CZ 4.32Å
371	A	93.4	Very high	94.8	Very high	37 Å²	37	38.2 Å²	38.2	31%	0.306	22%	0.217	S	C	.	.			trans	-158.8	148.1	170.8	0	0	0	0	0	109.9	S368 D373 F374	S368-A371 WeakPolarHBondContact CA-O 3.19Å; S368-A371 CarbonylContact O-C 3.23Å; S368-A371 VanDerWaalsContact O-C 3.23Å; S368-A371 PolarHBondContact O-N 2.81Å; A371-D373 VanDerWaalsContact C-N 3.28Å; A371-D373 PolarHBondContact O-N 2.68Å; A371-D373 VanDerWaalsContact O-N 3.11Å; A371-F374 HydrophobicContact CB-CB 4.15Å; A371-F374 HydrophobicContact CB-CD2 4.38Å; A371-F374 WeakPolarHBondContact O-CB 3.44Å; A371-F374 PolarHBondContact O-N 3.2Å
372	P	90.8	Very high	94.7	Very high	100 Å²	100	39.7 Å²	39.7	65%	0.649	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-39.6	-173.7	-30	35.7	0	0	0	115.5
373	D	91.5	Very high	94.6	Very high	64 Å²	64	40.1 Å²	40.1	34%	0.342	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	24.4	-178.7	-51.7	-39.5	0	0	0	112.2	R225 A371 L375 T376 N377	R225-D373 IonicContact NH2-OD1 2.74Å; R225-D373 PolarHBondContact NH2-OD1 2.85Å; A371-D373 VanDerWaalsContact C-N 3.28Å; A371-D373 PolarHBondContact O-N 2.68Å; A371-D373 VanDerWaalsContact O-N 3.11Å; D373-L375 VanDerWaalsContact C-N 3.28Å; D373-L375 PolarHBondContact O-N 3.46Å; D373-T376 PolarHBondContact O-N 3.25Å; D373-T376 PolarHBondContact O-OG1 3.11Å; D373-N377 WeakPolarHBondContact CB-ND2 3.45Å; D373-N377 WeakPolarHBondContact O-CB 3.5Å; D373-N377 PolarHBondContact O-N 3.44Å
374	F	95.6	Very high	94.6	Very high	20 Å²	20	36.3 Å²	36.3	9%	0.088	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-40.1	-176.1	-170.1	-89.3	0	0	0	112.2	L315 L367 I370 A371 T376 I378 Y379	L315-F374 HydrophobicContact CD1-CE1 4.1Å; L315-F374 HydrophobicContact CD2-CE1 4.16Å; L315-F374 HydrophobicContact CD2-CZ 3.99Å; L367-F374 HydrophobicContact CB-CD1 4.11Å; L367-F374 HydrophobicContact CD1-CD1 4.41Å; L367-F374 HydrophobicContact CD2-CD1 4.49Å; L367-F374 WeakPolarHBondContact O-CB 3.23Å; I370-F374 HydrophobicContact CB-CD2 3.96Å; I370-F374 HydrophobicContact CB-CE2 4.34Å; I370-F374 HydrophobicContact CB-CG 4.16Å; I370-F374 HydrophobicContact CD1-CD1 4.3Å; I370-F374 HydrophobicContact CD1-CE1 4.1Å; I370-F374 HydrophobicContact CD1-CE2 4.48Å; I370-F374 HydrophobicContact CD1-CZ 4.2Å; I370-F374 HydrophobicContact CG2-CD2 3.51Å; I370-F374 HydrophobicContact CG2-CE2 3.58Å; I370-F374 HydrophobicContact CG2-CG 4.21Å; I370-F374 HydrophobicContact CG2-CZ 4.32Å; A371-F374 HydrophobicContact CB-CB 4.15Å; A371-F374 HydrophobicContact CB-CD2 4.38Å; A371-F374 WeakPolarHBondContact O-CB 3.44Å; A371-F374 PolarHBondContact O-N 3.2Å; F374-T376 PolarHBondContact O-N 3.08Å; F374-I378 HydrophobicContact CD2-CB 4.13Å; F374-I378 HydrophobicContact CD2-CD1 3.72Å; F374-I378 HydrophobicContact CD2-CG1 4.42Å; F374-I378 HydrophobicContact CD2-CG2 4.36Å; F374-I378 HydrophobicContact CE1-CG2 4.4Å; F374-I378 HydrophobicContact CE2-CB 4.05Å; F374-I378 HydrophobicContact CE2-CD1 3.85Å; F374-I378 HydrophobicContact CE2-CG2 3.77Å; F374-I378 HydrophobicContact CG-CB 4.42Å; F374-I378 HydrophobicContact CZ-CB 4.29Å; F374-I378 HydrophobicContact CZ-CG2 3.79Å; F374-I378 WeakPolarHBondContact O-CB 3.36Å; F374-I378 PolarHBondContact O-N 3.12Å; F374-I378 VanDerWaalsContact O-N 3.09Å; F374-Y379 PolarHBondContact O-N 3.22Å
375	L	95.5	Very high	94.6	Very high	22 Å²	22	39.7 Å²	39.7	12%	0.115	22%	0.223	C	C	.	.	I	π-helix	trans	-57.8	-50.5	179.7	176.3	60.3	0	0	0	111.3	T222 L226 L364 L367 D373 Y379 L380	T222-L375 HydrophobicContact CG2-CD2 4.19Å; L226-L375 HydrophobicContact CD2-CD2 3.74Å; L226-L375 HydrophobicContact CD2-CG 4.06Å; L364-L375 HydrophobicContact CD2-CD1 4.31Å; L367-L375 HydrophobicContact CD1-CB 4.49Å; L367-L375 HydrophobicContact CD1-CD1 3.98Å; D373-L375 VanDerWaalsContact C-N 3.28Å; D373-L375 PolarHBondContact O-N 3.46Å; L375-Y379 HydrophobicContact CD1-CD1 3.76Å; L375-Y379 HydrophobicContact CD1-CE1 4.47Å; L375-L380 HydrophobicContact CD1-CD1 4.12Å; L375-L380 HydrophobicContact CD1-CD2 4.25Å; L375-L380 HydrophobicContact CD1-CG 3.92Å; L375-L380 HydrophobicContact CG-CD1 4.2Å; L375-L380 HydrophobicContact CG-CG 4.44Å; L375-L380 VanDerWaalsContact O-CG 3.31Å; L375-L380 WeakPolarHBondContact O-CG 3.38Å; L375-L380 PolarHBondContact O-N 3.11Å
376	T	94.2	Very high	94.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	24%	0.236	C	C	.	.	I	π-helix	trans	-84.1	-39.6	-171.2	49	0	0	0	0	113.1	L226 D229 L231 D373 F374 P381	L226-T376 HydrophobicContact CD2-CG2 3.37Å; D229-T376 HydrophobicContact CB-CG2 3.73Å; D229-T376 WeakPolarHBondContact OD2-CG2 3.43Å; D229-T376 PolarHBondContact OD2-OG1 3.46Å; L231-T376 HydrophobicContact CD1-CG2 4.11Å; D373-T376 PolarHBondContact O-N 3.25Å; D373-T376 PolarHBondContact O-OG1 3.11Å; F374-T376 PolarHBondContact O-N 3.08Å; T376-P381 VanDerWaalsContact O-CD 3.26Å; T376-P381 WeakPolarHBondContact O-CD 3.43Å; T376-P381 VanDerWaalsContact O-CG 3.28Å; T376-P381 WeakPolarHBondContact O-CG 3.2Å
377	N	93.7	Very high	94.6	Very high	81 Å²	81	44.3 Å²	44.3	43%	0.433	25%	0.245	S	C	.	.	I	π-helix	trans	-91.8	-20.3	-174	-64.6	-24.2	0	0	0	113.7	K234 D373	K234-N377 PolarHBondContact NZ-OD1 3.25Å; D373-N377 WeakPolarHBondContact CB-ND2 3.45Å; D373-N377 WeakPolarHBondContact O-CB 3.5Å; D373-N377 PolarHBondContact O-N 3.44Å
378	I	94.9	Very high	94.6	Very high	73 Å²	73	45.6 Å²	45.6	37%	0.374	26%	0.259	S	S	.	.	I	π-helix	trans	-126.3	-55.8	-173.9	-58.2	178	0	0	0	111.9	F374 N382	F374-I378 HydrophobicContact CD2-CB 4.13Å; F374-I378 HydrophobicContact CD2-CD1 3.72Å; F374-I378 HydrophobicContact CD2-CG1 4.42Å; F374-I378 HydrophobicContact CD2-CG2 4.36Å; F374-I378 HydrophobicContact CE1-CG2 4.4Å; F374-I378 HydrophobicContact CE2-CB 4.05Å; F374-I378 HydrophobicContact CE2-CD1 3.85Å; F374-I378 HydrophobicContact CE2-CG2 3.77Å; F374-I378 HydrophobicContact CG-CB 4.42Å; F374-I378 HydrophobicContact CZ-CB 4.29Å; F374-I378 HydrophobicContact CZ-CG2 3.79Å; F374-I378 WeakPolarHBondContact O-CB 3.36Å; F374-I378 PolarHBondContact O-N 3.12Å; F374-I378 VanDerWaalsContact O-N 3.09Å; I378-N382 VanDerWaalsContact O-CB 3.29Å; I378-N382 WeakPolarHBondContact O-CB 3.34Å; I378-N382 VanDerWaalsContact O-CG 3.31Å; I378-N382 PolarHBondContact O-N 3.11Å; I378-N382 PolarHBondContact O-ND2 2.92Å
379	Y	97.1	Very high	94.8	Very high	3 Å²	3	44.1 Å²	44.1	1%	0.012	24%	0.243	C	C	.	.	I	π-helix	trans	-65.6	-60	-171.1	-179.6	-102.6	0	0	0	112.2	L269 G306 L307 D311 L315 L367 F374 L375 N382 K383	L269-Y379 HydrophobicContact CD1-CE1 4.31Å; G306-Y379 VanDerWaalsContact CA-OH 3.25Å; G306-Y379 WeakPolarHBondContact CA-OH 2.97Å; L307-Y379 HydrophobicContact CD1-CE2 4.17Å; D311-Y379 HydrophobicContact CB-CE2 4.16Å; D311-Y379 WeakPolarHBondContact OD2-CE2 3.48Å; D311-Y379 PolarHBondContact OD2-OH 2.96Å; L315-Y379 HydrophobicContact CD1-CD2 3.71Å; L315-Y379 HydrophobicContact CD1-CE2 3.87Å; L367-Y379 HydrophobicContact CD1-CD1 4.02Å; L367-Y379 HydrophobicContact CD1-CD2 4.14Å; L367-Y379 HydrophobicContact CD1-CE1 4.47Å; L367-Y379 HydrophobicContact CD1-CG 3.82Å; F374-Y379 PolarHBondContact O-N 3.22Å; L375-Y379 HydrophobicContact CD1-CD1 3.76Å; L375-Y379 HydrophobicContact CD1-CE1 4.47Å; Y379-N382 PolarHBondContact O-N 2.59Å; Y379-K383 HydrophobicContact CD1-CG 4.35Å; Y379-K383 HydrophobicContact CD2-CG 4.11Å; Y379-K383 HydrophobicContact CE1-CG 4.12Å; Y379-K383 HydrophobicContact CE2-CD 3.93Å; Y379-K383 HydrophobicContact CE2-CG 3.86Å; Y379-K383 HydrophobicContact CG-CG 4.36Å; Y379-K383 WeakPolarHBondContact O-CB 3.31Å; Y379-K383 WeakPolarHBondContact O-CG 3.3Å; Y379-K383 PolarHBondContact O-N 3.3Å; Y379-K383 WeakPolarHBondContact OH-CE 3.28Å
380	L	96.9	Very high	94.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-47.6	-176.6	-63.9	172.2	0	0	0	112.9	M215 L226 L231 L235 L269 L305 L375 N382 K383 L384	M215-L380 HydrophobicContact CE-CD2 4.2Å; M215-L380 HydrophobicContact SD-CD1 4.47Å; M215-L380 HydrophobicContact SD-CD2 4.26Å; L226-L380 HydrophobicContact CD2-CD1 4Å; L231-L380 HydrophobicContact CD1-CD1 3.94Å; L231-L380 HydrophobicContact CD2-CD1 3.76Å; L235-L380 HydrophobicContact CD1-CB 4.24Å; L269-L380 HydrophobicContact CD1-CD2 3.81Å; L269-L380 HydrophobicContact CD2-CD1 4.33Å; L269-L380 HydrophobicContact CD2-CD2 3.93Å; L269-L380 HydrophobicContact CG-CD2 4.49Å; L305-L380 HydrophobicContact CD2-CD2 3.87Å; L375-L380 HydrophobicContact CD1-CD1 4.12Å; L375-L380 HydrophobicContact CD1-CD2 4.25Å; L375-L380 HydrophobicContact CD1-CG 3.92Å; L375-L380 HydrophobicContact CG-CD1 4.2Å; L375-L380 HydrophobicContact CG-CG 4.44Å; L375-L380 VanDerWaalsContact O-CG 3.31Å; L375-L380 WeakPolarHBondContact O-CG 3.38Å; L375-L380 PolarHBondContact O-N 3.11Å; L380-N382 VanDerWaalsContact C-N 3.32Å; L380-N382 PolarHBondContact O-N 2.63Å; L380-K383 PolarHBondContact O-N 3.43Å; L380-L384 WeakPolarHBondContact O-CB 3.2Å; L380-L384 WeakPolarHBondContact O-CG 3.06Å; L380-L384 PolarHBondContact O-N 3.35Å
381	P	95.3	Very high	94.9	Very high	24 Å²	24	43.1 Å²	43.1	16%	0.156	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-41.3	178.1	-23.3	32.8	0	0	0	112.9	L235 T376 R385	L235-P381 HydrophobicContact CD2-CB 4.36Å; L235-P381 HydrophobicContact CD2-CG 4.16Å; T376-P381 VanDerWaalsContact O-CD 3.26Å; T376-P381 WeakPolarHBondContact O-CD 3.43Å; T376-P381 VanDerWaalsContact O-CG 3.28Å; T376-P381 WeakPolarHBondContact O-CG 3.2Å; P381-R385 WeakPolarHBondContact O-CB 3.48Å; P381-R385 PolarHBondContact O-N 3.18Å
382	N	95.1	Very high	95	Very high	68 Å²	68	43.4 Å²	43.4	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-70.5	-42.4	179.3	-76.1	-44.4	0	0	0	112.2	I378 Y379 L380 L384 R385 Y386	I378-N382 VanDerWaalsContact O-CB 3.29Å; I378-N382 WeakPolarHBondContact O-CB 3.34Å; I378-N382 VanDerWaalsContact O-CG 3.31Å; I378-N382 PolarHBondContact O-N 3.11Å; I378-N382 PolarHBondContact O-ND2 2.92Å; Y379-N382 PolarHBondContact O-N 2.59Å; L380-N382 VanDerWaalsContact C-N 3.32Å; L380-N382 PolarHBondContact O-N 2.63Å; N382-L384 VanDerWaalsContact C-N 3.3Å; N382-L384 PolarHBondContact O-N 2.74Å; N382-R385 PolarHBondContact O-N 3.22Å; N382-Y386 HydrophobicContact CB-CD2 4.28Å; N382-Y386 HydrophobicContact CB-CE2 4.47Å; N382-Y386 VanDerWaalsContact O-CD2 3.22Å; N382-Y386 WeakPolarHBondContact O-CD2 3.33Å; N382-Y386 PolarHBondContact O-N 3.12Å
383	K	96.6	Very high	95.2	Very high	10 Å²	10	40.2 Å²	40.2	4%	0.043	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-42.2	177.9	-68.7	-81.9	-73.1	-166.7	0	110.9	L305 D311 Y379 L380 G387 G388	L305-K383 HydrophobicContact CD1-CB 3.84Å; L305-K383 WeakPolarHBondContact O-CE 3.18Å; L305-K383 PolarHBondContact O-NZ 3.09Å; D311-K383 IonicContact OD1-NZ 2.87Å; D311-K383 IonicContact OD2-NZ 3.47Å; D311-K383 PolarHBondContact OD2-NZ 3.48Å; Y379-K383 HydrophobicContact CD1-CG 4.35Å; Y379-K383 HydrophobicContact CD2-CG 4.11Å; Y379-K383 HydrophobicContact CE1-CG 4.12Å; Y379-K383 HydrophobicContact CE2-CD 3.93Å; Y379-K383 HydrophobicContact CE2-CG 3.86Å; Y379-K383 HydrophobicContact CG-CG 4.36Å; Y379-K383 WeakPolarHBondContact O-CB 3.31Å; Y379-K383 WeakPolarHBondContact O-CG 3.3Å; Y379-K383 PolarHBondContact O-N 3.3Å; Y379-K383 WeakPolarHBondContact OH-CE 3.28Å; L380-K383 PolarHBondContact O-N 3.43Å; K383-G387 PolarHBondContact O-N 3.18Å; K383-G388 WeakPolarHBondContact CE-O 3.44Å; K383-G388 PolarHBondContact NZ-O 2.95Å; K383-G388 PolarHBondContact O-N 2.83Å
384	L	96.2	Very high	95.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.5	-43.7	178.1	-68.3	171.8	0	0	0	112.6	L8 I12 F213 M215 L235 F267 L305 L380 N382 Y386 W389	L8-L384 HydrophobicContact CD1-CB 4.2Å; I12-L384 HydrophobicContact CD1-CB 4.18Å; I12-L384 HydrophobicContact CD1-CD2 4.07Å; F213-L384 HydrophobicContact CE1-CD1 4.15Å; F213-L384 HydrophobicContact CE2-CD1 4.33Å; F213-L384 HydrophobicContact CZ-CD1 3.74Å; M215-L384 HydrophobicContact CE-CD1 4.23Å; L235-L384 HydrophobicContact CD1-CD1 3.71Å; L235-L384 HydrophobicContact CD2-CD1 4.45Å; F267-L384 HydrophobicContact CD2-CD2 3.93Å; F267-L384 HydrophobicContact CE2-CD2 3.88Å; F267-L384 HydrophobicContact CZ-CD2 4.46Å; L305-L384 HydrophobicContact CD1-CD2 3.98Å; L305-L384 HydrophobicContact CD1-CG 4.47Å; L305-L384 HydrophobicContact CD2-CD2 4.2Å; L380-L384 WeakPolarHBondContact O-CB 3.2Å; L380-L384 WeakPolarHBondContact O-CG 3.06Å; L380-L384 PolarHBondContact O-N 3.35Å; N382-L384 VanDerWaalsContact C-N 3.3Å; N382-L384 PolarHBondContact O-N 2.74Å; L384-Y386 VanDerWaalsContact C-N 3.35Å; L384-Y386 PolarHBondContact O-N 3.48Å; L384-W389 WeakPolarHBondContact O-CZ3 3.43Å
385	R	94.4	Very high	95.4	Very high	72 Å²	72	40 Å²	40	27%	0.272	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-37.2	-179.2	-177.8	175.3	-179.2	-173.9	-0.5	113.4	L8 P381 N382	L8-R385 HydrophobicContact CD1-CB 4.05Å; P381-R385 WeakPolarHBondContact O-CB 3.48Å; P381-R385 PolarHBondContact O-N 3.18Å; N382-R385 PolarHBondContact O-N 3.22Å
386	Y	95.2	Very high	95.4	Very high	150 Å²	150	41.2 Å²	41.2	59%	0.588	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	12.4	-172	-61.5	-64	0	0	0	114.1	N382 L384 G388	N382-Y386 HydrophobicContact CB-CD2 4.28Å; N382-Y386 HydrophobicContact CB-CE2 4.47Å; N382-Y386 VanDerWaalsContact O-CD2 3.22Å; N382-Y386 WeakPolarHBondContact O-CD2 3.33Å; N382-Y386 PolarHBondContact O-N 3.12Å; L384-Y386 VanDerWaalsContact C-N 3.35Å; L384-Y386 PolarHBondContact O-N 3.48Å; Y386-G388 VanDerWaalsContact C-N 3.34Å; Y386-G388 PolarHBondContact O-N 3.22Å
387	G	95.3	Very high	95.5	Very high	26 Å²	26	44 Å²	44	27%	0.268	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	31.5	177.8	0	0	0	0	0	113.6	K383 W389	K383-G387 PolarHBondContact O-N 3.18Å; G387-W389 VanDerWaalsContact CA-CZ3 3.47Å; G387-W389 PolarHBondContact O-N 2.89Å
388	G	95.4	Very high	95.7	Very high	27 Å²	27	41.2 Å²	41.2	28%	0.278	21%	0.213	S	C	.	.			trans	-78	24.6	-171.2	0	0	0	0	0	115.5	K383 Y386	K383-G388 WeakPolarHBondContact CE-O 3.44Å; K383-G388 PolarHBondContact NZ-O 2.95Å; K383-G388 PolarHBondContact O-N 2.83Å; Y386-G388 VanDerWaalsContact C-N 3.34Å; Y386-G388 PolarHBondContact O-N 3.22Å
389	W	96.4	Very high	95.7	Very high	37 Å²	37	38.5 Å²	38.5	14%	0.14	20%	0.199	C	C	.	.			trans	-104.3	163.9	179.2	55.6	79	0	0	0	111.1	E11 I12 L15 F267 M303 W304 L305 L384 G387	E11-W389 HydrophobicContact CB-CH2 3.69Å; E11-W389 HydrophobicContact CB-CZ2 4.3Å; I12-W389 HydrophobicContact CG1-CH2 3.98Å; I12-W389 HydrophobicContact CG1-CZ3 4.23Å; L15-W389 HydrophobicContact CB-CZ2 4.38Å; L15-W389 HydrophobicContact CD2-CZ2 3.87Å; F267-W389 HydrophobicContact CD1-CB 4.22Å; F267-W389 HydrophobicContact CD1-CD2 4.29Å; F267-W389 HydrophobicContact CD1-CE3 4.47Å; F267-W389 HydrophobicContact CD1-CG 4.17Å; F267-W389 HydrophobicContact CE1-CB 4.11Å; F267-W389 AromaticContact CE1-CD2 3.36Å; F267-W389 HydrophobicContact CE1-CD2 3.36Å; F267-W389 AromaticContact CE1-CE2 3.76Å; F267-W389 AromaticContact CE1-CE3 3.62Å; F267-W389 HydrophobicContact CE1-CE3 3.62Å; F267-W389 AromaticContact CE1-CG 3.57Å; F267-W389 HydrophobicContact CE1-CG 3.57Å; F267-W389 HydrophobicContact CE1-CZ2 4.33Å; F267-W389 HydrophobicContact CE1-CZ3 4.17Å; F267-W389 AromaticContact CZ-CD2 3.89Å; F267-W389 HydrophobicContact CZ-CD2 3.89Å; F267-W389 AromaticContact CZ-CE3 3.81Å; F267-W389 HydrophobicContact CZ-CE3 3.81Å; F267-W389 HydrophobicContact CZ-CH2 4.04Å; F267-W389 HydrophobicContact CZ-CZ2 4.15Å; F267-W389 AromaticContact CZ-CZ3 3.87Å; F267-W389 HydrophobicContact CZ-CZ3 3.87Å; M303-W389 HydrophobicContact CB-CB 4.36Å; M303-W389 HydrophobicContact CB-CG 4.41Å; M303-W389 HydrophobicContact SD-CG 4.29Å; M303-W389 PolarHBondContact SD-NE1 3.44Å; W304-W389 CarbonylContact O-C 3.59Å; W304-W389 VanDerWaalsContact O-CA 3.24Å; W304-W389 WeakPolarHBondContact O-CA 3.49Å; W304-W389 WeakPolarHBondContact O-CB 3.25Å; L305-W389 HydrophobicContact CD1-CB 4.28Å; L305-W389 HydrophobicContact CD1-CE3 4.39Å; L384-W389 WeakPolarHBondContact O-CZ3 3.43Å; G387-W389 VanDerWaalsContact CA-CZ3 3.47Å; G387-W389 PolarHBondContact O-N 2.89Å
390	V	94.8	Very high	95.6	Very high	45 Å²	45	41.7 Å²	41.7	27%	0.273	22%	0.217	S	C	.	.			trans	-133	0	178.5	-63.4	0	0	0	0	114.2	M303 W304 L308 D347 W348	M303-V390 CarbonylContact C-O 3.58Å; M303-V390 WeakPolarHBondContact CA-O 3.41Å; M303-V390 WeakPolarHBondContact CB-O 3.27Å; W304-V390 HydrophobicContact CB-CG2 3.81Å; W304-V390 HydrophobicContact CE3-CG2 4.24Å; W304-V390 HydrophobicContact CG-CG2 4.46Å; W304-V390 PolarHBondContact N-O 3.38Å; W304-V390 PolarHBondContact O-N 3.43Å; L308-V390 HydrophobicContact CD1-CG2 4.48Å; L308-V390 HydrophobicContact CD2-CG2 4.01Å; D347-V390 HydrophobicContact CB-CB 4.02Å; D347-V390 HydrophobicContact CB-CG1 4.05Å; W348-V390 PolarHBondContact NE1-O 2.98Å; W348-V390 PolarHBondContact NE1-OXT 3.16Å; W348-V390 VanDerWaalsContact NE1-OXT 3.13Å

Retrieved 390 of 390 residues in 98.8 ms (Link to these results)

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