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Guanine nucleotide-binding protein G(q) subunit alpha

Guanine nucleotide-binding proteins (G proteins) function as transducers downstream of G protein-coupled receptors (GPCRs) in numerous signaling cascades. The alpha chain contains the guanine nucleotide binding site and alternates between an active, GTP-bound state and an inactive, GDP-bound state. Signaling by an activated GPCR promotes GDP release and GTP binding. The alpha subunit has a low GTPase activity that converts bound GTP to GDP, thereby terminating the signal. Both GDP release and GTP hydrolysis are modulated by numerous regulatory proteins. Signaling is mediated via phospholipase C-beta-dependent inositol lipid hydrolysis for signal propagation: activates phospholipase C-beta: following GPCR activation, GNAQ activates PLC-beta (PLCB1, PLCB2, PLCB3 or PLCB4), leading to production of diacylglycerol (DAG) and inositol 1,4,5-trisphosphate (IP3). Required for platelet activation. Regulates B-cell selection and survival and is required to prevent B-cell-dependent autoimmunity. Regulates chemotaxis of BM-derived neutrophils and dendritic cells (in vitro) (By similarity). Transduces FFAR4 signaling in response to long-chain fatty acids (LCFAs) (By similarity). Together with GNA11, required for heart development (By similarity).

AlphaFold DB , UniProt , Accession Q28294, Species CANLF (Canis lupus familiaris, Dog), Gene GNAQ, Length 359 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	39.9	Very low	55.3	Low	205 Å²	205	117.6 Å²	117.6	100%	1.01	66%	0.659	S	S	*	*				0	108.4	0	-84	172.8	-142.6	0	0	107.3
2	T	46.5	Very low	57.8	Low	99 Å²	99	113.4 Å²	113.4	61%	0.607	64%	0.643	S	S	*	*			trans	-68.8	150.8	170.9	47.7	0	0	0	0	109	E4 S5	T2-E4 PolarHBondContact O-N 3.25Å; T2-S5 WeakPolarHBondContact O-CB 3.37Å; T2-S5 PolarHBondContact O-N 2.75Å
3	L	51.4	Low	60	Low	153 Å²	153	115.2 Å²	115.2	80%	0.801	64%	0.643	S	S	*	*	H	α-helix	trans	-50.7	-27.4	-179.3	-88.8	137.3	0	0	0	113.5	S5 I6 M7	L3-S5 VanDerWaalsContact C-N 3.28Å; L3-S5 PolarHBondContact O-N 3.39Å; L3-I6 PolarHBondContact O-N 3.42Å; L3-M7 PolarHBondContact O-N 3.45Å
4	E	51.9	Low	62	Low	163 Å²	163	118.6 Å²	118.6	76%	0.762	65%	0.651	S	S	*	*	H	α-helix	trans	-59.9	-34	174.5	-68.8	-179.9	147.5	0	0	113.6	T2 I6	T2-E4 PolarHBondContact O-N 3.25Å; E4-I6 VanDerWaalsContact C-N 3.31Å; E4-I6 PolarHBondContact O-N 3.42Å
5	S	53.1	Low	63.8	Low	69 Å²	69	113 Å²	113	48%	0.483	63%	0.627	S	S	.	*	H	α-helix	trans	-72.2	-25.2	-179.3	-175.2	0	0	0	0	112.8	T2 L3	T2-S5 WeakPolarHBondContact O-CB 3.37Å; T2-S5 PolarHBondContact O-N 2.75Å; L3-S5 VanDerWaalsContact C-N 3.28Å; L3-S5 PolarHBondContact O-N 3.39Å
6	I	52.3	Low	65.4	Low	111 Å²	111	111.4 Å²	111.4	57%	0.569	61%	0.611	S	S	*	*	H	α-helix	trans	-85.1	-33.3	-177.3	-60.7	175.8	0	0	0	110.4	L3 E4 A8	L3-I6 PolarHBondContact O-N 3.42Å; E4-I6 VanDerWaalsContact C-N 3.31Å; E4-I6 PolarHBondContact O-N 3.42Å; I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 3.35Å
7	M	54.6	Low	66.9	Low	161 Å²	161	109.3 Å²	109.3	79%	0.793	60%	0.596	S	S	*	*	H	α-helix	trans	-71.5	-21.8	178.4	-104.4	-179.1	172	0	0	114.1	L3 C9	L3-M7 PolarHBondContact O-N 3.45Å; M7-C9 VanDerWaalsContact C-N 3.3Å; M7-C9 PolarHBondContact O-N 2.91Å
8	A	54.6	Low	68.2	Low	45 Å²	45	106.4 Å²	106.4	37%	0.372	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-70.9	-22.1	179.3	0	0	0	0	0	113.8	I6 C10	I6-A8 VanDerWaalsContact C-N 3.32Å; I6-A8 PolarHBondContact O-N 3.35Å; A8-C10 VanDerWaalsContact C-N 3.32Å; A8-C10 PolarHBondContact O-N 3.01Å
9	C	59.1	Low	69.4	Low	112 Å²	112	108.4 Å²	108.4	76%	0.757	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-75.1	-14.2	-175.4	-100.9	0	0	0	0	114.8	M7	M7-C9 VanDerWaalsContact C-N 3.3Å; M7-C9 PolarHBondContact O-N 2.91Å
10	C	69.9	Low	70.6	Confident	115 Å²	115	111 Å²	111	78%	0.777	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-116.1	14.7	-170.9	-61	0	0	0	0	114.6	A8	A8-C10 VanDerWaalsContact C-N 3.32Å; A8-C10 PolarHBondContact O-N 3.01Å
11	L	74.6	Confident	71.6	Confident	61 Å²	61	109.6 Å²	109.6	32%	0.319	58%	0.58	S	S	.	*			trans	-73.9	136.6	175.3	-67.3	172.3	0	0	0	110.3	A15 K16	L11-A15 HydrophobicContact CB-CB 4.11Å; L11-A15 HydrophobicContact CD2-CB 3.95Å; L11-K16 HydrophobicContact CB-CG 3.72Å; L11-K16 HydrophobicContact CD1-CG 4.43Å; L11-K16 WeakPolarHBondContact O-CE 3.38Å
12	S	85.3	Confident	74.1	Confident	67 Å²	67	103.5 Å²	103.5	47%	0.469	55%	0.552	S	S	.	*			trans	-58.9	154.9	165.9	62.3	0	0	0	0	109.9	E14 A15 K16	S12-E14 PolarHBondContact O-N 3.38Å; S12-A15 PolarHBondContact O-N 2.94Å; S12-A15 WeakPolarHBondContact OG-CB 3.47Å; S12-A15 PolarHBondContact OG-N 2.96Å; S12-K16 PolarHBondContact O-N 3.19Å
13	E	86.9	Confident	76.4	Confident	136 Å²	136	102 Å²	102	64%	0.636	54%	0.54	S	S	*	.	H	α-helix	trans	-55.8	-36.4	176.5	-69.3	-57.9	121.7	0	0	111.6	K16 E17	E13-K16 PolarHBondContact O-N 3.42Å; E13-K16 IonicContact OE1-NZ 3.85Å; E13-K16 PolarHBondContact OE1-NZ 2.96Å; E13-E17 WeakPolarHBondContact O-CB 3.44Å; E13-E17 PolarHBondContact O-N 3.22Å
14	E	87.9	Confident	78.4	Confident	164 Å²	164	99 Å²	99	77%	0.766	52%	0.522	S	S	*	.	H	α-helix	trans	-61	-43	172.2	-66.4	176.6	174.9	0	0	112.8	S12 E17 A18	S12-E14 PolarHBondContact O-N 3.38Å; E14-E17 PolarHBondContact O-N 3.35Å; E14-A18 WeakPolarHBondContact O-CB 3.4Å; E14-A18 PolarHBondContact O-N 3.39Å
15	A	89.2	Confident	80.2	Confident	34 Å²	34	95.4 Å²	95.4	28%	0.281	51%	0.507	S	S	.	.	H	α-helix	trans	-72	-32.9	179.4	0	0	0	0	0	112.5	L11 S12 R19	L11-A15 HydrophobicContact CB-CB 4.11Å; L11-A15 HydrophobicContact CD2-CB 3.95Å; S12-A15 PolarHBondContact O-N 2.94Å; S12-A15 WeakPolarHBondContact OG-CB 3.47Å; S12-A15 PolarHBondContact OG-N 2.96Å; A15-R19 WeakPolarHBondContact O-CB 3.35Å; A15-R19 PolarHBondContact O-N 2.91Å
16	K	89.3	Confident	82.1	Confident	87 Å²	87	95.9 Å²	95.9	38%	0.378	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-44.6	171.1	-68	179.2	-170	162.4	0	111	L11 S12 E13 R19 R20	L11-K16 HydrophobicContact CB-CG 3.72Å; L11-K16 HydrophobicContact CD1-CG 4.43Å; L11-K16 WeakPolarHBondContact O-CE 3.38Å; S12-K16 PolarHBondContact O-N 3.19Å; E13-K16 PolarHBondContact O-N 3.42Å; E13-K16 IonicContact OE1-NZ 3.85Å; E13-K16 PolarHBondContact OE1-NZ 2.96Å; K16-R19 PolarHBondContact O-N 2.82Å; K16-R20 PolarHBondContact O-N 3.06Å
17	E	91	Very high	83.9	Confident	76 Å²	76	97.4 Å²	97.4	36%	0.355	50%	0.5	S	S	.	.	H	α-helix	trans	-67.6	-42.7	178.8	-176.4	57.8	-165.4	0	0	111.9	E13 E14 R19 R20 I21	E13-E17 WeakPolarHBondContact O-CB 3.44Å; E13-E17 PolarHBondContact O-N 3.22Å; E14-E17 PolarHBondContact O-N 3.35Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.97Å; E17-R20 WeakPolarHBondContact O-CB 3.34Å; E17-R20 PolarHBondContact O-N 2.87Å; E17-R20 VanDerWaalsContact O-N 3.17Å; E17-R20 IonicContact OE1-CZ 3.58Å; E17-R20 IonicContact OE1-NE 2.82Å; E17-R20 PolarHBondContact OE1-NE 2.71Å; E17-R20 IonicContact OE1-NH2 3.54Å; E17-R20 PolarHBondContact OE1-NH2 2.89Å; E17-R20 IonicContact OE2-CZ 2.75Å; E17-R20 IonicContact OE2-NE 3.45Å; E17-R20 PolarHBondContact OE2-NE 3.1Å; E17-R20 IonicContact OE2-NH2 3.43Å; E17-I21 HydrophobicContact CG-CD1 4.04Å; E17-I21 WeakPolarHBondContact O-CG1 3.45Å; E17-I21 PolarHBondContact O-N 3.17Å
18	A	89.8	Confident	85.5	Confident	58 Å²	58	93.6 Å²	93.6	48%	0.479	48%	0.48	S	S	.	.	H	α-helix	trans	-58.9	-41.4	174.2	0	0	0	0	0	112.2	E14 I21 N22	E14-A18 WeakPolarHBondContact O-CB 3.4Å; E14-A18 PolarHBondContact O-N 3.39Å; A18-I21 PolarHBondContact O-N 3.3Å; A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 PolarHBondContact O-N 3.49Å
19	R	91.4	Very high	87	Confident	143 Å²	143	96.5 Å²	96.5	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-42.2	175.2	-169.9	176.4	-174.8	170.9	3.9	111.9	A15 K16 E17 I21 N22 D23	A15-R19 WeakPolarHBondContact O-CB 3.35Å; A15-R19 PolarHBondContact O-N 2.91Å; K16-R19 PolarHBondContact O-N 2.82Å; E17-R19 VanDerWaalsContact C-N 3.31Å; E17-R19 PolarHBondContact O-N 2.97Å; R19-I21 PolarHBondContact O-N 3.37Å; R19-N22 PolarHBondContact O-N 3.39Å; R19-D23 WeakPolarHBondContact O-CB 3.39Å; R19-D23 VanDerWaalsContact O-CG 3.29Å; R19-D23 PolarHBondContact O-N 3.45Å
20	R	93.2	Very high	88.2	Confident	160 Å²	160	99.6 Å²	99.6	60%	0.604	49%	0.485	S	S	*	.	H	α-helix	trans	-59.8	-45.1	175.8	-170.7	-175.5	77.7	100.5	2.6	111.6	K16 E17 E24	K16-R20 PolarHBondContact O-N 3.06Å; E17-R20 WeakPolarHBondContact O-CB 3.34Å; E17-R20 PolarHBondContact O-N 2.87Å; E17-R20 VanDerWaalsContact O-N 3.17Å; E17-R20 IonicContact OE1-CZ 3.58Å; E17-R20 IonicContact OE1-NE 2.82Å; E17-R20 PolarHBondContact OE1-NE 2.71Å; E17-R20 IonicContact OE1-NH2 3.54Å; E17-R20 PolarHBondContact OE1-NH2 2.89Å; E17-R20 IonicContact OE2-CZ 2.75Å; E17-R20 IonicContact OE2-NE 3.45Å; E17-R20 PolarHBondContact OE2-NE 3.1Å; E17-R20 IonicContact OE2-NH2 3.43Å; R20-E24 PolarHBondContact O-N 3.43Å; R20-E24 VanDerWaalsContact O-N 3.1Å
21	I	91.3	Very high	88.7	Confident	82 Å²	82	100.4 Å²	100.4	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-63.2	-46.1	176.5	-67.8	167.6	0	0	0	110.3	E17 A18 R19 E24 I25	E17-I21 HydrophobicContact CG-CD1 4.04Å; E17-I21 WeakPolarHBondContact O-CG1 3.45Å; E17-I21 PolarHBondContact O-N 3.17Å; A18-I21 PolarHBondContact O-N 3.3Å; R19-I21 PolarHBondContact O-N 3.37Å; I21-E24 PolarHBondContact O-N 2.93Å; I21-I25 HydrophobicContact CG2-CD1 3.73Å; I21-I25 HydrophobicContact CG2-CG1 4.37Å; I21-I25 VanDerWaalsContact O-CG1 3.29Å; I21-I25 WeakPolarHBondContact O-CG1 3.29Å; I21-I25 PolarHBondContact O-N 3.01Å
22	N	93.2	Very high	89	Confident	78 Å²	78	101 Å²	101	42%	0.417	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-44.3	178.9	-172.4	71.4	0	0	0	112.5	A18 R19 E24 I25 E26	A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 PolarHBondContact O-N 3.49Å; R19-N22 PolarHBondContact O-N 3.39Å; N22-E24 VanDerWaalsContact C-N 3.28Å; N22-E24 PolarHBondContact O-N 3.42Å; N22-I25 PolarHBondContact O-N 3.44Å; N22-E26 PolarHBondContact O-N 2.87Å
23	D	93.6	Very high	88.6	Confident	66 Å²	66	104.2 Å²	104.2	35%	0.353	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-36	177.1	-71.7	-10.4	0	0	0	111.6	R19 R27	R19-D23 WeakPolarHBondContact O-CB 3.39Å; R19-D23 VanDerWaalsContact O-CG 3.29Å; R19-D23 PolarHBondContact O-N 3.45Å; D23-R27 VanDerWaalsContact O-CG 3.24Å; D23-R27 WeakPolarHBondContact O-CG 3.43Å; D23-R27 PolarHBondContact O-N 3.27Å
24	E	93.3	Very high	88.1	Confident	91 Å²	91	104 Å²	104	43%	0.425	47%	0.474	S	S	.	.	H	α-helix	trans	-72	-40.3	176.1	-165.9	60.1	-159.3	0	0	112	R20 I21 N22 E26 R27 Q28	R20-E24 PolarHBondContact O-N 3.43Å; R20-E24 VanDerWaalsContact O-N 3.1Å; I21-E24 PolarHBondContact O-N 2.93Å; N22-E24 VanDerWaalsContact C-N 3.28Å; N22-E24 PolarHBondContact O-N 3.42Å; E24-E26 PolarHBondContact O-N 2.91Å; E24-R27 PolarHBondContact O-N 3.28Å; E24-R27 IonicContact OE2-NH1 3.35Å; E24-R27 PolarHBondContact OE2-NH1 3.08Å; E24-Q28 WeakPolarHBondContact O-CB 3.24Å; E24-Q28 PolarHBondContact O-N 3.5Å
25	I	91.3	Very high	87.3	Confident	88 Å²	88	99.6 Å²	99.6	45%	0.451	46%	0.456	S	S	.	.	H	α-helix	trans	-59.5	-46.2	171.9	-69	167	0	0	0	110.2	I21 N22 R27 Q28 L29	I21-I25 HydrophobicContact CG2-CD1 3.73Å; I21-I25 HydrophobicContact CG2-CG1 4.37Å; I21-I25 VanDerWaalsContact O-CG1 3.29Å; I21-I25 WeakPolarHBondContact O-CG1 3.29Å; I21-I25 PolarHBondContact O-N 3.01Å; N22-I25 PolarHBondContact O-N 3.44Å; I25-R27 VanDerWaalsContact C-N 3.35Å; I25-R27 PolarHBondContact O-N 2.9Å; I25-Q28 PolarHBondContact O-N 3.41Å; I25-L29 HydrophobicContact CG2-CD1 3.87Å; I25-L29 HydrophobicContact CG2-CG 4.28Å; I25-L29 WeakPolarHBondContact O-CB 3.49Å; I25-L29 VanDerWaalsContact O-CG 3.28Å; I25-L29 WeakPolarHBondContact O-CG 3.48Å; I25-L29 PolarHBondContact O-N 2.98Å
26	E	91.7	Very high	86.5	Confident	79 Å²	79	101 Å²	101	37%	0.369	47%	0.467	S	S	.	.	H	α-helix	trans	-61.7	-40.9	177	-80.7	-165.2	-159	0	0	112.6	N22 E24 L29 R30	N22-E26 PolarHBondContact O-N 2.87Å; E24-E26 PolarHBondContact O-N 2.91Å; E26-L29 PolarHBondContact O-N 3.49Å; E26-R30 WeakPolarHBondContact O-CB 3.44Å; E26-R30 VanDerWaalsContact O-CG 3.29Å; E26-R30 WeakPolarHBondContact O-CG 3.28Å; E26-R30 PolarHBondContact O-N 2.85Å; E26-R30 IonicContact OE2-NH2 2.71Å; E26-R30 PolarHBondContact OE2-NH2 3.24Å
27	R	91.3	Very high	85.7	Confident	142 Å²	142	103.7 Å²	103.7	54%	0.536	48%	0.475	S	S	.	.	H	α-helix	trans	-63.2	-42.7	175.4	-76	169.3	-176.1	175.7	2.6	111.5	D23 E24 I25 R30 R31	D23-R27 VanDerWaalsContact O-CG 3.24Å; D23-R27 WeakPolarHBondContact O-CG 3.43Å; D23-R27 PolarHBondContact O-N 3.27Å; E24-R27 PolarHBondContact O-N 3.28Å; E24-R27 IonicContact OE2-NH1 3.35Å; E24-R27 PolarHBondContact OE2-NH1 3.08Å; I25-R27 VanDerWaalsContact C-N 3.35Å; I25-R27 PolarHBondContact O-N 2.9Å; R27-R30 PolarHBondContact O-N 3.38Å; R27-R31 WeakPolarHBondContact O-CG 3.47Å; R27-R31 PolarHBondContact O-N 3.25Å; R27-R31 VanDerWaalsContact O-N 3.08Å
28	Q	88.2	Confident	85.1	Confident	82 Å²	82	105.9 Å²	105.9	38%	0.383	48%	0.48	S	S	.	.	H	α-helix	trans	-64.6	-47.6	177.4	-169.8	59.2	32.9	0	0	110.8	E24 I25 R30 R31 D32	E24-Q28 WeakPolarHBondContact O-CB 3.24Å; E24-Q28 PolarHBondContact O-N 3.5Å; I25-Q28 PolarHBondContact O-N 3.41Å; Q28-R30 VanDerWaalsContact C-N 3.29Å; Q28-R30 PolarHBondContact O-N 2.81Å; Q28-R31 CarbonylContact O-C 3.56Å; Q28-R31 WeakPolarHBondContact O-CA 3.43Å; Q28-R31 WeakPolarHBondContact O-CB 3.4Å; Q28-R31 PolarHBondContact O-N 2.97Å; Q28-D32 PolarHBondContact NE2-OD1 3.27Å; Q28-D32 VanDerWaalsContact O-CG 3.23Å; Q28-D32 PolarHBondContact O-N 2.81Å
29	L	86.1	Confident	85.1	Confident	105 Å²	105	106.1 Å²	106.1	55%	0.55	47%	0.471	S	S	.	.	H	α-helix	trans	-58.1	-38.6	176	-72.8	172.3	0	0	0	112.9	I25 E26 K33	I25-L29 HydrophobicContact CG2-CD1 3.87Å; I25-L29 HydrophobicContact CG2-CG 4.28Å; I25-L29 WeakPolarHBondContact O-CB 3.49Å; I25-L29 VanDerWaalsContact O-CG 3.28Å; I25-L29 WeakPolarHBondContact O-CG 3.48Å; I25-L29 PolarHBondContact O-N 2.98Å; E26-L29 PolarHBondContact O-N 3.49Å; L29-K33 WeakPolarHBondContact O-CB 3.29Å; L29-K33 PolarHBondContact O-N 2.85Å
30	R	83.8	Confident	85.1	Confident	177 Å²	177	99.7 Å²	99.7	67%	0.668	45%	0.448	S	S	*	.	H	α-helix	trans	-67	-37.4	175.3	-73.8	177.4	-166.4	-167.3	9.2	112.3	E26 R27 Q28 R34	E26-R30 WeakPolarHBondContact O-CB 3.44Å; E26-R30 VanDerWaalsContact O-CG 3.29Å; E26-R30 WeakPolarHBondContact O-CG 3.28Å; E26-R30 PolarHBondContact O-N 2.85Å; E26-R30 IonicContact OE2-NH2 2.71Å; E26-R30 PolarHBondContact OE2-NH2 3.24Å; R27-R30 PolarHBondContact O-N 3.38Å; Q28-R30 VanDerWaalsContact C-N 3.29Å; Q28-R30 PolarHBondContact O-N 2.81Å; R30-R34 WeakPolarHBondContact O-CB 3.22Å; R30-R34 PolarHBondContact O-N 3.31Å; R30-R34 VanDerWaalsContact O-N 3.16Å
31	R	81.3	Confident	85.1	Confident	132 Å²	132	93.4 Å²	93.4	50%	0.498	43%	0.425	S	S	.	.	H	α-helix	trans	-67.6	-50.6	174.4	-72.8	175.4	179.8	172.7	0.9	110.6	R27 Q28 K33 R34 D35	R27-R31 WeakPolarHBondContact O-CG 3.47Å; R27-R31 PolarHBondContact O-N 3.25Å; R27-R31 VanDerWaalsContact O-N 3.08Å; Q28-R31 CarbonylContact O-C 3.56Å; Q28-R31 WeakPolarHBondContact O-CA 3.43Å; Q28-R31 WeakPolarHBondContact O-CB 3.4Å; Q28-R31 PolarHBondContact O-N 2.97Å; R31-K33 VanDerWaalsContact C-N 3.3Å; R31-K33 PolarHBondContact O-N 3.16Å; R31-R34 WeakPolarHBondContact O-CA 3.47Å; R31-R34 WeakPolarHBondContact O-CB 3.39Å; R31-R34 PolarHBondContact O-N 3.01Å; R31-D35 VanDerWaalsContact O-CG 3.3Å; R31-D35 PolarHBondContact O-N 3.42Å
32	D	80.3	Confident	85.4	Confident	74 Å²	74	89.5 Å²	89.5	40%	0.396	41%	0.405	S	S	.	.	H	α-helix	trans	-57.9	-42.6	178.7	-62.7	-13.6	0	0	0	111.1	Q28 R34 D35 A36	Q28-D32 PolarHBondContact NE2-OD1 3.27Å; Q28-D32 VanDerWaalsContact O-CG 3.23Å; Q28-D32 PolarHBondContact O-N 2.81Å; D32-R34 VanDerWaalsContact C-N 3.33Å; D32-R34 PolarHBondContact O-N 2.91Å; D32-D35 PolarHBondContact O-N 3.31Å; D32-A36 WeakPolarHBondContact O-CB 3.16Å; D32-A36 PolarHBondContact O-N 2.79Å
33	K	77.3	Confident	85.6	Confident	135 Å²	135	85.8 Å²	85.8	59%	0.587	39%	0.385	S	S	*	.	H	α-helix	trans	-64.7	-35	175.5	-172.3	173.2	-179.8	171.4	0	112.8	L29 R31 R37	L29-K33 WeakPolarHBondContact O-CB 3.29Å; L29-K33 PolarHBondContact O-N 2.85Å; R31-K33 VanDerWaalsContact C-N 3.3Å; R31-K33 PolarHBondContact O-N 3.16Å; K33-R37 VanDerWaalsContact O-CG 3.3Å; K33-R37 WeakPolarHBondContact O-CG 3.48Å; K33-R37 PolarHBondContact O-N 3.3Å
34	R	74.7	Confident	85.8	Confident	132 Å²	132	82.7 Å²	82.7	50%	0.498	37%	0.368	S	S	.	.	H	α-helix	trans	-72.4	-39.9	176.8	-172.5	-168	69.4	-171.7	-1.2	111.1	R30 R31 D32 R37	R30-R34 WeakPolarHBondContact O-CB 3.22Å; R30-R34 PolarHBondContact O-N 3.31Å; R30-R34 VanDerWaalsContact O-N 3.16Å; R31-R34 WeakPolarHBondContact O-CA 3.47Å; R31-R34 WeakPolarHBondContact O-CB 3.39Å; R31-R34 PolarHBondContact O-N 3.01Å; D32-R34 VanDerWaalsContact C-N 3.33Å; D32-R34 PolarHBondContact O-N 2.91Å; R34-R37 PolarHBondContact O-N 2.92Å
35	D	72.4	Confident	86	Confident	71 Å²	71	78.3 Å²	78.3	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-76	-37.7	-177.5	-61.9	-13.7	0	0	0	110.2	R31 D32 R37 R38 E39	R31-D35 VanDerWaalsContact O-CG 3.3Å; R31-D35 PolarHBondContact O-N 3.42Å; D32-D35 PolarHBondContact O-N 3.31Å; D35-R37 VanDerWaalsContact C-N 3.28Å; D35-R37 PolarHBondContact O-N 3.34Å; D35-R38 WeakPolarHBondContact O-CA 3.46Å; D35-R38 WeakPolarHBondContact O-CB 3.3Å; D35-R38 PolarHBondContact O-N 3.44Å; D35-E39 PolarHBondContact O-N 3.31Å
36	A	71.2	Confident	86.3	Confident	64 Å²	64	74.1 Å²	74.1	53%	0.529	33%	0.326	S	S	.	.	H	α-helix	trans	-59.9	-34.1	170.5	0	0	0	0	0	112.9	D32 R38 E39	D32-A36 WeakPolarHBondContact O-CB 3.16Å; D32-A36 PolarHBondContact O-N 2.79Å; A36-R38 PolarHBondContact O-N 3.03Å; A36-E39 PolarHBondContact O-N 3.07Å
37	R	72.4	Confident	86.5	Confident	143 Å²	143	70.5 Å²	70.5	54%	0.54	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.3	173	-78.7	174.1	175.5	-168.3	-4.7	113.8	K33 R34 D35 Y356	K33-R37 VanDerWaalsContact O-CG 3.3Å; K33-R37 WeakPolarHBondContact O-CG 3.48Å; K33-R37 PolarHBondContact O-N 3.3Å; R34-R37 PolarHBondContact O-N 2.92Å; D35-R37 VanDerWaalsContact C-N 3.28Å; D35-R37 PolarHBondContact O-N 3.34Å; R37-Y356 HydrophobicContact CG-CE1 4.1Å
38	R	79.7	Confident	86.7	Confident	122 Å²	122	64.2 Å²	64.2	46%	0.46	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-8.3	177.4	-64.2	176.1	177.8	-172.6	-4.7	112.2	D35 A36 V199 I200	D35-R38 WeakPolarHBondContact O-CA 3.46Å; D35-R38 WeakPolarHBondContact O-CB 3.3Å; D35-R38 PolarHBondContact O-N 3.44Å; A36-R38 PolarHBondContact O-N 3.03Å; R38-V199 WeakPolarHBondContact O-CA 3.32Å; R38-V199 WeakPolarHBondContact O-CG1 3.38Å; R38-I200 PolarHBondContact O-N 3.39Å
39	E	88.6	Confident	87	Confident	63 Å²	63	63.1 Å²	63.1	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.1	-178.8	-164.2	-177.7	106.4	0	0	110.5	D35 A36 I200 R202	D35-E39 PolarHBondContact O-N 3.31Å; A36-E39 PolarHBondContact O-N 3.07Å; E39-I200 CarbonylContact C-O 3.57Å; E39-I200 VanDerWaalsContact CA-O 3.32Å; E39-I200 WeakPolarHBondContact CA-O 3.4Å; E39-I200 HydrophobicContact CG-CB 4.3Å; E39-I200 HydrophobicContact CG-CG2 4.32Å; E39-R202 HydrophobicContact CG-CB 4.17Å; E39-R202 WeakPolarHBondContact OE1-CD 3.44Å; E39-R202 IonicContact OE1-CZ 3.51Å; E39-R202 IonicContact OE1-NE 3.3Å; E39-R202 PolarHBondContact OE1-NE 3.21Å; E39-R202 IonicContact OE1-NH2 2.8Å; E39-R202 IonicContact OE2-CZ 3.63Å; E39-R202 IonicContact OE2-NE 2.77Å; E39-R202 PolarHBondContact OE2-NE 3.02Å; E39-R202 IonicContact OE2-NH2 3.63Å; E39-R202 PolarHBondContact OE2-NH2 3.13Å
40	L	91.9	Very high	87.5	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117	176.3	-55.9	-177	0	0	0	108.8	V199 I200 F201 R202 T224 I348 L349 N352	L40-V199 HydrophobicContact CD1-CG1 3.56Å; L40-V199 HydrophobicContact CG-CG1 3.69Å; L40-I200 PolarHBondContact N-O 2.76Å; L40-F201 HydrophobicContact CB-CD1 4.07Å; L40-F201 HydrophobicContact CB-CE1 4.2Å; L40-F201 HydrophobicContact CD1-CD1 4.43Å; L40-F201 HydrophobicContact CD1-CE1 3.78Å; L40-F201 HydrophobicContact CD1-CZ 3.98Å; L40-F201 WeakPolarHBondContact O-CA 3.01Å; L40-R202 PolarHBondContact O-N 2.83Å; L40-T224 HydrophobicContact CB-CG2 4.25Å; L40-T224 HydrophobicContact CD2-CG2 4.01Å; L40-I348 HydrophobicContact CD1-CG2 3.86Å; L40-L349 HydrophobicContact CD1-CD2 3.87Å; L40-N352 HydrophobicContact CD2-CB 4.45Å
41	K	94.6	Very high	88.1	Confident	28 Å²	28	50.1 Å²	50.1	12%	0.122	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115	-178.8	-171.8	-176.7	-173.3	-174.4	0	110.2	R202 V204 C219 E221 N222 V223 T224 S225	K41-R202 WeakPolarHBondContact CA-O 3.31Å; K41-V204 HydrophobicContact CG-CG2 4.06Å; K41-C219 WeakPolarHBondContact CE-O 3.1Å; K41-C219 PolarHBondContact NZ-O 3.28Å; K41-E221 WeakPolarHBondContact CD-O 3.34Å; K41-E221 PolarHBondContact NZ-O 3.19Å; K41-N222 WeakPolarHBondContact CB-O 3.32Å; K41-N222 WeakPolarHBondContact CD-O 3.41Å; K41-V223 HydrophobicContact CD-CG2 4.03Å; K41-T224 PolarHBondContact N-OG1 3.45Å; K41-T224 WeakPolarHBondContact O-CB 3.4Å; K41-T224 PolarHBondContact O-N 2.94Å; K41-S225 PolarHBondContact O-N 2.87Å
42	L	95.9	Very high	88.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113	178.6	-50.8	-177.4	0	0	0	109.3	F201 R202 M203 V204 S225 M227 F341 I348	L42-F201 HydrophobicContact CD1-CB 4.21Å; L42-F201 HydrophobicContact CD1-CD1 3.43Å; L42-F201 VanDerWaalsContact CD1-CD1 3.43Å; L42-F201 HydrophobicContact CD1-CE1 4.2Å; L42-F201 HydrophobicContact CD1-CG 4.22Å; L42-F201 HydrophobicContact CD2-CD1 4.11Å; L42-F201 HydrophobicContact CD2-CE1 4.47Å; L42-F201 HydrophobicContact CG-CD1 3.89Å; L42-R202 PolarHBondContact N-O 3.45Å; L42-M203 HydrophobicContact CB-CG 4.17Å; L42-M203 HydrophobicContact CD1-CE 3.69Å; L42-M203 HydrophobicContact CD1-CG 4.02Å; L42-M203 CarbonylContact O-C 3.6Å; L42-M203 WeakPolarHBondContact O-CA 3.43Å; L42-V204 PolarHBondContact O-N 3.34Å; L42-S225 WeakPolarHBondContact CA-O 3.36Å; L42-M227 HydrophobicContact CB-CE 4.31Å; L42-M227 HydrophobicContact CB-SD 4.4Å; L42-M227 HydrophobicContact CD1-CE 3.46Å; L42-M227 VanDerWaalsContact CD1-CE 3.46Å; L42-M227 HydrophobicContact CD1-SD 4.24Å; L42-M227 HydrophobicContact CD2-CE 4.14Å; L42-M227 HydrophobicContact CG-CE 4.17Å; L42-F341 HydrophobicContact CD1-CE2 4.4Å; L42-I348 HydrophobicContact CD2-CD1 3.73Å
43	L	97.7	Very high	89.7	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.3	-179.6	179.9	57	0	0	0	110.3	L45 V204 V206 C219 F220 V223 S225 M227 F264	L43-L45 HydrophobicContact CD1-CD2 4.18Å; L43-L45 HydrophobicContact CD2-CD1 3.97Å; L43-L45 HydrophobicContact CD2-CD2 4.19Å; L43-L45 HydrophobicContact CD2-CG 4.21Å; L43-L45 HydrophobicContact CG-CD1 4.15Å; L43-L45 HydrophobicContact CG-CD2 3.98Å; L43-L45 HydrophobicContact CG-CG 3.89Å; L43-V204 HydrophobicContact CD1-CB 3.82Å; L43-V204 HydrophobicContact CD1-CG1 3.89Å; L43-V206 HydrophobicContact CD1-CG1 4.44Å; L43-C219 HydrophobicContact CD1-CB 4.47Å; L43-C219 WeakPolarHBondContact CD1-SG 3.42Å; L43-F220 HydrophobicContact CD2-CD1 3.78Å; L43-F220 HydrophobicContact CD2-CE1 3.9Å; L43-V223 HydrophobicContact CB-CG1 3.76Å; L43-V223 HydrophobicContact CB-CG2 4.02Å; L43-V223 HydrophobicContact CD2-CG2 3.96Å; L43-S225 PolarHBondContact N-O 2.65Å; L43-M227 PolarHBondContact O-N 3.45Å; L43-F264 HydrophobicContact CD2-CE1 3.86Å; L43-F264 HydrophobicContact CD2-CZ 3.73Å
44	L	98	Very high	90.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	118.8	178.5	-73.7	75.8	0	0	0	110.1	K52 F55 I56 M203 V204 V206 M227 L229	L44-K52 HydrophobicContact CB-CB 4.34Å; L44-K52 HydrophobicContact CB-CD 4.25Å; L44-K52 HydrophobicContact CB-CG 4.27Å; L44-K52 HydrophobicContact CD2-CB 4.29Å; L44-K52 WeakPolarHBondContact O-CD 3.12Å; L44-F55 HydrophobicContact CD2-CB 4.4Å; L44-F55 HydrophobicContact CD2-CD1 4.08Å; L44-I56 HydrophobicContact CD1-CD1 3.97Å; L44-I56 HydrophobicContact CD2-CD1 3.69Å; L44-I56 HydrophobicContact CD2-CG1 3.79Å; L44-I56 HydrophobicContact CG-CD1 4.5Å; L44-M203 HydrophobicContact CD1-CB 3.95Å; L44-M203 HydrophobicContact CD1-CG 4.38Å; L44-M203 HydrophobicContact CD1-SD 4.44Å; L44-V204 PolarHBondContact N-O 3.04Å; L44-V206 WeakPolarHBondContact O-CG2 3.24Å; L44-M227 CarbonylContact C-O 3.44Å; L44-M227 WeakPolarHBondContact CA-O 3.48Å; L44-M227 HydrophobicContact CG-CB 4.25Å; L44-L229 HydrophobicContact CB-CD1 4.39Å; L44-L229 HydrophobicContact CD2-CD1 4.29Å; L44-L229 HydrophobicContact CG-CD1 4.35Å
45	L	98.1	Very high	91.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	163.2	-178.3	-62.5	176	0	0	0	111.5	L43 V206 W216 I226 M227 F228 L229 I258 F264	L43-L45 HydrophobicContact CD1-CD2 4.18Å; L43-L45 HydrophobicContact CD2-CD1 3.97Å; L43-L45 HydrophobicContact CD2-CD2 4.19Å; L43-L45 HydrophobicContact CD2-CG 4.21Å; L43-L45 HydrophobicContact CG-CD1 4.15Å; L43-L45 HydrophobicContact CG-CD2 3.98Å; L43-L45 HydrophobicContact CG-CG 3.89Å; L45-V206 HydrophobicContact CD2-CG2 3.8Å; L45-W216 HydrophobicContact CD2-CD2 3.89Å; L45-W216 HydrophobicContact CD2-CE3 3.71Å; L45-W216 HydrophobicContact CD2-CG 4.49Å; L45-W216 HydrophobicContact CD2-CH2 4.19Å; L45-W216 HydrophobicContact CD2-CZ2 4.35Å; L45-W216 HydrophobicContact CD2-CZ3 3.86Å; L45-I226 HydrophobicContact CD1-CG2 3.98Å; L45-I226 HydrophobicContact CG-CG2 4.47Å; L45-M227 PolarHBondContact N-O 3.48Å; L45-F228 HydrophobicContact CB-CD2 3.74Å; L45-F228 HydrophobicContact CB-CE2 4.16Å; L45-F228 WeakPolarHBondContact O-CA 3.4Å; L45-L229 PolarHBondContact O-N 3.29Å; L45-I258 HydrophobicContact CD1-CB 4.48Å; L45-I258 HydrophobicContact CD1-CD1 3.82Å; L45-I258 HydrophobicContact CD1-CG1 3.99Å; L45-I258 HydrophobicContact CD1-CG2 3.63Å; L45-F264 HydrophobicContact CD1-CE2 4.5Å; L45-F264 HydrophobicContact CD1-CZ 4.43Å
46	G	97.6	Very high	92.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.138	C	C	.	.			trans	139.8	168.5	-179.4	0	0	0	0	0	112	K52 G208	G46-K52 PolarHBondContact O-NZ 3.34Å; G46-G208 WeakPolarHBondContact O-CA 3.44Å
47	T	96.2	Very high	94	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.018	12%	0.119	C	C	.	.	S	Bend	trans	-58.8	165.8	178.4	50.5	0	0	0	0	112.5	E49 S50 K52 E250 L254	T47-E49 PolarHBondContact O-N 3.36Å; T47-S50 PolarHBondContact O-N 3.2Å; T47-S50 PolarHBondContact O-OG 2.8Å; T47-K52 PolarHBondContact O-NZ 3.39Å; T47-E250 HydrophobicContact CG2-CG 4.01Å; T47-L254 HydrophobicContact CG2-CD2 4.19Å
48	G	94.2	Very high	95.2	Very high	10 Å²	10	19 Å²	19	10%	0.103	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	141.9	168.1	0	0	0	0	0	110.1	S50 G208 R247	G48-S50 PolarHBondContact O-N 3.42Å; G48-S50 VanDerWaalsContact O-N 3.08Å; G48-G208 PolarHBondContact N-O 2.83Å; G48-R247 PolarHBondContact O-NH2 3.44Å
49	E	94.9	Very high	95.9	Very high	59 Å²	59	13.1 Å²	13.1	28%	0.276	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	6.3	174.6	-49.2	-179.3	141	0	0	116.7	T47 G51 R183 R247 K275	T47-E49 PolarHBondContact O-N 3.36Å; E49-G51 PolarHBondContact O-N 2.77Å; E49-G51 VanDerWaalsContact O-N 3.11Å; E49-R183 IonicContact OE1-NE 2.8Å; E49-R183 PolarHBondContact OE1-NE 3.03Å; E49-R247 IonicContact OE2-CZ 4Å; E49-R247 IonicContact OE2-NH1 2.72Å; E49-R247 PolarHBondContact OE2-NH1 3.2Å; E49-R247 IonicContact OE2-NH2 3.09Å; E49-R247 PolarHBondContact OE2-NH2 3.26Å; E49-K275 WeakPolarHBondContact O-CE 3.41Å; E49-K275 PolarHBondContact O-NZ 3Å
50	S	97.3	Very high	96.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	-65.1	-14.9	176.5	69.9	0	0	0	0	114.8	T47 G48 L229 N274	T47-S50 PolarHBondContact O-N 3.2Å; T47-S50 PolarHBondContact O-OG 2.8Å; G48-S50 PolarHBondContact O-N 3.42Å; G48-S50 VanDerWaalsContact O-N 3.08Å; S50-L229 WeakPolarHBondContact CB-O 3.26Å; S50-L229 WeakPolarHBondContact OG-CB 3.27Å; S50-L229 PolarHBondContact OG-O 3.4Å; S50-L229 VanDerWaalsContact OG-O 3.11Å; S50-N274 PolarHBondContact O-ND2 3.35Å
51	G	97.1	Very high	96.3	Very high	9 Å²	9	14.9 Å²	14.9	9%	0.093	8%	0.076	C	C	.	.	S	Bend	trans	111.1	9.7	175.3	0	0	0	0	0	115.9	E49 S53 T54 F55	E49-G51 PolarHBondContact O-N 2.77Å; E49-G51 VanDerWaalsContact O-N 3.11Å; G51-S53 PolarHBondContact O-N 3.3Å; G51-T54 WeakPolarHBondContact O-CB 3.41Å; G51-T54 PolarHBondContact O-N 3.27Å; G51-F55 PolarHBondContact O-N 3.39Å
52	K	97.1	Very high	96.3	Very high	9 Å²	9	14.6 Å²	14.6	4%	0.039	8%	0.076	C	C	.	.	H	α-helix	trans	-52.3	-58.3	-178.2	-63	-177.4	-69.8	-67.7	0	113	L44 G46 T47 T54 F55 I56 D205 V206 L229	L44-K52 HydrophobicContact CB-CB 4.34Å; L44-K52 HydrophobicContact CB-CD 4.25Å; L44-K52 HydrophobicContact CB-CG 4.27Å; L44-K52 HydrophobicContact CD2-CB 4.29Å; L44-K52 WeakPolarHBondContact O-CD 3.12Å; G46-K52 PolarHBondContact O-NZ 3.34Å; T47-K52 PolarHBondContact O-NZ 3.39Å; K52-T54 VanDerWaalsContact C-N 3.26Å; K52-T54 PolarHBondContact O-N 2.69Å; K52-F55 WeakPolarHBondContact O-CA 3.48Å; K52-F55 VanDerWaalsContact O-CB 3.3Å; K52-F55 WeakPolarHBondContact O-CB 3.38Å; K52-F55 PolarHBondContact O-N 2.91Å; K52-I56 PolarHBondContact O-N 2.85Å; K52-I56 VanDerWaalsContact O-N 3.07Å; K52-D205 WeakPolarHBondContact CB-OD1 3.48Å; K52-V206 WeakPolarHBondContact CE-O 3.44Å; K52-L229 HydrophobicContact CG-CB 4.26Å; K52-L229 HydrophobicContact CG-CD1 3.87Å; K52-L229 HydrophobicContact CG-CG 4.43Å
53	S	96.8	Very high	96.1	Very high	27 Å²	27	18.1 Å²	18.1	19%	0.189	9%	0.092	C	C	.	.	H	α-helix	trans	-64.4	-32.4	-179.6	-47.8	0	0	0	0	112	G51 F55 I56 K57 T186 D205	G51-S53 PolarHBondContact O-N 3.3Å; S53-F55 VanDerWaalsContact C-N 3.35Å; S53-I56 PolarHBondContact O-N 3.47Å; S53-K57 VanDerWaalsContact O-CG 3.24Å; S53-K57 WeakPolarHBondContact O-CG 3.4Å; S53-K57 PolarHBondContact O-N 2.81Å; S53-T186 PolarHBondContact OG-OG1 2.9Å; S53-D205 WeakPolarHBondContact CA-OD2 3.44Å; S53-D205 WeakPolarHBondContact CB-OD2 3.43Å; S53-D205 PolarHBondContact OG-OD2 3.08Å
54	T	97.5	Very high	95.7	Very high	27 Å²	27	20.2 Å²	20.2	17%	0.166	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-40.3	173.6	-53.2	0	0	0	0	111.3	G51 K52 I56 K57 Q58 L180 A331 T332	G51-T54 WeakPolarHBondContact O-CB 3.41Å; G51-T54 PolarHBondContact O-N 3.27Å; K52-T54 VanDerWaalsContact C-N 3.26Å; K52-T54 PolarHBondContact O-N 2.69Å; T54-I56 VanDerWaalsContact C-N 3.35Å; T54-I56 PolarHBondContact O-N 2.81Å; T54-K57 WeakPolarHBondContact O-CB 3.37Å; T54-K57 PolarHBondContact O-N 3.02Å; T54-Q58 WeakPolarHBondContact O-CG 3.5Å; T54-Q58 PolarHBondContact O-N 3.34Å; T54-L180 HydrophobicContact CG2-CB 4.39Å; T54-L180 HydrophobicContact CG2-CD2 4.03Å; T54-L180 PolarHBondContact OG1-O 3.3Å; T54-A331 HydrophobicContact CG2-CB 3.69Å; T54-A331 WeakPolarHBondContact CG2-O 3.26Å; T54-T332 HydrophobicContact CG2-CG2 4.31Å
55	F	97.2	Very high	95.4	Very high	1 Å²	1	25.7 Å²	25.7	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-43.1	173.2	-169.5	-88.7	0	0	0	111.8	L44 G51 K52 S53 K57 Q58 M59 M203 M227 L229 F272 I337 F341	L44-F55 HydrophobicContact CD2-CB 4.4Å; L44-F55 HydrophobicContact CD2-CD1 4.08Å; G51-F55 PolarHBondContact O-N 3.39Å; K52-F55 WeakPolarHBondContact O-CA 3.48Å; K52-F55 VanDerWaalsContact O-CB 3.3Å; K52-F55 WeakPolarHBondContact O-CB 3.38Å; K52-F55 PolarHBondContact O-N 2.91Å; S53-F55 VanDerWaalsContact C-N 3.35Å; F55-K57 PolarHBondContact O-N 3.29Å; F55-Q58 WeakPolarHBondContact O-CB 3.26Å; F55-Q58 PolarHBondContact O-N 2.91Å; F55-Q58 VanDerWaalsContact O-N 3.14Å; F55-M59 HydrophobicContact CD1-CG 4.17Å; F55-M59 HydrophobicContact CE1-CE 4.12Å; F55-M59 HydrophobicContact CE1-CG 4.03Å; F55-M59 HydrophobicContact CE1-SD 4.14Å; F55-M59 HydrophobicContact CZ-CE 4.08Å; F55-M59 WeakPolarHBondContact O-CG 3.39Å; F55-M59 PolarHBondContact O-N 2.81Å; F55-M203 HydrophobicContact CE1-CE 4.28Å; F55-M203 HydrophobicContact CE1-SD 4.46Å; F55-M227 HydrophobicContact CE1-SD 4.21Å; F55-L229 HydrophobicContact CB-CD2 4.22Å; F55-F272 HydrophobicContact CE2-CE1 4.38Å; F55-F272 HydrophobicContact CE2-CE2 4.03Å; F55-F272 AromaticContact CE2-CZ 3.9Å; F55-F272 HydrophobicContact CE2-CZ 3.9Å; F55-F272 AromaticContact CZ-CE2 3.98Å; F55-F272 HydrophobicContact CZ-CE2 3.98Å; F55-F272 AromaticContact CZ-CZ 3.86Å; F55-F272 HydrophobicContact CZ-CZ 3.86Å; F55-I337 HydrophobicContact CD2-CD1 3.97Å; F55-I337 HydrophobicContact CD2-CG2 4.21Å; F55-I337 HydrophobicContact CE2-CD1 4.08Å; F55-I337 HydrophobicContact CE2-CG2 3.96Å; F55-F341 HydrophobicContact CE1-CD2 4.14Å; F55-F341 HydrophobicContact CZ-CB 4.42Å; F55-F341 AromaticContact CZ-CD2 3.79Å; F55-F341 HydrophobicContact CZ-CD2 3.79Å; F55-F341 HydrophobicContact CZ-CG 4.46Å
56	I	95.7	Very high	95.2	Very high	5 Å²	5	26 Å²	26	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-44.1	174.2	-62.7	-67.7	0	0	0	112	L44 K52 S53 T54 Q58 M59 R60 Y192 M203 D205	L44-I56 HydrophobicContact CD1-CD1 3.97Å; L44-I56 HydrophobicContact CD2-CD1 3.69Å; L44-I56 HydrophobicContact CD2-CG1 3.79Å; L44-I56 HydrophobicContact CG-CD1 4.5Å; K52-I56 PolarHBondContact O-N 2.85Å; K52-I56 VanDerWaalsContact O-N 3.07Å; S53-I56 PolarHBondContact O-N 3.47Å; T54-I56 VanDerWaalsContact C-N 3.35Å; T54-I56 PolarHBondContact O-N 2.81Å; I56-Q58 PolarHBondContact O-N 2.81Å; I56-M59 WeakPolarHBondContact O-CB 3.46Å; I56-M59 PolarHBondContact O-N 2.81Å; I56-R60 PolarHBondContact O-N 2.94Å; I56-Y192 HydrophobicContact CD1-CD2 4.27Å; I56-Y192 HydrophobicContact CG1-CD2 4.47Å; I56-Y192 HydrophobicContact CG2-CD1 3.91Å; I56-Y192 HydrophobicContact CG2-CD2 3.55Å; I56-Y192 HydrophobicContact CG2-CE1 4.01Å; I56-Y192 HydrophobicContact CG2-CE2 3.67Å; I56-Y192 HydrophobicContact CG2-CG 3.66Å; I56-M203 HydrophobicContact CD1-CB 3.47Å; I56-M203 VanDerWaalsContact CD1-CB 3.47Å; I56-M203 HydrophobicContact CD1-CG 4.18Å; I56-M203 HydrophobicContact CD1-SD 3.61Å; I56-D205 HydrophobicContact CG1-CB 4.11Å
57	K	96.1	Very high	95.2	Very high	27 Å²	27	27.4 Å²	27.4	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-57.5	-38.9	174.9	-65.9	174.5	-179.3	178.7	0	110.7	S53 T54 F55 R60 I61 Y67 V179 L180 V182	S53-K57 VanDerWaalsContact O-CG 3.24Å; S53-K57 WeakPolarHBondContact O-CG 3.4Å; S53-K57 PolarHBondContact O-N 2.81Å; T54-K57 WeakPolarHBondContact O-CB 3.37Å; T54-K57 PolarHBondContact O-N 3.02Å; F55-K57 PolarHBondContact O-N 3.29Å; K57-R60 WeakPolarHBondContact O-CB 3.42Å; K57-R60 PolarHBondContact O-N 3.47Å; K57-I61 WeakPolarHBondContact O-CD1 3.12Å; K57-I61 WeakPolarHBondContact O-CG1 3.31Å; K57-I61 PolarHBondContact O-N 2.75Å; K57-I61 VanDerWaalsContact O-N 3.09Å; K57-Y67 VanDerWaalsContact CA-OH 3.32Å; K57-Y67 WeakPolarHBondContact CA-OH 3.37Å; K57-Y67 HydrophobicContact CB-CE2 4.29Å; K57-Y67 VanDerWaalsContact CB-OH 3.27Å; K57-Y67 WeakPolarHBondContact CB-OH 3.19Å; K57-Y67 WeakPolarHBondContact CG-OH 3.23Å; K57-V179 HydrophobicContact CD-CG1 4.43Å; K57-V179 VanDerWaalsContact CD-O 3.3Å; K57-V179 WeakPolarHBondContact CD-O 3.36Å; K57-V179 WeakPolarHBondContact CE-O 3.48Å; K57-V179 PolarHBondContact NZ-O 2.94Å; K57-L180 HydrophobicContact CB-CD2 3.91Å; K57-V182 PolarHBondContact NZ-O 3.15Å; K57-V182 VanDerWaalsContact NZ-O 3.12Å
58	Q	97	Very high	95.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.6	-38.6	174.3	-69.8	-72.5	24.6	0	0	112.8	T54 F55 I56 R60 I61 I62 L180 A331 T334 I337	T54-Q58 WeakPolarHBondContact O-CG 3.5Å; T54-Q58 PolarHBondContact O-N 3.34Å; F55-Q58 WeakPolarHBondContact O-CB 3.26Å; F55-Q58 PolarHBondContact O-N 2.91Å; F55-Q58 VanDerWaalsContact O-N 3.14Å; I56-Q58 PolarHBondContact O-N 2.81Å; Q58-R60 VanDerWaalsContact C-N 3.29Å; Q58-R60 PolarHBondContact O-N 2.76Å; Q58-I61 CarbonylContact O-C 3.41Å; Q58-I61 WeakPolarHBondContact O-CB 3.38Å; Q58-I61 PolarHBondContact O-N 3.24Å; Q58-I62 HydrophobicContact CB-CD1 4.17Å; Q58-I62 WeakPolarHBondContact O-CB 3.47Å; Q58-I62 VanDerWaalsContact O-CG1 3.27Å; Q58-I62 WeakPolarHBondContact O-CG1 3.45Å; Q58-I62 PolarHBondContact O-N 2.69Å; Q58-L180 HydrophobicContact CG-CD2 3.78Å; Q58-A331 WeakPolarHBondContact CG-O 3.37Å; Q58-A331 PolarHBondContact NE2-O 3.44Å; Q58-T334 PolarHBondContact NE2-OG1 2.89Å; Q58-T334 PolarHBondContact OE1-OG1 3.2Å; Q58-I337 HydrophobicContact CB-CB 4.33Å; Q58-I337 HydrophobicContact CB-CG2 3.73Å; Q58-I337 HydrophobicContact CG-CB 4.35Å; Q58-I337 HydrophobicContact CG-CG1 4.16Å; Q58-I337 HydrophobicContact CG-CG2 4.25Å
59	M	94.8	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-38.6	174.8	-63.7	-64	104.5	0	0	111.9	F55 I56 I61 I62 H63 G64 F194 M203 I337 F341	F55-M59 HydrophobicContact CD1-CG 4.17Å; F55-M59 HydrophobicContact CE1-CE 4.12Å; F55-M59 HydrophobicContact CE1-CG 4.03Å; F55-M59 HydrophobicContact CE1-SD 4.14Å; F55-M59 HydrophobicContact CZ-CE 4.08Å; F55-M59 WeakPolarHBondContact O-CG 3.39Å; F55-M59 PolarHBondContact O-N 2.81Å; I56-M59 WeakPolarHBondContact O-CB 3.46Å; I56-M59 PolarHBondContact O-N 2.81Å; M59-I61 VanDerWaalsContact C-N 3.31Å; M59-I61 PolarHBondContact O-N 2.86Å; M59-I62 HydrophobicContact CE-CD1 4.1Å; M59-I62 PolarHBondContact O-N 3.06Å; M59-H63 WeakPolarHBondContact O-CB 3.49Å; M59-H63 PolarHBondContact O-N 2.96Å; M59-G64 PolarHBondContact O-N 3.13Å; M59-F194 HydrophobicContact CB-CD1 4.16Å; M59-F194 HydrophobicContact CB-CD2 4.49Å; M59-F194 HydrophobicContact CB-CE1 3.53Å; M59-F194 HydrophobicContact CB-CE2 3.89Å; M59-F194 HydrophobicContact CB-CZ 3.37Å; M59-F194 HydrophobicContact CG-CZ 4.44Å; M59-M203 HydrophobicContact CB-CE 4.43Å; M59-M203 HydrophobicContact CB-SD 4.27Å; M59-M203 HydrophobicContact CG-CE 3.56Å; M59-M203 HydrophobicContact CG-SD 3.63Å; M59-M203 HydrophobicContact SD-CE 3.68Å; M59-I337 HydrophobicContact CE-CG2 3.47Å; M59-I337 VanDerWaalsContact CE-CG2 3.47Å; M59-F341 HydrophobicContact CE-CB 3.86Å; M59-F341 HydrophobicContact CE-CD1 4.09Å; M59-F341 HydrophobicContact CE-CD2 4.2Å; M59-F341 HydrophobicContact CE-CG 3.77Å; M59-F341 HydrophobicContact SD-CB 4.38Å; M59-F341 HydrophobicContact SD-CD1 3.61Å; M59-F341 HydrophobicContact SD-CD2 3.75Å; M59-F341 HydrophobicContact SD-CE1 3.69Å; M59-F341 HydrophobicContact SD-CE2 3.82Å; M59-F341 HydrophobicContact SD-CG 3.62Å; M59-F341 HydrophobicContact SD-CZ 3.78Å
60	R	94.4	Very high	95.5	Very high	82 Å²	82	38.3 Å²	38.3	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-62.7	-36.2	171.8	-176.6	173.5	171.9	176.5	-1.3	112.5	I56 K57 Q58 G64 G66 D71	I56-R60 PolarHBondContact O-N 2.94Å; K57-R60 WeakPolarHBondContact O-CB 3.42Å; K57-R60 PolarHBondContact O-N 3.47Å; Q58-R60 VanDerWaalsContact C-N 3.29Å; Q58-R60 PolarHBondContact O-N 2.76Å; R60-G64 CarbonylContact O-C 3.6Å; R60-G64 WeakPolarHBondContact O-CA 3.25Å; R60-G64 PolarHBondContact O-N 3.37Å; R60-G64 VanDerWaalsContact O-N 3.12Å; R60-G66 PolarHBondContact NE-O 3.1Å; R60-G66 VanDerWaalsContact O-CA 3.31Å; R60-G66 WeakPolarHBondContact O-CA 3.44Å; R60-G66 PolarHBondContact O-N 3.2Å; R60-D71 IonicContact CZ-OD1 2.94Å; R60-D71 IonicContact NH1-OD1 3.34Å; R60-D71 IonicContact NH2-OD1 3.49Å; R60-D71 PolarHBondContact NH2-OD1 3.5Å; R60-D71 IonicContact NH2-OD2 3.59Å; R60-D71 PolarHBondContact NH2-OD2 3.44Å
61	I	95.4	Very high	95.5	Very high	26 Å²	26	40.8 Å²	40.8	13%	0.133	23%	0.23	C	C	.	.	H	α-helix	trans	-73.3	-44.6	177.5	-70.5	159.3	0	0	0	112.4	K57 Q58 M59 Y67 Q176 L180 T334	K57-I61 WeakPolarHBondContact O-CD1 3.12Å; K57-I61 WeakPolarHBondContact O-CG1 3.31Å; K57-I61 PolarHBondContact O-N 2.75Å; K57-I61 VanDerWaalsContact O-N 3.09Å; Q58-I61 CarbonylContact O-C 3.41Å; Q58-I61 WeakPolarHBondContact O-CB 3.38Å; Q58-I61 PolarHBondContact O-N 3.24Å; M59-I61 VanDerWaalsContact C-N 3.31Å; M59-I61 PolarHBondContact O-N 2.86Å; I61-Y67 HydrophobicContact CD1-CD2 4.14Å; I61-Y67 HydrophobicContact CD1-CE2 3.91Å; I61-Y67 HydrophobicContact CG1-CD2 3.82Å; I61-Y67 HydrophobicContact CG1-CE2 3.77Å; I61-Q176 HydrophobicContact CD1-CG 3.56Å; I61-Q176 HydrophobicContact CG1-CG 4.25Å; I61-Q176 VanDerWaalsContact CG2-NE2 3.29Å; I61-L180 HydrophobicContact CD1-CD1 4.26Å; I61-L180 HydrophobicContact CD1-CD2 3.84Å; I61-L180 HydrophobicContact CD1-CG 4.12Å; I61-T334 HydrophobicContact CG2-CG2 4.05Å
62	I	94	Very high	95.5	Very high	22 Å²	22	42.5 Å²	42.5	11%	0.113	24%	0.235	C	C	.	.	H	α-helix	trans	-82.6	-37.8	-169.9	-68.1	166.6	0	0	0	111.3	Q58 M59 T334 I337 R338	Q58-I62 HydrophobicContact CB-CD1 4.17Å; Q58-I62 WeakPolarHBondContact O-CB 3.47Å; Q58-I62 VanDerWaalsContact O-CG1 3.27Å; Q58-I62 WeakPolarHBondContact O-CG1 3.45Å; Q58-I62 PolarHBondContact O-N 2.69Å; M59-I62 HydrophobicContact CE-CD1 4.1Å; M59-I62 PolarHBondContact O-N 3.06Å; I62-T334 HydrophobicContact CD1-CG2 4.24Å; I62-T334 HydrophobicContact CG1-CG2 3.9Å; I62-I337 HydrophobicContact CD1-CB 4.12Å; I62-I337 HydrophobicContact CD1-CG2 3.75Å; I62-R338 HydrophobicContact CD1-CB 4.11Å; I62-R338 HydrophobicContact CG2-CB 4.45Å; I62-R338 HydrophobicContact CG2-CG 4.12Å
63	H	90.8	Very high	95.5	Very high	74 Å²	74	49.2 Å²	49.2	34%	0.343	26%	0.26	S	S	.	.	H	α-helix	trans	-120.9	-13	-172.2	-63.8	-58.6	0	0	0	114	M59 L196 F341	M59-H63 WeakPolarHBondContact O-CB 3.49Å; M59-H63 PolarHBondContact O-N 2.96Å; H63-L196 HydrophobicContact CB-CD2 3.85Å; H63-L196 WeakPolarHBondContact ND1-CD2 3.45Å; H63-F341 AromaticContact CD2-CD1 3.84Å; H63-F341 AromaticContact CD2-CE1 3.76Å; H63-F341 AromaticContact NE2-CD1 3.24Å; H63-F341 WeakPolarHBondContact NE2-CD1 3.47Å; H63-F341 AromaticContact NE2-CE1 3.47Å; H63-F341 WeakPolarHBondContact NE2-CE1 3.2Å
64	G	90.1	Very high	95.5	Very high	43 Å²	43	50.6 Å²	50.6	44%	0.443	28%	0.279	S	S	.	.	S	Bend	trans	-104.3	-163.2	175.1	0	0	0	0	0	112.9	M59 R60 G66	M59-G64 PolarHBondContact O-N 3.13Å; R60-G64 CarbonylContact O-C 3.6Å; R60-G64 WeakPolarHBondContact O-CA 3.25Å; R60-G64 PolarHBondContact O-N 3.37Å; R60-G64 VanDerWaalsContact O-N 3.12Å; G64-G66 PolarHBondContact O-N 3.01Å
65	S	91.5	Very high	95.6	Very high	115 Å²	115	51.1 Å²	51.1	80%	0.804	28%	0.28	S	S	*	.			trans	-78.1	5	175.5	60.9	0	0	0	0	113.8
66	G	94.3	Very high	95.6	Very high	8 Å²	8	52 Å²	52	8%	0.082	29%	0.285	C	S	.	.			trans	61.6	-146.1	-170.4	0	0	0	0	0	113.1	R60 G64	R60-G66 PolarHBondContact NE-O 3.1Å; R60-G66 VanDerWaalsContact O-CA 3.31Å; R60-G66 WeakPolarHBondContact O-CA 3.44Å; R60-G66 PolarHBondContact O-N 3.2Å; G64-G66 PolarHBondContact O-N 3.01Å
67	Y	96.5	Very high	95.7	Very high	28 Å²	28	56.2 Å²	56.2	11%	0.11	30%	0.303	C	S	.	.			trans	-114.9	118.4	179.9	-66.1	-83.4	0	0	0	109.3	K57 I61 D71 K72 F75 V179	K57-Y67 VanDerWaalsContact CA-OH 3.32Å; K57-Y67 WeakPolarHBondContact CA-OH 3.37Å; K57-Y67 HydrophobicContact CB-CE2 4.29Å; K57-Y67 VanDerWaalsContact CB-OH 3.27Å; K57-Y67 WeakPolarHBondContact CB-OH 3.19Å; K57-Y67 WeakPolarHBondContact CG-OH 3.23Å; I61-Y67 HydrophobicContact CD1-CD2 4.14Å; I61-Y67 HydrophobicContact CD1-CE2 3.91Å; I61-Y67 HydrophobicContact CG1-CD2 3.82Å; I61-Y67 HydrophobicContact CG1-CE2 3.77Å; Y67-D71 HydrophobicContact CD1-CB 3.95Å; Y67-K72 VanDerWaalsContact O-CE 3.3Å; Y67-K72 WeakPolarHBondContact O-CE 3.36Å; Y67-F75 HydrophobicContact CD1-CE2 4.01Å; Y67-F75 HydrophobicContact CE1-CE2 4.02Å; Y67-F75 HydrophobicContact CE1-CZ 4.17Å; Y67-V179 HydrophobicContact CD1-CG1 4Å; Y67-V179 HydrophobicContact CD2-CG1 3.89Å; Y67-V179 HydrophobicContact CE1-CG1 3.85Å; Y67-V179 HydrophobicContact CE2-CG1 3.74Å; Y67-V179 HydrophobicContact CG-CG1 4.03Å
68	S	97.2	Very high	95.8	Very high	55 Å²	55	57 Å²	57	39%	0.385	31%	0.309	S	S	.	.			trans	-67.2	168.7	170.6	68.4	0	0	0	0	110.8	E70 D71 K72	S68-E70 PolarHBondContact O-N 2.93Å; S68-D71 WeakPolarHBondContact CB-OD2 3.34Å; S68-D71 PolarHBondContact N-OD2 3.48Å; S68-D71 WeakPolarHBondContact O-CB 3.35Å; S68-D71 PolarHBondContact O-N 3.35Å; S68-D71 VanDerWaalsContact OG-CG 3.26Å; S68-D71 PolarHBondContact OG-N 2.93Å; S68-D71 VanDerWaalsContact OG-N 3.11Å; S68-D71 PolarHBondContact OG-OD2 3.32Å; S68-K72 VanDerWaalsContact O-CG 3.31Å; S68-K72 WeakPolarHBondContact O-CG 3.34Å; S68-K72 PolarHBondContact O-N 2.94Å
69	D	97.7	Very high	95.9	Very high	83 Å²	83	57 Å²	57	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-67.5	-26.5	175.4	-68.7	-9.1	0	0	0	112.6	K72 R73 L173	D69-K72 IonicContact OD1-NZ 2.65Å; D69-K72 PolarHBondContact OD1-NZ 3.28Å; D69-R73 WeakPolarHBondContact O-CB 3.39Å; D69-R73 PolarHBondContact O-N 2.97Å; D69-L173 HydrophobicContact CB-CD2 4.02Å
70	E	97.1	Very high	96.1	Very high	163 Å²	163	58 Å²	58	76%	0.762	31%	0.313	S	S	*	.	H	α-helix	trans	-67.8	-46.7	170.5	-173.5	175	-176.7	0	0	111.3	S68 K72 R73 G74	S68-E70 PolarHBondContact O-N 2.93Å; E70-K72 PolarHBondContact O-N 3.36Å; E70-R73 PolarHBondContact O-N 3.5Å; E70-G74 PolarHBondContact O-N 3.12Å
71	D	96.7	Very high	96.3	Very high	52 Å²	52	55 Å²	55	28%	0.278	30%	0.302	S	S	.	.	H	α-helix	trans	-56.8	-50	174.8	-65.7	-72.3	0	0	0	110.9	R60 Y67 S68 R73 G74 F75	R60-D71 IonicContact CZ-OD1 2.94Å; R60-D71 IonicContact NH1-OD1 3.34Å; R60-D71 IonicContact NH2-OD1 3.49Å; R60-D71 PolarHBondContact NH2-OD1 3.5Å; R60-D71 IonicContact NH2-OD2 3.59Å; R60-D71 PolarHBondContact NH2-OD2 3.44Å; Y67-D71 HydrophobicContact CD1-CB 3.95Å; S68-D71 WeakPolarHBondContact CB-OD2 3.34Å; S68-D71 PolarHBondContact N-OD2 3.48Å; S68-D71 WeakPolarHBondContact O-CB 3.35Å; S68-D71 PolarHBondContact O-N 3.35Å; S68-D71 VanDerWaalsContact OG-CG 3.26Å; S68-D71 PolarHBondContact OG-N 2.93Å; S68-D71 VanDerWaalsContact OG-N 3.11Å; S68-D71 PolarHBondContact OG-OD2 3.32Å; D71-R73 VanDerWaalsContact C-N 3.31Å; D71-R73 PolarHBondContact O-N 3.46Å; D71-G74 PolarHBondContact O-N 3.35Å; D71-G74 VanDerWaalsContact O-N 3.09Å; D71-F75 WeakPolarHBondContact O-CD2 3.47Å
72	K	98.3	Very high	96.4	Very high	45 Å²	45	54.9 Å²	54.9	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-57.4	-44.3	179.6	-72.6	165.8	-171.2	164.9	0	111.1	Y67 S68 D69 E70 G74 F75 L173 P174 V179	Y67-K72 VanDerWaalsContact O-CE 3.3Å; Y67-K72 WeakPolarHBondContact O-CE 3.36Å; S68-K72 VanDerWaalsContact O-CG 3.31Å; S68-K72 WeakPolarHBondContact O-CG 3.34Å; S68-K72 PolarHBondContact O-N 2.94Å; D69-K72 IonicContact OD1-NZ 2.65Å; D69-K72 PolarHBondContact OD1-NZ 3.28Å; E70-K72 PolarHBondContact O-N 3.36Å; K72-G74 PolarHBondContact O-N 3.25Å; K72-F75 WeakPolarHBondContact O-CB 3.49Å; K72-F75 PolarHBondContact O-N 3.11Å; K72-L173 HydrophobicContact CB-CD1 3.92Å; K72-L173 HydrophobicContact CB-CG 4.32Å; K72-P174 HydrophobicContact CB-CB 4.43Å; K72-P174 WeakPolarHBondContact CB-O 3.48Å; K72-P174 VanDerWaalsContact CD-O 3.24Å; K72-P174 WeakPolarHBondContact CD-O 3.45Å; K72-P174 WeakPolarHBondContact CG-O 3.24Å; K72-P174 WeakPolarHBondContact O-CD 3.26Å; K72-P174 VanDerWaalsContact O-CG 3.23Å; K72-P174 WeakPolarHBondContact O-CG 3.44Å; K72-V179 HydrophobicContact CG-CG2 4.22Å
73	R	97.5	Very high	96.6	Very high	150 Å²	150	53.9 Å²	53.9	57%	0.566	30%	0.296	S	S	*	.	H	α-helix	trans	-59.2	-34.5	178.8	-155.7	-177.4	-50.6	-80.6	-4.4	111.8	D69 E70 D71 F75 T76 L173	D69-R73 WeakPolarHBondContact O-CB 3.39Å; D69-R73 PolarHBondContact O-N 2.97Å; E70-R73 PolarHBondContact O-N 3.5Å; D71-R73 VanDerWaalsContact C-N 3.31Å; D71-R73 PolarHBondContact O-N 3.46Å; R73-F75 PolarHBondContact O-N 3.39Å; R73-T76 VanDerWaalsContact O-CB 3.27Å; R73-T76 WeakPolarHBondContact O-CB 3.36Å; R73-T76 PolarHBondContact O-N 3.49Å; R73-T76 VanDerWaalsContact O-N 3.15Å; R73-T76 PolarHBondContact O-OG1 3.05Å; R73-L173 HydrophobicContact CB-CD1 4.14Å
74	G	96.8	Very high	97	Very high	57 Å²	57	50.5 Å²	50.5	59%	0.588	28%	0.281	S	S	*	.	H	α-helix	trans	-61	-24.6	172.8	0	0	0	0	0	114.6	E70 D71 K72	E70-G74 PolarHBondContact O-N 3.12Å; D71-G74 PolarHBondContact O-N 3.35Å; D71-G74 VanDerWaalsContact O-N 3.09Å; K72-G74 PolarHBondContact O-N 3.25Å
75	F	97.9	Very high	97.4	Very high	38 Å²	38	52 Å²	52	17%	0.167	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.2	176.6	-68.5	-80.8	0	0	0	114.1	Y67 D71 K72 R73 K77 L78 V79 P174 V179 V182	Y67-F75 HydrophobicContact CD1-CE2 4.01Å; Y67-F75 HydrophobicContact CE1-CE2 4.02Å; Y67-F75 HydrophobicContact CE1-CZ 4.17Å; D71-F75 WeakPolarHBondContact O-CD2 3.47Å; K72-F75 WeakPolarHBondContact O-CB 3.49Å; K72-F75 PolarHBondContact O-N 3.11Å; R73-F75 PolarHBondContact O-N 3.39Å; F75-K77 PolarHBondContact O-N 2.8Å; F75-L78 HydrophobicContact CD1-CD1 3.81Å; F75-L78 HydrophobicContact CE1-CD1 4.35Å; F75-L78 WeakPolarHBondContact O-CB 3.46Å; F75-L78 PolarHBondContact O-N 2.93Å; F75-V79 WeakPolarHBondContact O-CG2 3.25Å; F75-V79 PolarHBondContact O-N 2.66Å; F75-P174 HydrophobicContact CB-CB 4.44Å; F75-P174 HydrophobicContact CB-CG 4.36Å; F75-V179 HydrophobicContact CB-CG2 4.45Å; F75-V179 HydrophobicContact CD2-CB 4.48Å; F75-V179 HydrophobicContact CD2-CG1 4.13Å; F75-V179 HydrophobicContact CD2-CG2 3.69Å; F75-V179 HydrophobicContact CE1-CG1 4.39Å; F75-V179 HydrophobicContact CE2-CG1 3.8Å; F75-V179 HydrophobicContact CE2-CG2 4.15Å; F75-V179 HydrophobicContact CG-CG2 4.11Å; F75-V179 HydrophobicContact CZ-CG1 3.94Å; F75-V182 HydrophobicContact CD1-CG1 3.63Å; F75-V182 HydrophobicContact CE1-CG1 4.18Å; F75-V182 HydrophobicContact CG-CG1 4.44Å
76	T	98.1	Very high	97.8	Very high	20 Å²	20	46.8 Å²	46.8	12%	0.123	25%	0.245	C	C	.	.	H	α-helix	trans	-55.7	-50.9	-174.4	-50.7	0	0	0	0	112	R73 L78 V79 Y80 Y172 P174	R73-T76 VanDerWaalsContact O-CB 3.27Å; R73-T76 WeakPolarHBondContact O-CB 3.36Å; R73-T76 PolarHBondContact O-N 3.49Å; R73-T76 VanDerWaalsContact O-N 3.15Å; R73-T76 PolarHBondContact O-OG1 3.05Å; T76-L78 VanDerWaalsContact C-N 3.31Å; T76-L78 PolarHBondContact O-N 3.21Å; T76-V79 PolarHBondContact O-N 2.86Å; T76-Y80 HydrophobicContact CG2-CD2 4.39Å; T76-Y80 HydrophobicContact CG2-CE1 4.17Å; T76-Y80 HydrophobicContact CG2-CE2 3.59Å; T76-Y80 VanDerWaalsContact CG2-CZ 3.47Å; T76-Y80 WeakPolarHBondContact CG2-OH 3.33Å; T76-Y80 PolarHBondContact O-N 2.94Å; T76-Y172 HydrophobicContact CG2-CD1 3.9Å; T76-Y172 HydrophobicContact CG2-CE1 4.17Å; T76-P174 VanDerWaalsContact OG1-CD 3.32Å; T76-P174 WeakPolarHBondContact OG1-CD 3.29Å
77	K	97.7	Very high	98	Very high	92 Å²	92	46.4 Å²	46.4	40%	0.4	24%	0.241	S	C	.	.	H	α-helix	trans	-55.8	-46	175.8	175.7	177	170.8	175.4	0	111.6	F75 V79 Y80 Q81 E119 V121	F75-K77 PolarHBondContact O-N 2.8Å; K77-V79 VanDerWaalsContact C-N 3.31Å; K77-V79 PolarHBondContact O-N 2.87Å; K77-Y80 PolarHBondContact O-N 3.4Å; K77-Q81 HydrophobicContact CG-CG 4.33Å; K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.33Å; K77-Q81 PolarHBondContact O-N 3.32Å; K77-E119 PolarHBondContact NZ-O 3.04Å; K77-E119 VanDerWaalsContact NZ-O 3.09Å; K77-V121 WeakPolarHBondContact CE-O 3.5Å; K77-V121 WeakPolarHBondContact CG-O 3.33Å
78	L	98.1	Very high	98.1	Very high	45 Å²	45	46 Å²	46	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-37.1	-177.3	-64.8	170	0	0	0	111.9	F75 T76 Q81 N82 V182 V184	F75-L78 HydrophobicContact CD1-CD1 3.81Å; F75-L78 HydrophobicContact CE1-CD1 4.35Å; F75-L78 WeakPolarHBondContact O-CB 3.46Å; F75-L78 PolarHBondContact O-N 2.93Å; T76-L78 VanDerWaalsContact C-N 3.31Å; T76-L78 PolarHBondContact O-N 3.21Å; L78-Q81 PolarHBondContact O-N 2.82Å; L78-N82 WeakPolarHBondContact O-CB 3.44Å; L78-N82 PolarHBondContact O-N 2.85Å; L78-N82 PolarHBondContact O-ND2 2.66Å; L78-V182 HydrophobicContact CB-CG2 3.59Å; L78-V184 HydrophobicContact CD1-CG2 3.72Å; L78-V184 HydrophobicContact CD2-CG2 4.08Å; L78-V184 HydrophobicContact CG-CG2 4.41Å
79	V	98.6	Very high	98.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-48	174.2	171.5	0	0	0	0	110.4	F75 T76 K77 Q81 N82 I83 Y160 V167 Y172 D178 V182	F75-V79 WeakPolarHBondContact O-CG2 3.25Å; F75-V79 PolarHBondContact O-N 2.66Å; T76-V79 PolarHBondContact O-N 2.86Å; K77-V79 VanDerWaalsContact C-N 3.31Å; K77-V79 PolarHBondContact O-N 2.87Å; V79-Q81 PolarHBondContact O-N 2.96Å; V79-N82 WeakPolarHBondContact O-CB 3.42Å; V79-N82 PolarHBondContact O-N 3.26Å; V79-I83 HydrophobicContact CG1-CD1 4.14Å; V79-I83 WeakPolarHBondContact O-CG1 3.22Å; V79-I83 PolarHBondContact O-N 3.23Å; V79-Y160 HydrophobicContact CB-CE1 4.45Å; V79-Y160 HydrophobicContact CG1-CD1 3.82Å; V79-Y160 HydrophobicContact CG1-CE1 3.58Å; V79-Y160 HydrophobicContact CG2-CE1 4.13Å; V79-V167 HydrophobicContact CG1-CG1 3.9Å; V79-Y172 HydrophobicContact CG1-CE1 4.29Å; V79-D178 HydrophobicContact CG2-CB 4.29Å; V79-V182 HydrophobicContact CG2-CB 4.3Å; V79-V182 HydrophobicContact CG2-CG2 4.16Å
80	Y	98.6	Very high	98.2	Very high	21 Å²	21	40.6 Å²	40.6	8%	0.082	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-46.3	177.6	-56.8	-24.7	0	0	0	111.6	T76 K77 N82 I83 F84 F124 V167 Y172	T76-Y80 HydrophobicContact CG2-CD2 4.39Å; T76-Y80 HydrophobicContact CG2-CE1 4.17Å; T76-Y80 HydrophobicContact CG2-CE2 3.59Å; T76-Y80 VanDerWaalsContact CG2-CZ 3.47Å; T76-Y80 WeakPolarHBondContact CG2-OH 3.33Å; T76-Y80 PolarHBondContact O-N 2.94Å; K77-Y80 PolarHBondContact O-N 3.4Å; Y80-N82 VanDerWaalsContact C-N 3.3Å; Y80-N82 PolarHBondContact O-N 3.16Å; Y80-I83 WeakPolarHBondContact O-CB 3.39Å; Y80-I83 PolarHBondContact O-N 2.71Å; Y80-I83 VanDerWaalsContact O-N 3.13Å; Y80-F84 VanDerWaalsContact O-CD2 3.31Å; Y80-F84 WeakPolarHBondContact O-CD2 3.3Å; Y80-F84 PolarHBondContact O-N 2.85Å; Y80-F124 HydrophobicContact CD1-CB 3.46Å; Y80-F124 VanDerWaalsContact CD1-CB 3.46Å; Y80-F124 HydrophobicContact CD1-CD1 4.41Å; Y80-F124 HydrophobicContact CD1-CG 4.02Å; Y80-F124 HydrophobicContact CD2-CB 3.95Å; Y80-F124 HydrophobicContact CE1-CB 3.49Å; Y80-F124 VanDerWaalsContact CE1-CB 3.49Å; Y80-F124 HydrophobicContact CE1-CD1 4.41Å; Y80-F124 HydrophobicContact CE1-CG 4.25Å; Y80-F124 HydrophobicContact CE2-CB 3.97Å; Y80-F124 HydrophobicContact CG-CB 3.69Å; Y80-F124 HydrophobicContact CG-CG 4.48Å; Y80-V167 HydrophobicContact CD1-CG1 3.92Å; Y80-V167 HydrophobicContact CE1-CG1 3.69Å; Y80-V167 WeakPolarHBondContact CE1-O 3.21Å; Y80-Y172 AromaticContact CE1-CD1 3.83Å; Y80-Y172 HydrophobicContact CE1-CD1 3.83Å; Y80-Y172 HydrophobicContact CE1-CE1 4.02Å
81	Q	98.6	Very high	98.3	Very high	17 Å²	17	32.9 Å²	32.9	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-56.9	-44.7	175.9	-70.4	-178.3	-48.7	0	0	111.8	K77 L78 V79 I83 F84 T85 V118 E119 V121	K77-Q81 HydrophobicContact CG-CG 4.33Å; K77-Q81 VanDerWaalsContact O-CG 3.31Å; K77-Q81 WeakPolarHBondContact O-CG 3.33Å; K77-Q81 PolarHBondContact O-N 3.32Å; L78-Q81 PolarHBondContact O-N 2.82Å; V79-Q81 PolarHBondContact O-N 2.96Å; Q81-I83 VanDerWaalsContact C-N 3.33Å; Q81-I83 PolarHBondContact O-N 2.93Å; Q81-F84 PolarHBondContact O-N 2.98Å; Q81-T85 WeakPolarHBondContact O-CB 3.43Å; Q81-T85 PolarHBondContact O-N 3.23Å; Q81-T85 PolarHBondContact O-OG1 3.18Å; Q81-V118 HydrophobicContact CB-CG1 3.75Å; Q81-V118 HydrophobicContact CG-CG1 4.01Å; Q81-V118 WeakPolarHBondContact CG-O 3.05Å; Q81-V118 PolarHBondContact NE2-O 3.06Å; Q81-E119 PolarHBondContact NE2-O 3.27Å; Q81-V121 HydrophobicContact CG-CB 4.1Å; Q81-V121 HydrophobicContact CG-CG1 4.44Å
82	N	98.6	Very high	98.3	Very high	25 Å²	25	37.5 Å²	37.5	13%	0.134	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-40.7	176.9	-87.8	-130.5	0	0	0	112.2	L78 V79 Y80 A86 R183	L78-N82 WeakPolarHBondContact O-CB 3.44Å; L78-N82 PolarHBondContact O-N 2.85Å; L78-N82 PolarHBondContact O-ND2 2.66Å; V79-N82 WeakPolarHBondContact O-CB 3.42Å; V79-N82 PolarHBondContact O-N 3.26Å; Y80-N82 VanDerWaalsContact C-N 3.3Å; Y80-N82 PolarHBondContact O-N 3.16Å; N82-A86 VanDerWaalsContact O-CB 3.29Å; N82-A86 WeakPolarHBondContact O-CB 3.49Å; N82-A86 PolarHBondContact O-N 2.73Å; N82-R183 PolarHBondContact ND2-O 3.17Å; N82-R183 VanDerWaalsContact OD1-CB 3.32Å; N82-R183 WeakPolarHBondContact OD1-CB 3.39Å; N82-R183 PolarHBondContact OD1-N 2.9Å
83	I	98.8	Very high	98.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-49.3	176.4	-71.9	168	0	0	0	111	V79 Y80 Q81 A86 M87 F124 I132 Y160 L161 L164 V167	V79-I83 HydrophobicContact CG1-CD1 4.14Å; V79-I83 WeakPolarHBondContact O-CG1 3.22Å; V79-I83 PolarHBondContact O-N 3.23Å; Y80-I83 WeakPolarHBondContact O-CB 3.39Å; Y80-I83 PolarHBondContact O-N 2.71Å; Y80-I83 VanDerWaalsContact O-N 3.13Å; Q81-I83 VanDerWaalsContact C-N 3.33Å; Q81-I83 PolarHBondContact O-N 2.93Å; I83-A86 PolarHBondContact O-N 3.38Å; I83-M87 PolarHBondContact O-N 3.04Å; I83-F124 HydrophobicContact CG2-CE2 4.01Å; I83-F124 HydrophobicContact CG2-CZ 3.99Å; I83-I132 HydrophobicContact CG2-CD1 4.19Å; I83-I132 HydrophobicContact CG2-CG2 4.21Å; I83-Y160 HydrophobicContact CG1-CG 4.23Å; I83-L161 HydrophobicContact CG2-CD2 3.92Å; I83-L164 HydrophobicContact CD1-CD2 4.35Å; I83-L164 HydrophobicContact CG2-CD2 4.27Å; I83-V167 HydrophobicContact CD1-CB 4.34Å; I83-V167 HydrophobicContact CD1-CG1 3.59Å
84	F	98.7	Very high	98.4	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-46	177.5	-81.5	-79.5	0	0	0	111.6	Y80 Q81 A86 M87 Q88 V113 V116 V118 V121 F124 Y128 I132	Y80-F84 VanDerWaalsContact O-CD2 3.31Å; Y80-F84 WeakPolarHBondContact O-CD2 3.3Å; Y80-F84 PolarHBondContact O-N 2.85Å; Q81-F84 PolarHBondContact O-N 2.98Å; F84-A86 VanDerWaalsContact C-N 3.31Å; F84-A86 PolarHBondContact O-N 3.03Å; F84-M87 PolarHBondContact O-N 2.98Å; F84-Q88 VanDerWaalsContact O-CB 3.31Å; F84-Q88 WeakPolarHBondContact O-CB 3.49Å; F84-Q88 VanDerWaalsContact O-CG 3.25Å; F84-Q88 WeakPolarHBondContact O-CG 3.34Å; F84-Q88 PolarHBondContact O-N 3.13Å; F84-V113 HydrophobicContact CD1-CG1 4.14Å; F84-V116 HydrophobicContact CD1-CB 4.05Å; F84-V116 HydrophobicContact CD1-CG1 3.89Å; F84-V116 HydrophobicContact CD1-CG2 4.11Å; F84-V116 HydrophobicContact CE1-CB 4.21Å; F84-V116 HydrophobicContact CE1-CG1 4.03Å; F84-V116 HydrophobicContact CE1-CG2 3.8Å; F84-V116 HydrophobicContact CG-CG1 4.28Å; F84-V118 HydrophobicContact CB-CG2 4.05Å; F84-V121 HydrophobicContact CD2-CB 4.42Å; F84-V121 HydrophobicContact CD2-CG1 3.79Å; F84-V121 HydrophobicContact CD2-CG2 3.8Å; F84-V121 HydrophobicContact CE2-CG1 3.79Å; F84-V121 HydrophobicContact CE2-CG2 4.04Å; F84-V121 HydrophobicContact CG-CG2 4.26Å; F84-F124 AromaticContact CE2-CD2 3.76Å; F84-F124 HydrophobicContact CE2-CD2 3.76Å; F84-F124 HydrophobicContact CE2-CE2 4.14Å; F84-F124 HydrophobicContact CZ-CD2 4.17Å; F84-F124 HydrophobicContact CZ-CE2 4.31Å; F84-Y128 AromaticContact CE1-CD1 3.81Å; F84-Y128 HydrophobicContact CE1-CD1 3.81Å; F84-Y128 AromaticContact CE1-CG 3.9Å; F84-Y128 HydrophobicContact CE1-CG 3.9Å; F84-Y128 HydrophobicContact CZ-CD1 4.11Å; F84-Y128 HydrophobicContact CZ-CD2 4.2Å; F84-Y128 AromaticContact CZ-CG 3.71Å; F84-Y128 HydrophobicContact CZ-CG 3.71Å; F84-I132 HydrophobicContact CD1-CD1 4.03Å; F84-I132 HydrophobicContact CE1-CD1 3.79Å; F84-I132 HydrophobicContact CZ-CD1 4.17Å
85	T	98.4	Very high	98.4	Very high	74 Å²	74	30.2 Å²	30.2	45%	0.454	15%	0.15	S	C	.	.	H	α-helix	trans	-57.3	-44.9	176.3	-59.7	0	0	0	0	111.6	Q81 Q88 A89 V118	Q81-T85 WeakPolarHBondContact O-CB 3.43Å; Q81-T85 PolarHBondContact O-N 3.23Å; Q81-T85 PolarHBondContact O-OG1 3.18Å; T85-Q88 PolarHBondContact O-N 3.17Å; T85-A89 WeakPolarHBondContact O-CB 3.3Å; T85-A89 PolarHBondContact O-N 3.1Å; T85-V118 WeakPolarHBondContact OG1-CG1 3.38Å
86	A	98.6	Very high	98.3	Very high	6 Å²	6	33.9 Å²	33.9	5%	0.05	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-46.6	179.8	0	0	0	0	0	112	N82 I83 F84 A89 M90 L153 T157	N82-A86 VanDerWaalsContact O-CB 3.29Å; N82-A86 WeakPolarHBondContact O-CB 3.49Å; N82-A86 PolarHBondContact O-N 2.73Å; I83-A86 PolarHBondContact O-N 3.38Å; F84-A86 VanDerWaalsContact C-N 3.31Å; F84-A86 PolarHBondContact O-N 3.03Å; A86-A89 PolarHBondContact O-N 2.92Å; A86-M90 PolarHBondContact O-N 2.85Å; A86-M90 VanDerWaalsContact O-N 3.08Å; A86-L153 HydrophobicContact CB-CD1 4.17Å; A86-T157 HydrophobicContact CB-CG2 3.79Å; A86-T157 WeakPolarHBondContact CB-OG1 3.26Å
87	M	98.8	Very high	98.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.6	-41.2	178	-173.8	55.6	70.7	0	0	111.8	I83 F84 A89 M90 I91 V113 I132 L135 W136 I141 L161	I83-M87 PolarHBondContact O-N 3.04Å; F84-M87 PolarHBondContact O-N 2.98Å; M87-A89 VanDerWaalsContact C-N 3.31Å; M87-A89 PolarHBondContact O-N 3.19Å; M87-M90 HydrophobicContact CE-CE 3.85Å; M87-M90 PolarHBondContact O-N 2.98Å; M87-M90 HydrophobicContact SD-CE 3.92Å; M87-I91 HydrophobicContact CG-CD1 3.82Å; M87-I91 HydrophobicContact CG-CG1 4.37Å; M87-I91 WeakPolarHBondContact O-CB 3.34Å; M87-I91 WeakPolarHBondContact O-CD1 3.49Å; M87-I91 VanDerWaalsContact O-CG1 3.26Å; M87-I91 WeakPolarHBondContact O-CG1 3.26Å; M87-I91 PolarHBondContact O-N 2.87Å; M87-I91 HydrophobicContact SD-CD1 4.37Å; M87-I91 HydrophobicContact SD-CG1 4.34Å; M87-V113 HydrophobicContact CB-CG1 4.12Å; M87-V113 HydrophobicContact CG-CG1 3.8Å; M87-I132 HydrophobicContact CE-CG2 4.02Å; M87-I132 HydrophobicContact CG-CG1 4.26Å; M87-L135 HydrophobicContact CE-CB 3.85Å; M87-L135 HydrophobicContact CG-CD1 4.06Å; M87-L135 HydrophobicContact SD-CB 3.82Å; M87-L135 HydrophobicContact SD-CD1 4.05Å; M87-W136 HydrophobicContact CE-CB 4.15Å; M87-I141 HydrophobicContact SD-CD1 4.47Å; M87-L161 HydrophobicContact CE-CD1 4.05Å
88	Q	98.8	Very high	98.4	Very high	20 Å²	20	38.9 Å²	38.9	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-37.6	174.7	-74.1	-177	-7.5	0	0	112.4	F84 T85 R92 V113 V116	F84-Q88 VanDerWaalsContact O-CB 3.31Å; F84-Q88 WeakPolarHBondContact O-CB 3.49Å; F84-Q88 VanDerWaalsContact O-CG 3.25Å; F84-Q88 WeakPolarHBondContact O-CG 3.34Å; F84-Q88 PolarHBondContact O-N 3.13Å; T85-Q88 PolarHBondContact O-N 3.17Å; Q88-R92 VanDerWaalsContact O-CG 3.31Å; Q88-R92 WeakPolarHBondContact O-CG 3.24Å; Q88-R92 PolarHBondContact O-N 2.79Å; Q88-V113 HydrophobicContact CG-CG1 4.23Å; Q88-V113 PolarHBondContact NE2-O 3.06Å; Q88-V116 PolarHBondContact NE2-O 2.84Å
89	A	98.4	Very high	98.4	Very high	25 Å²	25	37.2 Å²	37.2	21%	0.207	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-46.7	174.9	0	0	0	0	0	111.4	T85 A86 M87 R92 A93 L153	T85-A89 WeakPolarHBondContact O-CB 3.3Å; T85-A89 PolarHBondContact O-N 3.1Å; A86-A89 PolarHBondContact O-N 2.92Å; M87-A89 VanDerWaalsContact C-N 3.31Å; M87-A89 PolarHBondContact O-N 3.19Å; A89-R92 PolarHBondContact O-N 3.06Å; A89-A93 WeakPolarHBondContact O-CB 3.27Å; A89-A93 PolarHBondContact O-N 3.46Å; A89-L153 HydrophobicContact CB-CD1 4.07Å
90	M	98.7	Very high	98.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-41.9	176.6	-66.6	-172.6	-65.6	0	0	112.3	A86 M87 R92 A93 M94 W136 I141 Y145 Y151 L153 T157 L161	A86-M90 PolarHBondContact O-N 2.85Å; A86-M90 VanDerWaalsContact O-N 3.08Å; M87-M90 HydrophobicContact CE-CE 3.85Å; M87-M90 PolarHBondContact O-N 2.98Å; M87-M90 HydrophobicContact SD-CE 3.92Å; M90-R92 VanDerWaalsContact C-N 3.31Å; M90-R92 PolarHBondContact O-N 3.09Å; M90-A93 PolarHBondContact O-N 2.82Å; M90-A93 VanDerWaalsContact O-N 3.15Å; M90-M94 VanDerWaalsContact O-CG 3.27Å; M90-M94 WeakPolarHBondContact O-CG 3.35Å; M90-M94 PolarHBondContact O-N 3.37Å; M90-W136 HydrophobicContact CE-CE3 3.94Å; M90-W136 HydrophobicContact CE-CZ3 3.86Å; M90-W136 HydrophobicContact SD-CE3 4.46Å; M90-W136 HydrophobicContact SD-CZ3 3.87Å; M90-I141 HydrophobicContact CB-CD1 4.46Å; M90-I141 HydrophobicContact CE-CG2 4.29Å; M90-I141 HydrophobicContact SD-CG2 4.33Å; M90-Y145 HydrophobicContact SD-CD2 4.09Å; M90-Y151 HydrophobicContact CG-CE2 4.21Å; M90-L153 HydrophobicContact CG-CD1 3.89Å; M90-L153 HydrophobicContact CG-CD2 4.06Å; M90-L153 HydrophobicContact SD-CD2 4.09Å; M90-T157 HydrophobicContact CE-CG2 4.03Å; M90-T157 HydrophobicContact SD-CG2 4.31Å; M90-L161 HydrophobicContact CE-CD1 3.45Å; M90-L161 VanDerWaalsContact CE-CD1 3.45Å
91	I	98.7	Very high	98.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-42.1	175.8	-72.5	162.6	0	0	0	111.4	M87 M94 A110 V113 R114 L135	M87-I91 HydrophobicContact CG-CD1 3.82Å; M87-I91 HydrophobicContact CG-CG1 4.37Å; M87-I91 WeakPolarHBondContact O-CB 3.34Å; M87-I91 WeakPolarHBondContact O-CD1 3.49Å; M87-I91 VanDerWaalsContact O-CG1 3.26Å; M87-I91 WeakPolarHBondContact O-CG1 3.26Å; M87-I91 PolarHBondContact O-N 2.87Å; M87-I91 HydrophobicContact SD-CD1 4.37Å; M87-I91 HydrophobicContact SD-CG1 4.34Å; I91-M94 WeakPolarHBondContact O-CB 3.42Å; I91-A110 HydrophobicContact CD1-CB 4.13Å; I91-A110 HydrophobicContact CG1-CB 4.1Å; I91-A110 HydrophobicContact CG2-CB 4.17Å; I91-V113 HydrophobicContact CD1-CB 3.93Å; I91-V113 HydrophobicContact CD1-CG1 3.9Å; I91-R114 HydrophobicContact CG2-CB 4.43Å; I91-R114 VanDerWaalsContact CG2-NH2 3.34Å; I91-L135 HydrophobicContact CD1-CD1 4.13Å
92	R	98.3	Very high	98.3	Very high	150 Å²	150	47.8 Å²	47.8	57%	0.566	24%	0.244	S	C	*	.	H	α-helix	trans	-68.9	-40.6	175.9	-69.2	175.1	-169	-156	4	111.5	Q88 A89 M90 M94 D95 T96	Q88-R92 VanDerWaalsContact O-CG 3.31Å; Q88-R92 WeakPolarHBondContact O-CG 3.24Å; Q88-R92 PolarHBondContact O-N 2.79Å; A89-R92 PolarHBondContact O-N 3.06Å; M90-R92 VanDerWaalsContact C-N 3.31Å; M90-R92 PolarHBondContact O-N 3.09Å; R92-M94 VanDerWaalsContact C-N 3.32Å; R92-M94 PolarHBondContact O-N 3.5Å; R92-D95 WeakPolarHBondContact O-CB 3.24Å; R92-D95 PolarHBondContact O-N 3.13Å; R92-T96 PolarHBondContact O-N 3.39Å; R92-T96 PolarHBondContact O-OG1 3.09Å
93	A	98.2	Very high	98.3	Very high	6 Å²	6	51.3 Å²	51.3	5%	0.05	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-35.1	177.6	0	0	0	0	0	112.4	A89 M90 D95 T96 L97 C144 Y151	A89-A93 WeakPolarHBondContact O-CB 3.27Å; A89-A93 PolarHBondContact O-N 3.46Å; M90-A93 PolarHBondContact O-N 2.82Å; M90-A93 VanDerWaalsContact O-N 3.15Å; A93-D95 VanDerWaalsContact C-N 3.28Å; A93-D95 PolarHBondContact O-N 3.41Å; A93-T96 PolarHBondContact O-N 3.46Å; A93-L97 VanDerWaalsContact O-CB 3.29Å; A93-L97 WeakPolarHBondContact O-CB 3.31Å; A93-L97 VanDerWaalsContact O-CG 3.26Å; A93-L97 WeakPolarHBondContact O-CG 3.33Å; A93-L97 PolarHBondContact O-N 2.97Å; A93-C144 VanDerWaalsContact CB-SG 3.56Å; A93-Y151 HydrophobicContact CB-CD1 3.56Å; A93-Y151 HydrophobicContact CB-CD2 3.65Å; A93-Y151 HydrophobicContact CB-CE1 3.66Å; A93-Y151 HydrophobicContact CB-CE2 3.74Å; A93-Y151 HydrophobicContact CB-CG 3.56Å
94	M	98.4	Very high	98.3	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-53.8	-45.5	171.6	-71.2	-78.3	-75.5	0	0	111.6	M90 I91 R92 K98 I99 Y101 G140 I141 C144	M90-M94 VanDerWaalsContact O-CG 3.27Å; M90-M94 WeakPolarHBondContact O-CG 3.35Å; M90-M94 PolarHBondContact O-N 3.37Å; I91-M94 WeakPolarHBondContact O-CB 3.42Å; R92-M94 VanDerWaalsContact C-N 3.32Å; R92-M94 PolarHBondContact O-N 3.5Å; M94-K98 WeakPolarHBondContact O-CA 3.32Å; M94-K98 PolarHBondContact O-N 3.28Å; M94-I99 HydrophobicContact CE-CB 4.15Å; M94-I99 HydrophobicContact CE-CG2 3.88Å; M94-I99 WeakPolarHBondContact CE-O 3.45Å; M94-I99 PolarHBondContact O-N 3.04Å; M94-I99 HydrophobicContact SD-CB 3.63Å; M94-I99 HydrophobicContact SD-CG2 3.62Å; M94-Y101 HydrophobicContact CE-CD1 3.93Å; M94-Y101 HydrophobicContact CE-CD2 4.46Å; M94-Y101 HydrophobicContact CE-CE1 3.98Å; M94-Y101 HydrophobicContact CE-CE2 4.49Å; M94-Y101 HydrophobicContact CE-CG 4.16Å; M94-G140 VanDerWaalsContact SD-C 3.52Å; M94-I141 HydrophobicContact CE-CD1 4.41Å; M94-I141 HydrophobicContact CG-CD1 3.73Å; M94-I141 HydrophobicContact SD-CD1 4.11Å; M94-C144 HydrophobicContact CG-CB 4.1Å; M94-C144 HydrophobicContact SD-CB 3.54Å; M94-C144 VanDerWaalsContact SD-CB 3.54Å
95	D	97.5	Very high	98.2	Very high	92 Å²	92	62.1 Å²	62.1	49%	0.492	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-45.2	178.5	-58.1	-40.9	0	0	0	111.1	R92 A93 K98 R114	R92-D95 WeakPolarHBondContact O-CB 3.24Å; R92-D95 PolarHBondContact O-N 3.13Å; A93-D95 VanDerWaalsContact C-N 3.28Å; A93-D95 PolarHBondContact O-N 3.41Å; D95-K98 PolarHBondContact O-N 3.5Å; D95-R114 IonicContact OD1-NH2 3.39Å; D95-R114 PolarHBondContact OD1-NH2 2.99Å; D95-R114 IonicContact OD2-CZ 3.38Å; D95-R114 IonicContact OD2-NH2 3.73Å; D95-R114 PolarHBondContact OD2-NH2 3.31Å
96	T	96.9	Very high	98.2	Very high	114 Å²	114	58.6 Å²	58.6	70%	0.699	28%	0.284	S	S	*	.	H	α-helix	trans	-66.1	-43.9	-179.8	-56.1	0	0	0	0	112.7	R92 A93 K98	R92-T96 PolarHBondContact O-N 3.39Å; R92-T96 PolarHBondContact O-OG1 3.09Å; A93-T96 PolarHBondContact O-N 3.46Å; T96-K98 VanDerWaalsContact C-N 3.26Å; T96-K98 PolarHBondContact O-N 3.19Å
97	L	97.8	Very high	98.2	Very high	31 Å²	31	63.1 Å²	63.1	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-83.3	-4.4	-178.7	-58.9	-179.1	0	0	0	112.8	A93 I99 R147 E150 Y151	A93-L97 VanDerWaalsContact O-CB 3.29Å; A93-L97 WeakPolarHBondContact O-CB 3.31Å; A93-L97 VanDerWaalsContact O-CG 3.26Å; A93-L97 WeakPolarHBondContact O-CG 3.33Å; A93-L97 PolarHBondContact O-N 2.97Å; L97-I99 VanDerWaalsContact C-N 3.3Å; L97-I99 HydrophobicContact CB-CD1 3.8Å; L97-I99 HydrophobicContact CB-CG1 3.86Å; L97-I99 HydrophobicContact CD1-CD1 4.03Å; L97-I99 PolarHBondContact O-N 3.28Å; L97-R147 HydrophobicContact CD1-CB 4.07Å; L97-E150 HydrophobicContact CD2-CB 4.31Å; L97-E150 WeakPolarHBondContact CD2-OE2 3.47Å; L97-Y151 HydrophobicContact CD1-CD1 4.18Å; L97-Y151 HydrophobicContact CD1-CE1 4.18Å
98	K	98.2	Very high	98.2	Very high	187 Å²	187	66.3 Å²	66.3	81%	0.813	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	40.3	-178.6	-55.5	-174.8	-179.5	-180	0	113.2	M94 D95 T96	M94-K98 WeakPolarHBondContact O-CA 3.32Å; M94-K98 PolarHBondContact O-N 3.28Å; D95-K98 PolarHBondContact O-N 3.5Å; T96-K98 VanDerWaalsContact C-N 3.26Å; T96-K98 PolarHBondContact O-N 3.19Å
99	I	98.4	Very high	98.2	Very high	9 Å²	9	67.7 Å²	67.7	5%	0.046	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-90.9	120.7	177.5	-56.5	170.7	0	0	0	107.8	M94 L97 G140 E143 C144	M94-I99 HydrophobicContact CE-CB 4.15Å; M94-I99 HydrophobicContact CE-CG2 3.88Å; M94-I99 WeakPolarHBondContact CE-O 3.45Å; M94-I99 PolarHBondContact O-N 3.04Å; M94-I99 HydrophobicContact SD-CB 3.63Å; M94-I99 HydrophobicContact SD-CG2 3.62Å; L97-I99 VanDerWaalsContact C-N 3.3Å; L97-I99 HydrophobicContact CB-CD1 3.8Å; L97-I99 HydrophobicContact CB-CG1 3.86Å; L97-I99 HydrophobicContact CD1-CD1 4.03Å; L97-I99 PolarHBondContact O-N 3.28Å; I99-G140 WeakPolarHBondContact CG2-O 3.48Å; I99-E143 HydrophobicContact CD1-CG 4.26Å; I99-E143 HydrophobicContact CG2-CB 4.39Å; I99-C144 HydrophobicContact CD1-CB 3.88Å
100	P	98	Very high	98.2	Very high	99 Å²	99	66.6 Å²	66.6	64%	0.643	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-77.6	147.4	177.7	31.4	-33.7	0	0	0	111.3	K102	P100-K102 PolarHBondContact O-N 3.23Å
101	Y	98.6	Very high	98.2	Very high	30 Å²	30	70.3 Å²	70.3	12%	0.118	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-63	135	164	-61.8	-82.7	0	0	0	109.5	M94 N106 K107 A110 L135 I141	M94-Y101 HydrophobicContact CE-CD1 3.93Å; M94-Y101 HydrophobicContact CE-CD2 4.46Å; M94-Y101 HydrophobicContact CE-CE1 3.98Å; M94-Y101 HydrophobicContact CE-CE2 4.49Å; M94-Y101 HydrophobicContact CE-CG 4.16Å; Y101-N106 HydrophobicContact CD1-CB 3.85Å; Y101-N106 HydrophobicContact CG-CB 4.28Å; Y101-K107 HydrophobicContact CD2-CG 3.86Å; Y101-K107 HydrophobicContact CG-CG 4.47Å; Y101-A110 HydrophobicContact CE1-CB 3.98Å; Y101-A110 HydrophobicContact CE2-CB 4.26Å; Y101-A110 WeakPolarHBondContact OH-CB 3.45Å; Y101-L135 HydrophobicContact CD1-CD2 4.2Å; Y101-L135 HydrophobicContact CE1-CD2 3.7Å; Y101-I141 HydrophobicContact CD1-CG1 4.41Å; Y101-I141 HydrophobicContact CE1-CD1 4Å; Y101-I141 HydrophobicContact CE1-CG1 4.12Å
102	K	98.5	Very high	98.2	Very high	131 Å²	131	72.7 Å²	72.7	57%	0.57	36%	0.356	S	S	*	.	S	Bend	trans	-69.1	-39.6	174.2	-176.9	178.5	-177.8	179.2	0	111.2	P100 D138 P139	P100-K102 PolarHBondContact O-N 3.23Å; K102-D138 PolarHBondContact N-OD1 3.28Å; K102-D138 PolarHBondContact N-OD2 3.31Å; K102-P139 HydrophobicContact CB-CB 4.42Å; K102-P139 HydrophobicContact CB-CG 4.43Å; K102-P139 HydrophobicContact CD-CB 3.87Å; K102-P139 HydrophobicContact CD-CG 3.38Å
103	Y	98.3	Very high	98.2	Very high	99 Å²	99	65.5 Å²	65.5	39%	0.388	33%	0.329	S	S	.	.	S	Bend	trans	-103.6	124.8	-177.4	-53.7	-66.7	0	0	0	111.1	H105 N106 D138	Y103-H105 VanDerWaalsContact C-N 3.28Å; Y103-H105 WeakPolarHBondContact CB-CE1 3.48Å; Y103-H105 AromaticContact CG-CE1 3.96Å; Y103-H105 PolarHBondContact O-N 3.03Å; Y103-N106 WeakPolarHBondContact O-CB 3.27Å; Y103-N106 PolarHBondContact O-N 3.43Å; Y103-D138 HydrophobicContact CD2-CB 4.42Å; Y103-D138 WeakPolarHBondContact CD2-OD2 3.42Å; Y103-D138 PolarHBondContact N-OD2 2.86Å; Y103-D138 VanDerWaalsContact N-OD2 3.09Å
104	E	97.5	Very high	98.2	Very high	129 Å²	129	68.9 Å²	68.9	60%	0.603	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-36.1	-172.8	-171.8	61.6	-158.9	0	0	113	N106 K107	E104-N106 PolarHBondContact O-N 3.31Å; E104-K107 WeakPolarHBondContact O-CB 3.15Å; E104-K107 PolarHBondContact O-N 3.14Å; E104-K107 WeakPolarHBondContact OE1-CD 3.2Å; E104-K107 WeakPolarHBondContact OE1-CE 3.27Å; E104-K107 IonicContact OE1-NZ 2.75Å; E104-K107 PolarHBondContact OE1-NZ 3.05Å; E104-K107 VanDerWaalsContact OE2-CE 3.23Å; E104-K107 WeakPolarHBondContact OE2-CE 3.35Å; E104-K107 IonicContact OE2-NZ 2.72Å; E104-K107 PolarHBondContact OE2-NZ 3.24Å
105	H	97.9	Very high	98.2	Very high	101 Å²	101	75.4 Å²	75.4	47%	0.468	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.7	178.4	66	-83.5	0	0	0	113.1	Y103 K107 A108 H109 S134	Y103-H105 VanDerWaalsContact C-N 3.28Å; Y103-H105 WeakPolarHBondContact CB-CE1 3.48Å; Y103-H105 AromaticContact CG-CE1 3.96Å; Y103-H105 PolarHBondContact O-N 3.03Å; H105-K107 PolarHBondContact O-N 3.26Å; H105-A108 PolarHBondContact O-N 3.39Å; H105-A108 VanDerWaalsContact O-N 3.12Å; H105-H109 AromaticContact CD2-CD2 3.62Å; H105-H109 AromaticContact CD2-NE2 3.65Å; H105-H109 PolarHBondContact O-N 2.94Å; H105-S134 PolarHBondContact NE2-OG 3.48Å
106	N	98.7	Very high	98.2	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-67.7	-17.3	176.5	-81.5	-28.3	0	0	0	113.1	Y101 Y103 E104 A108 H109 A110 S134 L135 D138	Y101-N106 HydrophobicContact CD1-CB 3.85Å; Y101-N106 HydrophobicContact CG-CB 4.28Å; Y103-N106 WeakPolarHBondContact O-CB 3.27Å; Y103-N106 PolarHBondContact O-N 3.43Å; E104-N106 PolarHBondContact O-N 3.31Å; N106-A108 VanDerWaalsContact C-N 3.32Å; N106-A108 PolarHBondContact O-N 2.99Å; N106-H109 PolarHBondContact O-N 3.25Å; N106-H109 PolarHBondContact OD1-CD2 3.09Å; N106-A110 VanDerWaalsContact O-CB 3.24Å; N106-A110 WeakPolarHBondContact O-CB 3.23Å; N106-A110 PolarHBondContact O-N 2.72Å; N106-S134 PolarHBondContact ND2-O 2.85Å; N106-S134 VanDerWaalsContact ND2-O 3.13Å; N106-S134 WeakPolarHBondContact OD1-CB 3.35Å; N106-S134 PolarHBondContact OD1-O 3.43Å; N106-S134 PolarHBondContact OD1-OG 2.75Å; N106-L135 HydrophobicContact CB-CD2 3.95Å; N106-D138 WeakPolarHBondContact ND2-CB 3.44Å; N106-D138 PolarHBondContact ND2-OD2 2.97Å
107	K	98.3	Very high	98.3	Very high	101 Å²	101	70 Å²	70	44%	0.439	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-41	169.8	-65	-179.5	-173.1	167.1	0	111.8	Y101 E104 H105 Q111	Y101-K107 HydrophobicContact CD2-CG 3.86Å; Y101-K107 HydrophobicContact CG-CG 4.47Å; E104-K107 WeakPolarHBondContact O-CB 3.15Å; E104-K107 PolarHBondContact O-N 3.14Å; E104-K107 WeakPolarHBondContact OE1-CD 3.2Å; E104-K107 WeakPolarHBondContact OE1-CE 3.27Å; E104-K107 IonicContact OE1-NZ 2.75Å; E104-K107 PolarHBondContact OE1-NZ 3.05Å; E104-K107 VanDerWaalsContact OE2-CE 3.23Å; E104-K107 WeakPolarHBondContact OE2-CE 3.35Å; E104-K107 IonicContact OE2-NZ 2.72Å; E104-K107 PolarHBondContact OE2-NZ 3.24Å; H105-K107 PolarHBondContact O-N 3.26Å; K107-Q111 PolarHBondContact O-N 3.15Å; K107-Q111 VanDerWaalsContact O-N 3.08Å
108	A	98.4	Very high	98.3	Very high	68 Å²	68	69.4 Å²	69.4	56%	0.562	34%	0.337	S	S	*	.	H	α-helix	trans	-70.7	-41.4	176.8	0	0	0	0	0	111.4	H105 N106 A110 Q111 L112	H105-A108 PolarHBondContact O-N 3.39Å; H105-A108 VanDerWaalsContact O-N 3.12Å; N106-A108 VanDerWaalsContact C-N 3.32Å; N106-A108 PolarHBondContact O-N 2.99Å; A108-A110 PolarHBondContact O-N 3.5Å; A108-Q111 PolarHBondContact O-N 3.28Å; A108-L112 WeakPolarHBondContact O-CB 3.24Å; A108-L112 PolarHBondContact O-N 2.92Å
109	H	98.7	Very high	98.2	Very high	49 Å²	49	67.2 Å²	67.2	23%	0.227	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-41.9	173.7	-69.4	-42.6	0	0	0	112.4	H105 N106 Q111 L112 V113 A131 L135	H105-H109 AromaticContact CD2-CD2 3.62Å; H105-H109 AromaticContact CD2-NE2 3.65Å; H105-H109 PolarHBondContact O-N 2.94Å; N106-H109 PolarHBondContact O-N 3.25Å; N106-H109 PolarHBondContact OD1-CD2 3.09Å; H109-Q111 PolarHBondContact O-N 2.91Å; H109-L112 PolarHBondContact O-N 3.26Å; H109-V113 WeakPolarHBondContact O-CG2 3.48Å; H109-V113 PolarHBondContact O-N 3.29Å; H109-A131 HydrophobicContact CB-CB 3.82Å; H109-A131 WeakPolarHBondContact ND1-CB 3.14Å; H109-L135 HydrophobicContact CB-CD1 4.09Å; H109-L135 HydrophobicContact CB-CD2 4.36Å; H109-L135 HydrophobicContact CB-CG 3.97Å
110	A	98.7	Very high	98.1	Very high	1 Å²	1	74.2 Å²	74.2	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176.1	0	0	0	0	0	111.4	I91 Y101 N106 A108 V113 R114 L135	I91-A110 HydrophobicContact CD1-CB 4.13Å; I91-A110 HydrophobicContact CG1-CB 4.1Å; I91-A110 HydrophobicContact CG2-CB 4.17Å; Y101-A110 HydrophobicContact CE1-CB 3.98Å; Y101-A110 HydrophobicContact CE2-CB 4.26Å; Y101-A110 WeakPolarHBondContact OH-CB 3.45Å; N106-A110 VanDerWaalsContact O-CB 3.24Å; N106-A110 WeakPolarHBondContact O-CB 3.23Å; N106-A110 PolarHBondContact O-N 2.72Å; A108-A110 PolarHBondContact O-N 3.5Å; A110-V113 PolarHBondContact O-N 3.07Å; A110-R114 WeakPolarHBondContact O-CB 3.3Å; A110-R114 PolarHBondContact O-N 2.87Å; A110-L135 HydrophobicContact CB-CD2 4Å
111	Q	98.4	Very high	98.1	Very high	79 Å²	79	70 Å²	70	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.8	-171.8	61.4	20.6	0	0	111.7	K107 A108 H109 V113 R114 E115	K107-Q111 PolarHBondContact O-N 3.15Å; K107-Q111 VanDerWaalsContact O-N 3.08Å; A108-Q111 PolarHBondContact O-N 3.28Å; H109-Q111 PolarHBondContact O-N 2.91Å; Q111-V113 VanDerWaalsContact C-N 3.34Å; Q111-V113 PolarHBondContact O-N 3.48Å; Q111-R114 PolarHBondContact O-N 2.85Å; Q111-E115 PolarHBondContact NE2-OE1 3.36Å; Q111-E115 WeakPolarHBondContact O-CG 3.3Å; Q111-E115 PolarHBondContact O-N 3.19Å
112	L	98.4	Very high	97.9	Very high	49 Å²	49	73 Å²	73	26%	0.257	36%	0.357	S	S	.	.	H	α-helix	trans	-56.2	-45.3	176.5	174.2	67	0	0	0	112.2	A108 H109 P127 Y128 A131	A108-L112 WeakPolarHBondContact O-CB 3.24Å; A108-L112 PolarHBondContact O-N 2.92Å; H109-L112 PolarHBondContact O-N 3.26Å; L112-P127 HydrophobicContact CD1-CG 4.43Å; L112-P127 HydrophobicContact CD2-CB 3.98Å; L112-P127 HydrophobicContact CD2-CG 3.86Å; L112-Y128 HydrophobicContact CD1-CD1 4.42Å; L112-Y128 HydrophobicContact CD1-CE1 3.77Å; L112-Y128 HydrophobicContact CD2-CD1 4.37Å; L112-Y128 HydrophobicContact CG-CD1 4.04Å; L112-Y128 HydrophobicContact CG-CE1 3.85Å; L112-A131 HydrophobicContact CD2-CB 4.01Å
113	V	98.6	Very high	97.8	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-74.3	-36	-179.9	174.9	0	0	0	0	111.7	F84 M87 Q88 I91 H109 A110 Q111 E115 V116 A131 I132 L135	F84-V113 HydrophobicContact CD1-CG1 4.14Å; M87-V113 HydrophobicContact CB-CG1 4.12Å; M87-V113 HydrophobicContact CG-CG1 3.8Å; Q88-V113 HydrophobicContact CG-CG1 4.23Å; Q88-V113 PolarHBondContact NE2-O 3.06Å; I91-V113 HydrophobicContact CD1-CB 3.93Å; I91-V113 HydrophobicContact CD1-CG1 3.9Å; H109-V113 WeakPolarHBondContact O-CG2 3.48Å; H109-V113 PolarHBondContact O-N 3.29Å; A110-V113 PolarHBondContact O-N 3.07Å; Q111-V113 VanDerWaalsContact C-N 3.34Å; Q111-V113 PolarHBondContact O-N 3.48Å; V113-E115 VanDerWaalsContact C-N 3.28Å; V113-E115 PolarHBondContact O-N 3.29Å; V113-V116 PolarHBondContact O-N 2.59Å; V113-A131 HydrophobicContact CG2-CB 4.12Å; V113-I132 HydrophobicContact CG1-CD1 4.47Å; V113-I132 HydrophobicContact CG1-CG1 4.35Å; V113-I132 HydrophobicContact CG2-CD1 4.28Å; V113-I132 HydrophobicContact CG2-CG1 3.73Å; V113-L135 HydrophobicContact CB-CD1 4.42Å; V113-L135 HydrophobicContact CG2-CD1 3.97Å
114	R	98	Very high	97.7	Very high	77 Å²	77	64.3 Å²	64.3	29%	0.291	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-33.6	179.3	-177.5	-174.4	-73.7	152.7	-11.2	112.8	I91 D95 A110 Q111 V116	I91-R114 HydrophobicContact CG2-CB 4.43Å; I91-R114 VanDerWaalsContact CG2-NH2 3.34Å; D95-R114 IonicContact OD1-NH2 3.39Å; D95-R114 PolarHBondContact OD1-NH2 2.99Å; D95-R114 IonicContact OD2-CZ 3.38Å; D95-R114 IonicContact OD2-NH2 3.73Å; D95-R114 PolarHBondContact OD2-NH2 3.31Å; A110-R114 WeakPolarHBondContact O-CB 3.3Å; A110-R114 PolarHBondContact O-N 2.87Å; Q111-R114 PolarHBondContact O-N 2.85Å; R114-V116 VanDerWaalsContact C-N 3.31Å
115	E	97.4	Very high	97.7	Very high	137 Å²	137	64.5 Å²	64.5	64%	0.64	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.5	-177.9	-71.3	175.6	179.3	0	0	114.2	Q111 V113 D117	Q111-E115 PolarHBondContact NE2-OE1 3.36Å; Q111-E115 WeakPolarHBondContact O-CG 3.3Å; Q111-E115 PolarHBondContact O-N 3.19Å; V113-E115 VanDerWaalsContact C-N 3.28Å; V113-E115 PolarHBondContact O-N 3.29Å; E115-D117 PolarHBondContact O-N 2.91Å
116	V	98.3	Very high	97.6	Very high	21 Å²	21	64.2 Å²	64.2	13%	0.127	33%	0.332	C	S	.	.			trans	-68.7	125	-179.1	176.5	0	0	0	0	111.3	F84 Q88 V113 R114 V118 V121 Y128	F84-V116 HydrophobicContact CD1-CB 4.05Å; F84-V116 HydrophobicContact CD1-CG1 3.89Å; F84-V116 HydrophobicContact CD1-CG2 4.11Å; F84-V116 HydrophobicContact CE1-CB 4.21Å; F84-V116 HydrophobicContact CE1-CG1 4.03Å; F84-V116 HydrophobicContact CE1-CG2 3.8Å; F84-V116 HydrophobicContact CG-CG1 4.28Å; Q88-V116 PolarHBondContact NE2-O 2.84Å; V113-V116 PolarHBondContact O-N 2.59Å; R114-V116 VanDerWaalsContact C-N 3.31Å; V116-V118 PolarHBondContact O-N 3.09Å; V116-V121 HydrophobicContact CG1-CG2 3.43Å; V116-V121 VanDerWaalsContact CG1-CG2 3.43Å; V116-Y128 HydrophobicContact CG2-CD1 3.87Å; V116-Y128 HydrophobicContact CG2-CE1 3.28Å
117	D	98.2	Very high	97.5	Very high	73 Å²	73	67.7 Å²	67.7	39%	0.39	35%	0.354	S	S	.	.			trans	-75.6	98.6	166.9	-176.2	-9	0	0	0	109.5	E115 E119 K120 V121	E115-D117 PolarHBondContact O-N 2.91Å; D117-E119 PolarHBondContact O-N 3.41Å; D117-E119 PolarHBondContact OD1-N 3.24Å; D117-K120 HydrophobicContact CB-CB 4.42Å; D117-K120 HydrophobicContact CB-CD 4.27Å; D117-K120 HydrophobicContact CB-CG 4.44Å; D117-K120 PolarHBondContact O-N 3.34Å; D117-K120 WeakPolarHBondContact OD2-CD 3.5Å; D117-K120 WeakPolarHBondContact OD2-CE 3.49Å; D117-K120 IonicContact OD2-NZ 2.84Å; D117-K120 PolarHBondContact OD2-NZ 3.25Å; D117-V121 PolarHBondContact O-N 2.96Å
118	V	97.9	Very high	97.5	Very high	18 Å²	18	66.7 Å²	66.7	11%	0.109	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-55.8	-35.1	-175.3	176.3	0	0	0	0	112.1	Q81 F84 T85 V116 K120 V121	Q81-V118 HydrophobicContact CB-CG1 3.75Å; Q81-V118 HydrophobicContact CG-CG1 4.01Å; Q81-V118 WeakPolarHBondContact CG-O 3.05Å; Q81-V118 PolarHBondContact NE2-O 3.06Å; F84-V118 HydrophobicContact CB-CG2 4.05Å; T85-V118 WeakPolarHBondContact OG1-CG1 3.38Å; V116-V118 PolarHBondContact O-N 3.09Å; V118-K120 PolarHBondContact O-N 3.12Å; V118-V121 WeakPolarHBondContact O-CB 3.47Å; V118-V121 PolarHBondContact O-N 3.21Å
119	E	96.4	Very high	97.5	Very high	141 Å²	141	63.9 Å²	63.9	66%	0.659	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-65.2	-26.7	-178.2	-64.8	-57.3	149	0	0	112.7	K77 Q81 D117	K77-E119 PolarHBondContact NZ-O 3.04Å; K77-E119 VanDerWaalsContact NZ-O 3.09Å; Q81-E119 PolarHBondContact NE2-O 3.27Å; D117-E119 PolarHBondContact O-N 3.41Å; D117-E119 PolarHBondContact OD1-N 3.24Å
120	K	97.3	Very high	97.5	Very high	155 Å²	155	65.7 Å²	65.7	67%	0.674	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-92.5	-8.4	179.5	-64.9	-179	-173.2	142.6	0	114.1	D117 V118 S122	D117-K120 HydrophobicContact CB-CB 4.42Å; D117-K120 HydrophobicContact CB-CD 4.27Å; D117-K120 HydrophobicContact CB-CG 4.44Å; D117-K120 PolarHBondContact O-N 3.34Å; D117-K120 WeakPolarHBondContact OD2-CD 3.5Å; D117-K120 WeakPolarHBondContact OD2-CE 3.49Å; D117-K120 IonicContact OD2-NZ 2.84Å; D117-K120 PolarHBondContact OD2-NZ 3.25Å; V118-K120 PolarHBondContact O-N 3.12Å; K120-S122 PolarHBondContact O-N 3.45Å
121	V	97.3	Very high	97.5	Very high	12 Å²	12	65.7 Å²	65.7	7%	0.073	34%	0.335	C	S	.	.			trans	-59.7	125.3	176.4	171.9	0	0	0	0	109.5	K77 Q81 F84 V116 D117 V118	K77-V121 WeakPolarHBondContact CE-O 3.5Å; K77-V121 WeakPolarHBondContact CG-O 3.33Å; Q81-V121 HydrophobicContact CG-CB 4.1Å; Q81-V121 HydrophobicContact CG-CG1 4.44Å; F84-V121 HydrophobicContact CD2-CB 4.42Å; F84-V121 HydrophobicContact CD2-CG1 3.79Å; F84-V121 HydrophobicContact CD2-CG2 3.8Å; F84-V121 HydrophobicContact CE2-CG1 3.79Å; F84-V121 HydrophobicContact CE2-CG2 4.04Å; F84-V121 HydrophobicContact CG-CG2 4.26Å; V116-V121 HydrophobicContact CG1-CG2 3.43Å; V116-V121 VanDerWaalsContact CG1-CG2 3.43Å; D117-V121 PolarHBondContact O-N 2.96Å; V118-V121 WeakPolarHBondContact O-CB 3.47Å; V118-V121 PolarHBondContact O-N 3.21Å
122	S	95.3	Very high	97.5	Very high	92 Å²	92	61.9 Å²	61.9	64%	0.643	32%	0.318	S	S	*	.			trans	-133.9	-15	177.5	50.8	0	0	0	0	113.4	K120	K120-S122 PolarHBondContact O-N 3.45Å
123	A	95.1	Very high	97.5	Very high	42 Å²	42	62 Å²	62	35%	0.347	32%	0.316	S	S	.	.			trans	-134.6	159.7	176.8	0	0	0	0	0	110	E125	A123-E125 HydrophobicContact CB-CG 4.21Å
124	F	97.2	Very high	97.6	Very high	6 Å²	6	63.3 Å²	63.3	3%	0.026	33%	0.325	C	S	.	.			trans	-127	83.9	177.3	-170.2	-125.2	0	0	0	109.7	Y80 I83 F84 V129 I132 L164 V167 A168	Y80-F124 HydrophobicContact CD1-CB 3.46Å; Y80-F124 VanDerWaalsContact CD1-CB 3.46Å; Y80-F124 HydrophobicContact CD1-CD1 4.41Å; Y80-F124 HydrophobicContact CD1-CG 4.02Å; Y80-F124 HydrophobicContact CD2-CB 3.95Å; Y80-F124 HydrophobicContact CE1-CB 3.49Å; Y80-F124 VanDerWaalsContact CE1-CB 3.49Å; Y80-F124 HydrophobicContact CE1-CD1 4.41Å; Y80-F124 HydrophobicContact CE1-CG 4.25Å; Y80-F124 HydrophobicContact CE2-CB 3.97Å; Y80-F124 HydrophobicContact CG-CB 3.69Å; Y80-F124 HydrophobicContact CG-CG 4.48Å; I83-F124 HydrophobicContact CG2-CE2 4.01Å; I83-F124 HydrophobicContact CG2-CZ 3.99Å; F84-F124 AromaticContact CE2-CD2 3.76Å; F84-F124 HydrophobicContact CE2-CD2 3.76Å; F84-F124 HydrophobicContact CE2-CE2 4.14Å; F84-F124 HydrophobicContact CZ-CD2 4.17Å; F84-F124 HydrophobicContact CZ-CE2 4.31Å; F124-V129 HydrophobicContact CD1-CG2 3.8Å; F124-V129 HydrophobicContact CD2-CG2 4.25Å; F124-V129 HydrophobicContact CE1-CG2 3.8Å; F124-V129 HydrophobicContact CE2-CG2 4.26Å; F124-V129 HydrophobicContact CG-CG2 4.01Å; F124-V129 HydrophobicContact CZ-CG2 4.02Å; F124-V129 VanDerWaalsContact O-CG2 3.27Å; F124-V129 WeakPolarHBondContact O-CG2 3.46Å; F124-I132 HydrophobicContact CE2-CD1 3.66Å; F124-I132 HydrophobicContact CZ-CD1 4.19Å; F124-L164 HydrophobicContact CE1-CD2 3.85Å; F124-L164 HydrophobicContact CZ-CD2 3.76Å; F124-V167 HydrophobicContact CD1-CG1 4.21Å; F124-A168 HydrophobicContact CD1-CB 3.91Å; F124-A168 HydrophobicContact CE1-CB 4.04Å
125	E	96.3	Very high	97.6	Very high	132 Å²	132	59.6 Å²	59.6	62%	0.617	31%	0.311	S	S	*	.			trans	-129.5	172	-169.6	-64.4	175.1	-172.8	0	0	111.2	A123 Y128 V129	A123-E125 HydrophobicContact CB-CG 4.21Å; E125-Y128 WeakPolarHBondContact O-CB 3.37Å; E125-Y128 PolarHBondContact O-N 3.12Å; E125-V129 PolarHBondContact O-N 2.98Å
126	N	96.7	Very high	97.7	Very high	96 Å²	96	53.7 Å²	53.7	51%	0.513	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	145	172.1	-82.4	-21.8	0	0	0	111.8	V129 D130	N126-V129 WeakPolarHBondContact OD1-CB 3.35Å; N126-D130 VanDerWaalsContact CG-OD2 3.28Å; N126-D130 PolarHBondContact ND2-OD2 3.25Å; N126-D130 PolarHBondContact OD1-N 3.35Å; N126-D130 VanDerWaalsContact OD1-N 3.09Å; N126-D130 PolarHBondContact OD1-OD1 3.4Å; N126-D130 PolarHBondContact OD1-OD2 3.47Å
127	P	97.4	Very high	97.7	Very high	72 Å²	72	58.1 Å²	58.1	47%	0.468	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84	-0.6	10.1	33.5	-36.7	0	0	0	115.5	L112 A131	L112-P127 HydrophobicContact CD1-CG 4.43Å; L112-P127 HydrophobicContact CD2-CB 3.98Å; L112-P127 HydrophobicContact CD2-CG 3.86Å; P127-A131 VanDerWaalsContact O-CB 3.3Å; P127-A131 WeakPolarHBondContact O-CB 3.46Å; P127-A131 PolarHBondContact O-N 2.91Å; P127-A131 VanDerWaalsContact O-N 3.1Å
128	Y	98.3	Very high	97.7	Very high	80 Å²	80	54.7 Å²	54.7	31%	0.314	29%	0.288	S	S	.	.	H	α-helix	trans	-72.6	-36.8	-172.5	-57.4	-69.6	0	0	0	113.8	F84 L112 V116 E125 A131 I132	F84-Y128 AromaticContact CE1-CD1 3.81Å; F84-Y128 HydrophobicContact CE1-CD1 3.81Å; F84-Y128 AromaticContact CE1-CG 3.9Å; F84-Y128 HydrophobicContact CE1-CG 3.9Å; F84-Y128 HydrophobicContact CZ-CD1 4.11Å; F84-Y128 HydrophobicContact CZ-CD2 4.2Å; F84-Y128 AromaticContact CZ-CG 3.71Å; F84-Y128 HydrophobicContact CZ-CG 3.71Å; L112-Y128 HydrophobicContact CD1-CD1 4.42Å; L112-Y128 HydrophobicContact CD1-CE1 3.77Å; L112-Y128 HydrophobicContact CD2-CD1 4.37Å; L112-Y128 HydrophobicContact CG-CD1 4.04Å; L112-Y128 HydrophobicContact CG-CE1 3.85Å; V116-Y128 HydrophobicContact CG2-CD1 3.87Å; V116-Y128 HydrophobicContact CG2-CE1 3.28Å; E125-Y128 WeakPolarHBondContact O-CB 3.37Å; E125-Y128 PolarHBondContact O-N 3.12Å; Y128-A131 PolarHBondContact O-N 3.33Å; Y128-I132 WeakPolarHBondContact O-CB 3.37Å; Y128-I132 WeakPolarHBondContact O-CG1 3.38Å; Y128-I132 PolarHBondContact O-N 3.36Å
129	V	98.3	Very high	97.7	Very high	9 Å²	9	56.4 Å²	56.4	6%	0.055	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-53.1	177.4	174.2	0	0	0	0	110.2	F124 E125 N126 A131 I132 K133 A168	F124-V129 HydrophobicContact CD1-CG2 3.8Å; F124-V129 HydrophobicContact CD2-CG2 4.25Å; F124-V129 HydrophobicContact CE1-CG2 3.8Å; F124-V129 HydrophobicContact CE2-CG2 4.26Å; F124-V129 HydrophobicContact CG-CG2 4.01Å; F124-V129 HydrophobicContact CZ-CG2 4.02Å; F124-V129 VanDerWaalsContact O-CG2 3.27Å; F124-V129 WeakPolarHBondContact O-CG2 3.46Å; E125-V129 PolarHBondContact O-N 2.98Å; N126-V129 WeakPolarHBondContact OD1-CB 3.35Å; V129-A131 VanDerWaalsContact C-N 3.34Å; V129-A131 PolarHBondContact O-N 2.84Å; V129-I132 PolarHBondContact O-N 3.13Å; V129-K133 HydrophobicContact CG1-CD 4.12Å; V129-K133 WeakPolarHBondContact O-CB 3.46Å; V129-K133 WeakPolarHBondContact O-CG 3.48Å; V129-K133 PolarHBondContact O-N 3.18Å; V129-A168 HydrophobicContact CB-CB 4.4Å; V129-A168 HydrophobicContact CG1-CB 3.65Å; V129-A168 HydrophobicContact CG2-CB 3.78Å
130	D	98.4	Very high	97.8	Very high	88 Å²	88	49.9 Å²	49.9	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177.9	-69.5	-18.8	0	0	0	112.1	N126 K133 S134	N126-D130 VanDerWaalsContact CG-OD2 3.28Å; N126-D130 PolarHBondContact ND2-OD2 3.25Å; N126-D130 PolarHBondContact OD1-N 3.35Å; N126-D130 VanDerWaalsContact OD1-N 3.09Å; N126-D130 PolarHBondContact OD1-OD1 3.4Å; N126-D130 PolarHBondContact OD1-OD2 3.47Å; D130-K133 PolarHBondContact O-N 2.93Å; D130-S134 WeakPolarHBondContact O-CB 3.42Å; D130-S134 PolarHBondContact O-N 2.8Å
131	A	98.7	Very high	97.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-47.6	177	0	0	0	0	0	112.3	H109 L112 V113 P127 Y128 V129 S134 L135	H109-A131 HydrophobicContact CB-CB 3.82Å; H109-A131 WeakPolarHBondContact ND1-CB 3.14Å; L112-A131 HydrophobicContact CD2-CB 4.01Å; V113-A131 HydrophobicContact CG2-CB 4.12Å; P127-A131 VanDerWaalsContact O-CB 3.3Å; P127-A131 WeakPolarHBondContact O-CB 3.46Å; P127-A131 PolarHBondContact O-N 2.91Å; P127-A131 VanDerWaalsContact O-N 3.1Å; Y128-A131 PolarHBondContact O-N 3.33Å; V129-A131 VanDerWaalsContact C-N 3.34Å; V129-A131 PolarHBondContact O-N 2.84Å; A131-S134 PolarHBondContact O-N 3.02Å; A131-L135 WeakPolarHBondContact O-CB 3.21Å; A131-L135 WeakPolarHBondContact O-CD1 3.45Å; A131-L135 VanDerWaalsContact O-CG 3.23Å; A131-L135 WeakPolarHBondContact O-CG 3.08Å; A131-L135 PolarHBondContact O-N 2.96Å
132	I	98.8	Very high	98	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-37.3	-179.1	-71.7	165.2	0	0	0	111	I83 F84 M87 V113 F124 Y128 V129 L135 W136 L161 L164	I83-I132 HydrophobicContact CG2-CD1 4.19Å; I83-I132 HydrophobicContact CG2-CG2 4.21Å; F84-I132 HydrophobicContact CD1-CD1 4.03Å; F84-I132 HydrophobicContact CE1-CD1 3.79Å; F84-I132 HydrophobicContact CZ-CD1 4.17Å; M87-I132 HydrophobicContact CE-CG2 4.02Å; M87-I132 HydrophobicContact CG-CG1 4.26Å; V113-I132 HydrophobicContact CG1-CD1 4.47Å; V113-I132 HydrophobicContact CG1-CG1 4.35Å; V113-I132 HydrophobicContact CG2-CD1 4.28Å; V113-I132 HydrophobicContact CG2-CG1 3.73Å; F124-I132 HydrophobicContact CE2-CD1 3.66Å; F124-I132 HydrophobicContact CZ-CD1 4.19Å; Y128-I132 WeakPolarHBondContact O-CB 3.37Å; Y128-I132 WeakPolarHBondContact O-CG1 3.38Å; Y128-I132 PolarHBondContact O-N 3.36Å; V129-I132 PolarHBondContact O-N 3.13Å; I132-L135 PolarHBondContact O-N 3.29Å; I132-W136 VanDerWaalsContact O-CB 3.31Å; I132-W136 WeakPolarHBondContact O-CB 3.44Å; I132-W136 PolarHBondContact O-N 3.28Å; I132-L161 HydrophobicContact CG2-CD2 3.87Å; I132-L164 HydrophobicContact CG2-CD1 3.86Å; I132-L164 HydrophobicContact CG2-CD2 4.08Å
133	K	98.7	Very high	98.1	Very high	50 Å²	50	45.1 Å²	45.1	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-45.4	171.7	-74.9	178.5	-175.4	172.7	0	111.8	V129 D130 W136 N137 L164 D165	V129-K133 HydrophobicContact CG1-CD 4.12Å; V129-K133 WeakPolarHBondContact O-CB 3.46Å; V129-K133 WeakPolarHBondContact O-CG 3.48Å; V129-K133 PolarHBondContact O-N 3.18Å; D130-K133 PolarHBondContact O-N 2.93Å; K133-W136 PolarHBondContact O-N 3.36Å; K133-N137 PolarHBondContact O-N 3.04Å; K133-N137 VanDerWaalsContact O-N 3.1Å; K133-N137 PolarHBondContact O-ND2 3.28Å; K133-L164 HydrophobicContact CB-CD1 4.4Å; K133-L164 HydrophobicContact CG-CB 4Å; K133-L164 HydrophobicContact CG-CD1 3.62Å; K133-L164 HydrophobicContact CG-CG 4.46Å; K133-D165 WeakPolarHBondContact CE-OD1 3.27Å; K133-D165 IonicContact NZ-OD1 3.44Å; K133-D165 PolarHBondContact NZ-OD1 3.25Å
134	S	98.8	Very high	98.3	Very high	28 Å²	28	43.1 Å²	43.1	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-40	178.5	-175.6	0	0	0	0	112	H105 N106 D130 A131 D138	H105-S134 PolarHBondContact NE2-OG 3.48Å; N106-S134 PolarHBondContact ND2-O 2.85Å; N106-S134 VanDerWaalsContact ND2-O 3.13Å; N106-S134 WeakPolarHBondContact OD1-CB 3.35Å; N106-S134 PolarHBondContact OD1-O 3.43Å; N106-S134 PolarHBondContact OD1-OG 2.75Å; D130-S134 WeakPolarHBondContact O-CB 3.42Å; D130-S134 PolarHBondContact O-N 2.8Å; A131-S134 PolarHBondContact O-N 3.02Å; S134-D138 PolarHBondContact O-N 3.03Å
135	L	98.9	Very high	98.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-47.5	175.1	-74.8	164.7	0	0	0	111.9	M87 I91 Y101 N106 H109 A110 V113 A131 I132 N137 D138 I141	M87-L135 HydrophobicContact CE-CB 3.85Å; M87-L135 HydrophobicContact CG-CD1 4.06Å; M87-L135 HydrophobicContact SD-CB 3.82Å; M87-L135 HydrophobicContact SD-CD1 4.05Å; I91-L135 HydrophobicContact CD1-CD1 4.13Å; Y101-L135 HydrophobicContact CD1-CD2 4.2Å; Y101-L135 HydrophobicContact CE1-CD2 3.7Å; N106-L135 HydrophobicContact CB-CD2 3.95Å; H109-L135 HydrophobicContact CB-CD1 4.09Å; H109-L135 HydrophobicContact CB-CD2 4.36Å; H109-L135 HydrophobicContact CB-CG 3.97Å; A110-L135 HydrophobicContact CB-CD2 4Å; V113-L135 HydrophobicContact CB-CD1 4.42Å; V113-L135 HydrophobicContact CG2-CD1 3.97Å; A131-L135 WeakPolarHBondContact O-CB 3.21Å; A131-L135 WeakPolarHBondContact O-CD1 3.45Å; A131-L135 VanDerWaalsContact O-CG 3.23Å; A131-L135 WeakPolarHBondContact O-CG 3.08Å; A131-L135 PolarHBondContact O-N 2.96Å; I132-L135 PolarHBondContact O-N 3.29Å; L135-N137 PolarHBondContact O-N 2.85Å; L135-D138 WeakPolarHBondContact O-CB 3.38Å; L135-D138 PolarHBondContact O-N 3.16Å; L135-I141 HydrophobicContact CD2-CG1 4.44Å; L135-I141 WeakPolarHBondContact O-CB 3.28Å; L135-I141 WeakPolarHBondContact O-CG1 3.32Å; L135-I141 WeakPolarHBondContact O-CG2 3.31Å
136	W	98.7	Very high	98.4	Very high	13 Å²	13	42 Å²	42	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-33.5	-179.5	-174.7	-124.7	0	0	0	112.1	M87 M90 I132 K133 D138 I141 Q142 Y145 K158 L161 N162	M87-W136 HydrophobicContact CE-CB 4.15Å; M90-W136 HydrophobicContact CE-CE3 3.94Å; M90-W136 HydrophobicContact CE-CZ3 3.86Å; M90-W136 HydrophobicContact SD-CE3 4.46Å; M90-W136 HydrophobicContact SD-CZ3 3.87Å; I132-W136 VanDerWaalsContact O-CB 3.31Å; I132-W136 WeakPolarHBondContact O-CB 3.44Å; I132-W136 PolarHBondContact O-N 3.28Å; K133-W136 PolarHBondContact O-N 3.36Å; W136-D138 VanDerWaalsContact C-N 3.29Å; W136-D138 PolarHBondContact O-N 3.14Å; W136-I141 HydrophobicContact CE3-CG2 4Å; W136-I141 HydrophobicContact CZ3-CG2 4.43Å; W136-Q142 VanDerWaalsContact CD2-NE2 3.31Å; W136-Q142 VanDerWaalsContact CE3-NE2 3.3Å; W136-Q142 PolarHBondContact O-NE2 3.21Å; W136-Y145 AromaticContact CH2-CD1 4Å; W136-Y145 HydrophobicContact CH2-CD1 4Å; W136-Y145 AromaticContact CH2-CD2 3.68Å; W136-Y145 HydrophobicContact CH2-CD2 3.68Å; W136-Y145 HydrophobicContact CH2-CE1 4.41Å; W136-Y145 HydrophobicContact CH2-CE2 4.13Å; W136-Y145 AromaticContact CH2-CG 3.63Å; W136-Y145 HydrophobicContact CH2-CG 3.63Å; W136-Y145 AromaticContact CZ3-CD2 3.94Å; W136-Y145 HydrophobicContact CZ3-CD2 3.94Å; W136-Y145 AromaticContact CZ3-CG 3.92Å; W136-Y145 HydrophobicContact CZ3-CG 3.92Å; W136-K158 HydrophobicContact CZ2-CG 4.49Å; W136-L161 HydrophobicContact CD2-CB 3.62Å; W136-L161 HydrophobicContact CD2-CD1 3.73Å; W136-L161 HydrophobicContact CD2-CG 4.32Å; W136-L161 HydrophobicContact CE3-CB 4.19Å; W136-L161 HydrophobicContact CE3-CD1 3.41Å; W136-L161 VanDerWaalsContact CE3-CD1 3.41Å; W136-L161 HydrophobicContact CE3-CG 4.45Å; W136-L161 HydrophobicContact CG-CB 3.82Å; W136-L161 HydrophobicContact CG-CD1 4.32Å; W136-L161 HydrophobicContact CH2-CD1 4.36Å; W136-L161 HydrophobicContact CZ2-CB 4.11Å; W136-L161 HydrophobicContact CZ3-CD1 3.77Å; W136-L161 PolarHBondContact NE1-O 3.42Å; W136-N162 PolarHBondContact NE1-OD1 2.76Å
137	N	98.6	Very high	98.4	Very high	114 Å²	114	40.8 Å²	40.8	61%	0.61	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	0.2	174.5	-69.6	-60.6	0	0	0	114.3	K133 L135 P139	K133-N137 PolarHBondContact O-N 3.04Å; K133-N137 VanDerWaalsContact O-N 3.1Å; K133-N137 PolarHBondContact O-ND2 3.28Å; L135-N137 PolarHBondContact O-N 2.85Å; N137-P139 WeakPolarHBondContact O-CD 3.37Å
138	D	98.8	Very high	98.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.			trans	-75.8	125.4	174.8	-164	-71	0	0	0	110.6	K102 Y103 N106 S134 L135 W136 G140 I141 Q142	K102-D138 PolarHBondContact N-OD1 3.28Å; K102-D138 PolarHBondContact N-OD2 3.31Å; Y103-D138 HydrophobicContact CD2-CB 4.42Å; Y103-D138 WeakPolarHBondContact CD2-OD2 3.42Å; Y103-D138 PolarHBondContact N-OD2 2.86Å; Y103-D138 VanDerWaalsContact N-OD2 3.09Å; N106-D138 WeakPolarHBondContact ND2-CB 3.44Å; N106-D138 PolarHBondContact ND2-OD2 2.97Å; S134-D138 PolarHBondContact O-N 3.03Å; L135-D138 WeakPolarHBondContact O-CB 3.38Å; L135-D138 PolarHBondContact O-N 3.16Å; W136-D138 VanDerWaalsContact C-N 3.29Å; W136-D138 PolarHBondContact O-N 3.14Å; D138-G140 PolarHBondContact O-N 3.06Å; D138-G140 WeakPolarHBondContact OD1-CA 3.49Å; D138-G140 PolarHBondContact OD1-N 2.97Å; D138-I141 HydrophobicContact CB-CB 4.2Å; D138-I141 HydrophobicContact CB-CG1 4.14Å; D138-I141 PolarHBondContact O-N 3.21Å; D138-Q142 PolarHBondContact O-N 2.71Å
139	P	98.7	Very high	98.1	Very high	54 Å²	54	39.3 Å²	39.3	35%	0.351	19%	0.193	S	C	.	.	H	α-helix	trans	-58	-28.8	176.7	-33.7	42.8	0	0	0	115.3	K102 N137 Q142 E143	K102-P139 HydrophobicContact CB-CB 4.42Å; K102-P139 HydrophobicContact CB-CG 4.43Å; K102-P139 HydrophobicContact CD-CB 3.87Å; K102-P139 HydrophobicContact CD-CG 3.38Å; N137-P139 WeakPolarHBondContact O-CD 3.37Å; P139-Q142 PolarHBondContact O-N 3.18Å; P139-E143 WeakPolarHBondContact O-CB 3.32Å; P139-E143 PolarHBondContact O-N 2.75Å
140	G	98.7	Very high	97.9	Very high	4 Å²	4	42.8 Å²	42.8	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-41.9	172.8	0	0	0	0	0	112	M94 I99 D138 Q142 E143 C144	M94-G140 VanDerWaalsContact SD-C 3.52Å; I99-G140 WeakPolarHBondContact CG2-O 3.48Å; D138-G140 PolarHBondContact O-N 3.06Å; D138-G140 WeakPolarHBondContact OD1-CA 3.49Å; D138-G140 PolarHBondContact OD1-N 2.97Å; G140-Q142 VanDerWaalsContact C-N 3.35Å; G140-E143 PolarHBondContact O-N 3.12Å; G140-C144 WeakPolarHBondContact O-CB 3.46Å; G140-C144 PolarHBondContact O-N 3.47Å
141	I	98.7	Very high	97.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-38.8	174	-69.8	-72.9	0	0	0	111.1	M87 M90 M94 Y101 L135 W136 D138 C144 Y145	M87-I141 HydrophobicContact SD-CD1 4.47Å; M90-I141 HydrophobicContact CB-CD1 4.46Å; M90-I141 HydrophobicContact CE-CG2 4.29Å; M90-I141 HydrophobicContact SD-CG2 4.33Å; M94-I141 HydrophobicContact CE-CD1 4.41Å; M94-I141 HydrophobicContact CG-CD1 3.73Å; M94-I141 HydrophobicContact SD-CD1 4.11Å; Y101-I141 HydrophobicContact CD1-CG1 4.41Å; Y101-I141 HydrophobicContact CE1-CD1 4Å; Y101-I141 HydrophobicContact CE1-CG1 4.12Å; L135-I141 HydrophobicContact CD2-CG1 4.44Å; L135-I141 WeakPolarHBondContact O-CB 3.28Å; L135-I141 WeakPolarHBondContact O-CG1 3.32Å; L135-I141 WeakPolarHBondContact O-CG2 3.31Å; W136-I141 HydrophobicContact CE3-CG2 4Å; W136-I141 HydrophobicContact CZ3-CG2 4.43Å; D138-I141 HydrophobicContact CB-CB 4.2Å; D138-I141 HydrophobicContact CB-CG1 4.14Å; D138-I141 PolarHBondContact O-N 3.21Å; I141-C144 WeakPolarHBondContact O-CB 3.46Å; I141-C144 PolarHBondContact O-N 2.9Å; I141-Y145 PolarHBondContact O-N 2.8Å
142	Q	98.7	Very high	97.6	Very high	64 Å²	64	43 Å²	43	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-44.4	174.4	-69.6	-63.3	-58.9	0	0	111.8	W136 D138 P139 G140 C144 Y145 D146	W136-Q142 VanDerWaalsContact CD2-NE2 3.31Å; W136-Q142 VanDerWaalsContact CE3-NE2 3.3Å; W136-Q142 PolarHBondContact O-NE2 3.21Å; D138-Q142 PolarHBondContact O-N 2.71Å; P139-Q142 PolarHBondContact O-N 3.18Å; G140-Q142 VanDerWaalsContact C-N 3.35Å; Q142-C144 VanDerWaalsContact C-N 3.3Å; Q142-C144 PolarHBondContact O-N 3.35Å; Q142-Y145 WeakPolarHBondContact O-CB 3.19Å; Q142-Y145 PolarHBondContact O-N 3.49Å; Q142-Y145 VanDerWaalsContact O-N 3.12Å; Q142-D146 PolarHBondContact O-N 3.48Å
143	E	98.5	Very high	97.5	Very high	95 Å²	95	43.7 Å²	43.7	44%	0.444	21%	0.209	S	C	.	.	H	α-helix	trans	-58.2	-43.5	172.7	-175.5	-170.2	148.9	0	0	111.4	I99 P139 G140 Y145 D146 R147	I99-E143 HydrophobicContact CD1-CG 4.26Å; I99-E143 HydrophobicContact CG2-CB 4.39Å; P139-E143 WeakPolarHBondContact O-CB 3.32Å; P139-E143 PolarHBondContact O-N 2.75Å; G140-E143 PolarHBondContact O-N 3.12Å; E143-Y145 VanDerWaalsContact C-N 3.32Å; E143-Y145 PolarHBondContact O-N 3.5Å; E143-D146 PolarHBondContact O-N 2.79Å; E143-R147 WeakPolarHBondContact O-CG 3.47Å; E143-R147 PolarHBondContact O-N 3.26Å
144	C	98.5	Very high	97.4	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-39.4	175.9	-169.3	0	0	0	0	112	A93 M94 I99 G140 I141 Q142 R147 R148 Y151	A93-C144 VanDerWaalsContact CB-SG 3.56Å; M94-C144 HydrophobicContact CG-CB 4.1Å; M94-C144 HydrophobicContact SD-CB 3.54Å; M94-C144 VanDerWaalsContact SD-CB 3.54Å; I99-C144 HydrophobicContact CD1-CB 3.88Å; G140-C144 WeakPolarHBondContact O-CB 3.46Å; G140-C144 PolarHBondContact O-N 3.47Å; I141-C144 WeakPolarHBondContact O-CB 3.46Å; I141-C144 PolarHBondContact O-N 2.9Å; Q142-C144 VanDerWaalsContact C-N 3.3Å; Q142-C144 PolarHBondContact O-N 3.35Å; C144-R147 CarbonylContact O-C 3.56Å; C144-R147 PolarHBondContact O-N 3.17Å; C144-R148 PolarHBondContact O-N 2.91Å; C144-Y151 VanDerWaalsContact C-OH 3.3Å; C144-Y151 VanDerWaalsContact O-CE1 3.26Å; C144-Y151 WeakPolarHBondContact O-CE1 3.35Å; C144-Y151 PolarHBondContact O-OH 3.18Å
145	Y	98.2	Very high	97.2	Very high	12 Å²	12	43.8 Å²	43.8	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-37.6	175.7	176.1	-96.2	0	0	0	112.5	M90 W136 I141 Q142 E143 R147 R148 L153 T157 K158	M90-Y145 HydrophobicContact SD-CD2 4.09Å; W136-Y145 AromaticContact CH2-CD1 4Å; W136-Y145 HydrophobicContact CH2-CD1 4Å; W136-Y145 AromaticContact CH2-CD2 3.68Å; W136-Y145 HydrophobicContact CH2-CD2 3.68Å; W136-Y145 HydrophobicContact CH2-CE1 4.41Å; W136-Y145 HydrophobicContact CH2-CE2 4.13Å; W136-Y145 AromaticContact CH2-CG 3.63Å; W136-Y145 HydrophobicContact CH2-CG 3.63Å; W136-Y145 AromaticContact CZ3-CD2 3.94Å; W136-Y145 HydrophobicContact CZ3-CD2 3.94Å; W136-Y145 AromaticContact CZ3-CG 3.92Å; W136-Y145 HydrophobicContact CZ3-CG 3.92Å; I141-Y145 PolarHBondContact O-N 2.8Å; Q142-Y145 WeakPolarHBondContact O-CB 3.19Å; Q142-Y145 PolarHBondContact O-N 3.49Å; Q142-Y145 VanDerWaalsContact O-N 3.12Å; E143-Y145 VanDerWaalsContact C-N 3.32Å; E143-Y145 PolarHBondContact O-N 3.5Å; Y145-R147 PolarHBondContact O-N 2.83Å; Y145-R148 VanDerWaalsContact CE1-NH1 3.3Å; Y145-R148 WeakPolarHBondContact O-CB 3.36Å; Y145-R148 VanDerWaalsContact O-CD 3.28Å; Y145-R148 WeakPolarHBondContact O-CD 3.47Å; Y145-R148 WeakPolarHBondContact O-CG 3.49Å; Y145-R148 PolarHBondContact O-N 2.78Å; Y145-R148 VanDerWaalsContact O-N 3.13Å; Y145-R148 PolarHBondContact O-NH1 3.34Å; Y145-R148 VanDerWaalsContact O-NH1 3.13Å; Y145-R148 PolarHBondContact OH-NE 2.84Å; Y145-L153 HydrophobicContact CD2-CD2 3.68Å; Y145-L153 HydrophobicContact CE2-CD2 3.93Å; Y145-T157 HydrophobicContact CD2-CG2 4.4Å; Y145-T157 HydrophobicContact CE2-CG2 4.29Å; Y145-K158 HydrophobicContact CE1-CB 4.38Å; Y145-K158 HydrophobicContact CE1-CD 3.99Å; Y145-K158 HydrophobicContact CE2-CB 4.08Å; Y145-K158 WeakPolarHBondContact OH-CB 3.41Å; Y145-K158 WeakPolarHBondContact OH-CD 3.1Å
146	D	97	Very high	97.2	Very high	102 Å²	102	44.4 Å²	44.4	55%	0.545	22%	0.217	S	C	.	.	H	α-helix	trans	-66.6	-24.1	175.7	-70.8	-22.6	0	0	0	112.2	Q142 E143	Q142-D146 PolarHBondContact O-N 3.48Å; E143-D146 PolarHBondContact O-N 2.79Å
147	R	96.5	Very high	97.2	Very high	71 Å²	71	44 Å²	44	27%	0.268	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	13.7	174.4	-65.5	177.7	67.5	-174.9	-1.2	114.2	L97 E143 C144 Y145 R149 E150	L97-R147 HydrophobicContact CD1-CB 4.07Å; E143-R147 WeakPolarHBondContact O-CG 3.47Å; E143-R147 PolarHBondContact O-N 3.26Å; C144-R147 CarbonylContact O-C 3.56Å; C144-R147 PolarHBondContact O-N 3.17Å; Y145-R147 PolarHBondContact O-N 2.83Å; R147-R149 PolarHBondContact O-N 3.05Å; R147-E150 WeakPolarHBondContact CB-OE1 3.49Å; R147-E150 WeakPolarHBondContact CG-OE1 3.44Å; R147-E150 IonicContact CZ-OE1 3.46Å; R147-E150 IonicContact CZ-OE2 2.73Å; R147-E150 IonicContact NE-OE1 2.77Å; R147-E150 PolarHBondContact NE-OE1 3.21Å; R147-E150 IonicContact NE-OE2 3.56Å; R147-E150 PolarHBondContact NE-OE2 3.41Å; R147-E150 IonicContact NH2-OE1 2.78Å; R147-E150 PolarHBondContact NH2-OE1 2.95Å; R147-E150 IonicContact NH2-OE2 3.48Å; R147-E150 PolarHBondContact NH2-OE2 3.37Å; R147-E150 WeakPolarHBondContact O-CB 3.42Å; R147-E150 PolarHBondContact O-N 2.96Å
148	R	96.2	Very high	97.1	Very high	39 Å²	39	42.3 Å²	42.3	15%	0.147	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-1.3	-178.8	70.2	-171.8	179.1	-82.7	4.4	117.1	C144 Y145 E150 Y151 L153 E281	C144-R148 PolarHBondContact O-N 2.91Å; Y145-R148 VanDerWaalsContact CE1-NH1 3.3Å; Y145-R148 WeakPolarHBondContact O-CB 3.36Å; Y145-R148 VanDerWaalsContact O-CD 3.28Å; Y145-R148 WeakPolarHBondContact O-CD 3.47Å; Y145-R148 WeakPolarHBondContact O-CG 3.49Å; Y145-R148 PolarHBondContact O-N 2.78Å; Y145-R148 VanDerWaalsContact O-N 3.13Å; Y145-R148 PolarHBondContact O-NH1 3.34Å; Y145-R148 VanDerWaalsContact O-NH1 3.13Å; Y145-R148 PolarHBondContact OH-NE 2.84Å; R148-E150 VanDerWaalsContact C-N 3.35Å; R148-Y151 HydrophobicContact CB-CE1 4.36Å; R148-L153 HydrophobicContact CB-CB 4.2Å; R148-L153 HydrophobicContact CB-CD2 3.73Å; R148-E281 IonicContact CZ-OE1 2.7Å; R148-E281 IonicContact NH2-OE1 3.51Å; R148-E281 PolarHBondContact NH2-OE1 3.46Å
149	R	94.2	Very high	97.1	Very high	83 Å²	83	44.9 Å²	44.9	31%	0.313	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-20.8	168.1	67.8	179.1	-178.7	-85.6	-3.8	112.5	R147 Y151	R147-R149 PolarHBondContact O-N 3.05Å; R149-Y151 VanDerWaalsContact C-N 3.34Å
150	E	94.5	Very high	97.1	Very high	82 Å²	82	42.5 Å²	42.5	38%	0.383	20%	0.197	S	C	.	.	S	Bend	trans	-85.1	-5.7	-177.1	-61	175.8	-127.9	0	0	113.2	L97 R147 R148	L97-E150 HydrophobicContact CD2-CB 4.31Å; L97-E150 WeakPolarHBondContact CD2-OE2 3.47Å; R147-E150 WeakPolarHBondContact CB-OE1 3.49Å; R147-E150 WeakPolarHBondContact CG-OE1 3.44Å; R147-E150 IonicContact CZ-OE1 3.46Å; R147-E150 IonicContact CZ-OE2 2.73Å; R147-E150 IonicContact NE-OE1 2.77Å; R147-E150 PolarHBondContact NE-OE1 3.21Å; R147-E150 IonicContact NE-OE2 3.56Å; R147-E150 PolarHBondContact NE-OE2 3.41Å; R147-E150 IonicContact NH2-OE1 2.78Å; R147-E150 PolarHBondContact NH2-OE1 2.95Å; R147-E150 IonicContact NH2-OE2 3.48Å; R147-E150 PolarHBondContact NH2-OE2 3.37Å; R147-E150 WeakPolarHBondContact O-CB 3.42Å; R147-E150 PolarHBondContact O-N 2.96Å; R148-E150 VanDerWaalsContact C-N 3.35Å
151	Y	95.6	Very high	97.1	Very high	31 Å²	31	42.5 Å²	42.5	12%	0.122	20%	0.196	C	C	.	.	S	Bend	trans	-153.2	170.9	178	62.3	-83.5	0	0	0	110.7	M90 A93 L97 C144 R148 R149 L153	M90-Y151 HydrophobicContact CG-CE2 4.21Å; A93-Y151 HydrophobicContact CB-CD1 3.56Å; A93-Y151 HydrophobicContact CB-CD2 3.65Å; A93-Y151 HydrophobicContact CB-CE1 3.66Å; A93-Y151 HydrophobicContact CB-CE2 3.74Å; A93-Y151 HydrophobicContact CB-CG 3.56Å; L97-Y151 HydrophobicContact CD1-CD1 4.18Å; L97-Y151 HydrophobicContact CD1-CE1 4.18Å; C144-Y151 VanDerWaalsContact C-OH 3.3Å; C144-Y151 VanDerWaalsContact O-CE1 3.26Å; C144-Y151 WeakPolarHBondContact O-CE1 3.35Å; C144-Y151 PolarHBondContact O-OH 3.18Å; R148-Y151 HydrophobicContact CB-CE1 4.36Å; R149-Y151 VanDerWaalsContact C-N 3.34Å; Y151-L153 HydrophobicContact CD2-CB 4.26Å; Y151-L153 HydrophobicContact CE2-CB 3.84Å; Y151-L153 HydrophobicContact CE2-CD1 4.3Å; Y151-L153 HydrophobicContact CE2-CD2 4.17Å; Y151-L153 HydrophobicContact CE2-CG 4.32Å; Y151-L153 PolarHBondContact O-N 2.95Å
152	Q	94.9	Very high	97.1	Very high	60 Å²	60	47.2 Å²	47.2	28%	0.28	22%	0.222	S	C	.	.			trans	-82.4	117	-178	-57.4	-61.3	-31.3	0	0	110.9	V238 L239 V240	Q152-V238 PolarHBondContact NE2-O 3.22Å; Q152-L239 PolarHBondContact NE2-O 2.98Å; Q152-V240 HydrophobicContact CB-CG2 4.49Å; Q152-V240 HydrophobicContact CG-CB 4.4Å; Q152-V240 HydrophobicContact CG-CG2 3.82Å; Q152-V240 VanDerWaalsContact OE1-CG2 3.31Å
153	L	96.9	Very high	97	Very high	16 Å²	16	47.2 Å²	47.2	8%	0.084	22%	0.224	C	C	.	.			trans	-141.4	137.4	176.5	-170	65.6	0	0	0	110.5	A86 A89 M90 Y145 R148 Y151 T157	A86-L153 HydrophobicContact CB-CD1 4.17Å; A89-L153 HydrophobicContact CB-CD1 4.07Å; M90-L153 HydrophobicContact CG-CD1 3.89Å; M90-L153 HydrophobicContact CG-CD2 4.06Å; M90-L153 HydrophobicContact SD-CD2 4.09Å; Y145-L153 HydrophobicContact CD2-CD2 3.68Å; Y145-L153 HydrophobicContact CE2-CD2 3.93Å; R148-L153 HydrophobicContact CB-CB 4.2Å; R148-L153 HydrophobicContact CB-CD2 3.73Å; Y151-L153 HydrophobicContact CD2-CB 4.26Å; Y151-L153 HydrophobicContact CE2-CB 3.84Å; Y151-L153 HydrophobicContact CE2-CD1 4.3Å; Y151-L153 HydrophobicContact CE2-CD2 4.17Å; Y151-L153 HydrophobicContact CE2-CG 4.32Å; Y151-L153 PolarHBondContact O-N 2.95Å; L153-T157 HydrophobicContact CD1-CG2 4.18Å; L153-T157 WeakPolarHBondContact CD1-OG1 3.43Å; L153-T157 HydrophobicContact CD2-CG2 4.12Å; L153-T157 HydrophobicContact CG-CG2 4.33Å; L153-T157 WeakPolarHBondContact CG-OG1 3.31Å
154	S	95.8	Very high	97	Very high	34 Å²	34	43.1 Å²	43.1	24%	0.238	20%	0.204	C	C	.	.			trans	-66.6	136.4	178.5	-177.5	0	0	0	0	111.4	S156 T157	S154-S156 PolarHBondContact O-N 2.92Å; S154-S156 VanDerWaalsContact O-N 3.07Å; S154-S156 PolarHBondContact OG-N 3.44Å; S154-T157 VanDerWaalsContact O-CB 3.26Å; S154-T157 WeakPolarHBondContact O-CB 3.46Å; S154-T157 PolarHBondContact O-N 3.11Å; S154-T157 PolarHBondContact O-OG1 2.83Å
155	D	95.6	Very high	96.9	Very high	46 Å²	46	48.6 Å²	48.6	25%	0.246	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25	173.6	-63.5	-35	0	0	0	113.2	T157 K275 L278	D155-T157 VanDerWaalsContact C-N 3.28Å; D155-T157 PolarHBondContact O-N 3.11Å; D155-K275 WeakPolarHBondContact OD2-CD 3.48Å; D155-K275 VanDerWaalsContact OD2-CE 3.31Å; D155-K275 WeakPolarHBondContact OD2-CE 3.46Å; D155-K275 IonicContact OD2-NZ 2.78Å; D155-K275 PolarHBondContact OD2-NZ 3.47Å; D155-L278 HydrophobicContact CB-CD1 3.59Å
156	S	97.2	Very high	96.9	Very high	12 Å²	12	51 Å²	51	8%	0.084	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-5.5	180	-60.1	0	0	0	0	114	S154 K158 Y159 Y160 R181	S154-S156 PolarHBondContact O-N 2.92Å; S154-S156 VanDerWaalsContact O-N 3.07Å; S154-S156 PolarHBondContact OG-N 3.44Å; S156-K158 PolarHBondContact O-N 3.34Å; S156-Y159 WeakPolarHBondContact O-CB 3.48Å; S156-Y159 PolarHBondContact O-N 3.2Å; S156-Y160 VanDerWaalsContact O-CD2 3.29Å; S156-Y160 WeakPolarHBondContact O-CD2 3.23Å; S156-Y160 PolarHBondContact O-N 3.26Å; S156-R181 WeakPolarHBondContact CB-O 3.27Å; S156-R181 WeakPolarHBondContact OG-CB 3.32Å; S156-R181 PolarHBondContact OG-O 2.89Å
157	T	98.5	Very high	97	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-54	-56.3	-175.6	-61.7	0	0	0	0	112	A86 M90 Y145 L153 S154 D155 Y159 Y160 L161	A86-T157 HydrophobicContact CB-CG2 3.79Å; A86-T157 WeakPolarHBondContact CB-OG1 3.26Å; M90-T157 HydrophobicContact CE-CG2 4.03Å; M90-T157 HydrophobicContact SD-CG2 4.31Å; Y145-T157 HydrophobicContact CD2-CG2 4.4Å; Y145-T157 HydrophobicContact CE2-CG2 4.29Å; L153-T157 HydrophobicContact CD1-CG2 4.18Å; L153-T157 WeakPolarHBondContact CD1-OG1 3.43Å; L153-T157 HydrophobicContact CD2-CG2 4.12Å; L153-T157 HydrophobicContact CG-CG2 4.33Å; L153-T157 WeakPolarHBondContact CG-OG1 3.31Å; S154-T157 VanDerWaalsContact O-CB 3.26Å; S154-T157 WeakPolarHBondContact O-CB 3.46Å; S154-T157 PolarHBondContact O-N 3.11Å; S154-T157 PolarHBondContact O-OG1 2.83Å; D155-T157 VanDerWaalsContact C-N 3.28Å; D155-T157 PolarHBondContact O-N 3.11Å; T157-Y159 VanDerWaalsContact C-N 3.28Å; T157-Y159 PolarHBondContact O-N 3.36Å; T157-Y160 PolarHBondContact O-N 2.83Å; T157-L161 HydrophobicContact CG2-CD1 3.52Å; T157-L161 HydrophobicContact CG2-CG 4.14Å; T157-L161 WeakPolarHBondContact O-CB 3.33Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.37Å; T157-L161 PolarHBondContact O-N 3.17Å
158	K	97.9	Very high	97	Very high	80 Å²	80	43.9 Å²	43.9	35%	0.348	21%	0.213	S	C	.	.	H	α-helix	trans	-62.9	-34.4	-178.8	177.1	176.7	-179.6	-179.6	0	112.8	W136 Y145 S156 N162	W136-K158 HydrophobicContact CZ2-CG 4.49Å; Y145-K158 HydrophobicContact CE1-CB 4.38Å; Y145-K158 HydrophobicContact CE1-CD 3.99Å; Y145-K158 HydrophobicContact CE2-CB 4.08Å; Y145-K158 WeakPolarHBondContact OH-CB 3.41Å; Y145-K158 WeakPolarHBondContact OH-CD 3.1Å; S156-K158 PolarHBondContact O-N 3.34Å; K158-N162 WeakPolarHBondContact CG-ND2 3.44Å; K158-N162 WeakPolarHBondContact O-CB 3.49Å; K158-N162 PolarHBondContact O-N 2.91Å; K158-N162 VanDerWaalsContact O-N 3.08Å; K158-N162 PolarHBondContact O-ND2 3.43Å
159	Y	98.3	Very high	97.1	Very high	54 Å²	54	45.8 Å²	45.8	21%	0.212	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-47.7	177.5	168.3	-99.5	0	0	0	111.8	S156 T157 R166 Q177 D178 R181	S156-Y159 WeakPolarHBondContact O-CB 3.48Å; S156-Y159 PolarHBondContact O-N 3.2Å; T157-Y159 VanDerWaalsContact C-N 3.28Å; T157-Y159 PolarHBondContact O-N 3.36Å; Y159-R166 PolarHBondContact OH-NH2 3.37Å; Y159-Q177 HydrophobicContact CE1-CG 4.44Å; Y159-Q177 HydrophobicContact CE2-CG 3.71Å; Y159-Q177 WeakPolarHBondContact OH-CB 3.45Å; Y159-Q177 WeakPolarHBondContact OH-CG 3.35Å; Y159-D178 VanDerWaalsContact CE1-OD1 3.23Å; Y159-D178 WeakPolarHBondContact CE1-OD1 3.19Å; Y159-D178 PolarHBondContact OH-OD1 3.1Å; Y159-D178 VanDerWaalsContact OH-OD1 3.1Å; Y159-R181 HydrophobicContact CD1-CB 4.22Å; Y159-R181 HydrophobicContact CD1-CG 4.33Å; Y159-R181 HydrophobicContact CE1-CB 4.37Å
160	Y	98.6	Very high	97.1	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-75.5	-42.5	179.7	-68.4	-60.6	0	0	0	112.7	V79 I83 S156 T157 N162 D163 L164 V167 D178 R181 V182	V79-Y160 HydrophobicContact CB-CE1 4.45Å; V79-Y160 HydrophobicContact CG1-CD1 3.82Å; V79-Y160 HydrophobicContact CG1-CE1 3.58Å; V79-Y160 HydrophobicContact CG2-CE1 4.13Å; I83-Y160 HydrophobicContact CG1-CG 4.23Å; S156-Y160 VanDerWaalsContact O-CD2 3.29Å; S156-Y160 WeakPolarHBondContact O-CD2 3.23Å; S156-Y160 PolarHBondContact O-N 3.26Å; T157-Y160 PolarHBondContact O-N 2.83Å; Y160-N162 VanDerWaalsContact C-N 3.3Å; Y160-N162 PolarHBondContact O-N 3.48Å; Y160-D163 CarbonylContact O-C 3.51Å; Y160-D163 PolarHBondContact O-N 3.25Å; Y160-L164 PolarHBondContact O-N 3.47Å; Y160-V167 HydrophobicContact CD1-CG2 4.48Å; Y160-D178 HydrophobicContact CE1-CB 4.11Å; Y160-D178 VanDerWaalsContact CE1-OD1 3.27Å; Y160-D178 WeakPolarHBondContact CE1-OD1 3.49Å; Y160-D178 PolarHBondContact OH-O 3.26Å; Y160-R181 HydrophobicContact CE2-CB 4.41Å; Y160-V182 WeakPolarHBondContact OH-CA 3.35Å; Y160-V182 PolarHBondContact OH-N 3.42Å; Y160-V182 VanDerWaalsContact OH-N 3.08Å
161	L	98.6	Very high	97.2	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-71	-24.3	-175.6	-63.8	-173.7	0	0	0	113.3	I83 M87 M90 I132 W136 T157 D163 L164	I83-L161 HydrophobicContact CG2-CD2 3.92Å; M87-L161 HydrophobicContact CE-CD1 4.05Å; M90-L161 HydrophobicContact CE-CD1 3.45Å; M90-L161 VanDerWaalsContact CE-CD1 3.45Å; I132-L161 HydrophobicContact CG2-CD2 3.87Å; W136-L161 HydrophobicContact CD2-CB 3.62Å; W136-L161 HydrophobicContact CD2-CD1 3.73Å; W136-L161 HydrophobicContact CD2-CG 4.32Å; W136-L161 HydrophobicContact CE3-CB 4.19Å; W136-L161 HydrophobicContact CE3-CD1 3.41Å; W136-L161 VanDerWaalsContact CE3-CD1 3.41Å; W136-L161 HydrophobicContact CE3-CG 4.45Å; W136-L161 HydrophobicContact CG-CB 3.82Å; W136-L161 HydrophobicContact CG-CD1 4.32Å; W136-L161 HydrophobicContact CH2-CD1 4.36Å; W136-L161 HydrophobicContact CZ2-CB 4.11Å; W136-L161 HydrophobicContact CZ3-CD1 3.77Å; W136-L161 PolarHBondContact NE1-O 3.42Å; T157-L161 HydrophobicContact CG2-CD1 3.52Å; T157-L161 HydrophobicContact CG2-CG 4.14Å; T157-L161 WeakPolarHBondContact O-CB 3.33Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.37Å; T157-L161 PolarHBondContact O-N 3.17Å; L161-D163 VanDerWaalsContact C-N 3.27Å; L161-D163 PolarHBondContact O-N 2.83Å; L161-L164 HydrophobicContact CD2-CD1 4.39Å; L161-L164 HydrophobicContact CD2-CD2 4.01Å; L161-L164 WeakPolarHBondContact O-CD1 3.38Å; L161-L164 WeakPolarHBondContact O-CG 3.47Å
162	N	98.3	Very high	97.3	Very high	100 Å²	100	48 Å²	48	54%	0.535	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.3	173.6	-75.5	-2.9	0	0	0	113.9	W136 K158 Y160	W136-N162 PolarHBondContact NE1-OD1 2.76Å; K158-N162 WeakPolarHBondContact CG-ND2 3.44Å; K158-N162 WeakPolarHBondContact O-CB 3.49Å; K158-N162 PolarHBondContact O-N 2.91Å; K158-N162 VanDerWaalsContact O-N 3.08Å; K158-N162 PolarHBondContact O-ND2 3.43Å; Y160-N162 VanDerWaalsContact C-N 3.3Å; Y160-N162 PolarHBondContact O-N 3.48Å
163	D	97.6	Very high	97.5	Very high	64 Å²	64	47.6 Å²	47.6	34%	0.342	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	41	-173.8	-159.2	1.6	0	0	0	111.3	Y160 L161 D165 R166 V167	Y160-D163 CarbonylContact O-C 3.51Å; Y160-D163 PolarHBondContact O-N 3.25Å; L161-D163 VanDerWaalsContact C-N 3.27Å; L161-D163 PolarHBondContact O-N 2.83Å; D163-D165 PolarHBondContact O-N 3.32Å; D163-R166 PolarHBondContact O-N 3.48Å; D163-R166 WeakPolarHBondContact OD1-CB 3.24Å; D163-R166 IonicContact OD1-NE 3.91Å; D163-R166 WeakPolarHBondContact OD2-CD 3.04Å; D163-R166 IonicContact OD2-CZ 3.35Å; D163-R166 IonicContact OD2-NE 3.77Å; D163-R166 PolarHBondContact OD2-NE 2.97Å; D163-R166 IonicContact OD2-NH2 2.76Å; D163-V167 PolarHBondContact O-N 3.21Å
164	L	98.3	Very high	97.5	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-30.3	-178	-73.9	167.9	0	0	0	112.7	I83 F124 I132 K133 Y160 L161 V167 A168	I83-L164 HydrophobicContact CD1-CD2 4.35Å; I83-L164 HydrophobicContact CG2-CD2 4.27Å; F124-L164 HydrophobicContact CE1-CD2 3.85Å; F124-L164 HydrophobicContact CZ-CD2 3.76Å; I132-L164 HydrophobicContact CG2-CD1 3.86Å; I132-L164 HydrophobicContact CG2-CD2 4.08Å; K133-L164 HydrophobicContact CB-CD1 4.4Å; K133-L164 HydrophobicContact CG-CB 4Å; K133-L164 HydrophobicContact CG-CD1 3.62Å; K133-L164 HydrophobicContact CG-CG 4.46Å; Y160-L164 PolarHBondContact O-N 3.47Å; L161-L164 HydrophobicContact CD2-CD1 4.39Å; L161-L164 HydrophobicContact CD2-CD2 4.01Å; L161-L164 WeakPolarHBondContact O-CD1 3.38Å; L161-L164 WeakPolarHBondContact O-CG 3.47Å; L164-V167 PolarHBondContact O-N 3.05Å; L164-A168 WeakPolarHBondContact O-CB 3.06Å; L164-A168 PolarHBondContact O-N 3.3Å
165	D	97.5	Very high	97.6	Very high	116 Å²	116	47.9 Å²	47.9	62%	0.62	27%	0.268	S	S	*	.	H	α-helix	trans	-62.3	-45.3	176.6	-70.9	-49.1	0	0	0	111.5	K133 D163 V167 A168 D169	K133-D165 WeakPolarHBondContact CE-OD1 3.27Å; K133-D165 IonicContact NZ-OD1 3.44Å; K133-D165 PolarHBondContact NZ-OD1 3.25Å; D163-D165 PolarHBondContact O-N 3.32Å; D165-V167 PolarHBondContact O-N 2.9Å; D165-A168 PolarHBondContact O-N 3.21Å; D165-D169 PolarHBondContact O-N 3.19Å
166	R	98.1	Very high	97.8	Very high	61 Å²	61	49.6 Å²	49.6	23%	0.23	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-41.2	176.4	179.7	-177.9	63.1	84.6	1.1	112.1	Y159 D163 Y172 D178	Y159-R166 PolarHBondContact OH-NH2 3.37Å; D163-R166 PolarHBondContact O-N 3.48Å; D163-R166 WeakPolarHBondContact OD1-CB 3.24Å; D163-R166 IonicContact OD1-NE 3.91Å; D163-R166 WeakPolarHBondContact OD2-CD 3.04Å; D163-R166 IonicContact OD2-CZ 3.35Å; D163-R166 IonicContact OD2-NE 3.77Å; D163-R166 PolarHBondContact OD2-NE 2.97Å; D163-R166 IonicContact OD2-NH2 2.76Å; R166-Y172 VanDerWaalsContact O-CD2 3.26Å; R166-Y172 WeakPolarHBondContact O-CD2 3.22Å; R166-D178 IonicContact CZ-OD1 3.36Å; R166-D178 IonicContact CZ-OD2 2.96Å; R166-D178 IonicContact NH1-OD1 3.15Å; R166-D178 PolarHBondContact NH1-OD1 2.94Å; R166-D178 IonicContact NH1-OD2 3.43Å; R166-D178 PolarHBondContact NH1-OD2 3.43Å; R166-D178 IonicContact NH2-OD1 2.7Å; R166-D178 PolarHBondContact NH2-OD1 3.15Å; R166-D178 IonicContact NH2-OD2 3.24Å
167	V	98	Very high	97.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-76	-28.4	-177	-178.7	0	0	0	0	112.1	V79 Y80 I83 F124 Y160 D163 L164 D165 Y172	V79-V167 HydrophobicContact CG1-CG1 3.9Å; Y80-V167 HydrophobicContact CD1-CG1 3.92Å; Y80-V167 HydrophobicContact CE1-CG1 3.69Å; Y80-V167 WeakPolarHBondContact CE1-O 3.21Å; I83-V167 HydrophobicContact CD1-CB 4.34Å; I83-V167 HydrophobicContact CD1-CG1 3.59Å; F124-V167 HydrophobicContact CD1-CG1 4.21Å; Y160-V167 HydrophobicContact CD1-CG2 4.48Å; D163-V167 PolarHBondContact O-N 3.21Å; L164-V167 PolarHBondContact O-N 3.05Å; D165-V167 PolarHBondContact O-N 2.9Å; V167-Y172 HydrophobicContact CG1-CD1 4.27Å; V167-Y172 HydrophobicContact CG1-CE1 3.92Å; V167-Y172 HydrophobicContact CG2-CE2 4.3Å
168	A	97.7	Very high	97.8	Very high	24 Å²	24	51.2 Å²	51.2	20%	0.198	28%	0.281	C	S	.	.	H	α-helix	trans	-85.1	-5.9	177.2	0	0	0	0	0	114	F124 V129 L164 D165	F124-A168 HydrophobicContact CD1-CB 3.91Å; F124-A168 HydrophobicContact CE1-CB 4.04Å; V129-A168 HydrophobicContact CB-CB 4.4Å; V129-A168 HydrophobicContact CG1-CB 3.65Å; V129-A168 HydrophobicContact CG2-CB 3.78Å; L164-A168 WeakPolarHBondContact O-CB 3.06Å; L164-A168 PolarHBondContact O-N 3.3Å; D165-A168 PolarHBondContact O-N 3.21Å
169	D	97.2	Very high	97.8	Very high	80 Å²	80	47.4 Å²	47.4	43%	0.428	26%	0.264	S	S	.	.			trans	-60.1	129.9	174.9	-168.9	-65.7	0	0	0	110.1	D165 A171 Y172	D165-D169 PolarHBondContact O-N 3.19Å; D169-A171 PolarHBondContact O-N 3.23Å; D169-A171 VanDerWaalsContact O-N 3.14Å; D169-A171 WeakPolarHBondContact OD1-CA 3.45Å; D169-A171 WeakPolarHBondContact OD1-CB 3.38Å; D169-A171 PolarHBondContact OD1-N 3.14Å; D169-Y172 WeakPolarHBondContact O-CA 3.48Å; D169-Y172 WeakPolarHBondContact O-CB 3.01Å; D169-Y172 PolarHBondContact O-N 2.94Å
170	P	94.8	Very high	97.8	Very high	142 Å²	142	44.9 Å²	44.9	92%	0.922	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.4	178.5	-26.1	35.4	0	0	0	114.5
171	A	96	Very high	97.8	Very high	83 Å²	83	47.3 Å²	47.3	69%	0.686	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	12.4	173.7	0	0	0	0	0	112.8	D169 L173	D169-A171 PolarHBondContact O-N 3.23Å; D169-A171 VanDerWaalsContact O-N 3.14Å; D169-A171 WeakPolarHBondContact OD1-CA 3.45Å; D169-A171 WeakPolarHBondContact OD1-CB 3.38Å; D169-A171 PolarHBondContact OD1-N 3.14Å; A171-L173 PolarHBondContact O-N 3.19Å
172	Y	98	Very high	97.8	Very high	17 Å²	17	47.3 Å²	47.3	7%	0.067	26%	0.264	C	S	.	.			trans	-51.8	124.1	179.4	172.3	-120.6	0	0	0	111.6	T76 V79 Y80 R166 V167 D169 P174 D178	T76-Y172 HydrophobicContact CG2-CD1 3.9Å; T76-Y172 HydrophobicContact CG2-CE1 4.17Å; V79-Y172 HydrophobicContact CG1-CE1 4.29Å; Y80-Y172 AromaticContact CE1-CD1 3.83Å; Y80-Y172 HydrophobicContact CE1-CD1 3.83Å; Y80-Y172 HydrophobicContact CE1-CE1 4.02Å; R166-Y172 VanDerWaalsContact O-CD2 3.26Å; R166-Y172 WeakPolarHBondContact O-CD2 3.22Å; V167-Y172 HydrophobicContact CG1-CD1 4.27Å; V167-Y172 HydrophobicContact CG1-CE1 3.92Å; V167-Y172 HydrophobicContact CG2-CE2 4.3Å; D169-Y172 WeakPolarHBondContact O-CA 3.48Å; D169-Y172 WeakPolarHBondContact O-CB 3.01Å; D169-Y172 PolarHBondContact O-N 2.94Å; Y172-P174 HydrophobicContact CE1-CG 3.89Å; Y172-D178 VanDerWaalsContact OH-CG 3.25Å; Y172-D178 PolarHBondContact OH-OD2 3.43Å
173	L	98.1	Very high	97.7	Very high	52 Å²	52	45.3 Å²	45.3	27%	0.272	25%	0.248	S	C	.	.			trans	-122.1	121.7	170.9	-179.3	68	0	0	0	107.8	D69 K72 R73 A171 T175	D69-L173 HydrophobicContact CB-CD2 4.02Å; K72-L173 HydrophobicContact CB-CD1 3.92Å; K72-L173 HydrophobicContact CB-CG 4.32Å; R73-L173 HydrophobicContact CB-CD1 4.14Å; A171-L173 PolarHBondContact O-N 3.19Å; L173-T175 PolarHBondContact O-N 2.76Å
174	P	98.5	Very high	97.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	25%	0.25	C	S	.	.			trans	-53.5	129.5	178.2	-31.5	38.6	0	0	0	112.4	K72 F75 T76 Y172 D178 V179	K72-P174 HydrophobicContact CB-CB 4.43Å; K72-P174 WeakPolarHBondContact CB-O 3.48Å; K72-P174 VanDerWaalsContact CD-O 3.24Å; K72-P174 WeakPolarHBondContact CD-O 3.45Å; K72-P174 WeakPolarHBondContact CG-O 3.24Å; K72-P174 WeakPolarHBondContact O-CD 3.26Å; K72-P174 VanDerWaalsContact O-CG 3.23Å; K72-P174 WeakPolarHBondContact O-CG 3.44Å; F75-P174 HydrophobicContact CB-CB 4.44Å; F75-P174 HydrophobicContact CB-CG 4.36Å; T76-P174 VanDerWaalsContact OG1-CD 3.32Å; T76-P174 WeakPolarHBondContact OG1-CD 3.29Å; Y172-P174 HydrophobicContact CE1-CG 3.89Å; P174-D178 HydrophobicContact CB-CB 3.96Å; P174-V179 HydrophobicContact CB-CG2 4.49Å
175	T	98.1	Very high	97.4	Very high	55 Å²	55	48.5 Å²	48.5	34%	0.337	27%	0.272	S	S	.	.			trans	-71.7	167.6	171.5	69.3	0	0	0	0	110.3	L173 Q177 D178 V179	L173-T175 PolarHBondContact O-N 2.76Å; T175-Q177 PolarHBondContact O-N 3.15Å; T175-Q177 PolarHBondContact OG1-N 3.07Å; T175-D178 WeakPolarHBondContact CA-OD2 3.27Å; T175-D178 VanDerWaalsContact CB-OD2 3.29Å; T175-D178 WeakPolarHBondContact CB-OD2 3.32Å; T175-D178 WeakPolarHBondContact CG2-OD2 3.23Å; T175-D178 PolarHBondContact N-OD2 2.68Å; T175-D178 PolarHBondContact O-N 3.05Å; T175-D178 VanDerWaalsContact O-N 3.16Å; T175-D178 VanDerWaalsContact OG1-CG 3.3Å; T175-D178 PolarHBondContact OG1-N 2.71Å; T175-D178 VanDerWaalsContact OG1-N 3.15Å; T175-D178 PolarHBondContact OG1-OD2 3.49Å; T175-V179 WeakPolarHBondContact O-CG2 3.38Å; T175-V179 PolarHBondContact O-N 2.78Å
176	Q	97.8	Very high	97.3	Very high	81 Å²	81	43.9 Å²	43.9	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-55.5	-35	170.4	-176.4	177.9	91.3	0	0	111.6	I61 V179 L180	I61-Q176 HydrophobicContact CD1-CG 3.56Å; I61-Q176 HydrophobicContact CG1-CG 4.25Å; I61-Q176 VanDerWaalsContact CG2-NE2 3.29Å; Q176-V179 PolarHBondContact O-N 3Å; Q176-L180 HydrophobicContact CG-CD1 4.34Å; Q176-L180 WeakPolarHBondContact O-CG 3.46Å; Q176-L180 PolarHBondContact O-N 3.34Å
177	Q	98	Very high	97	Very high	51 Å²	51	45.8 Å²	45.8	24%	0.238	27%	0.266	C	S	.	.	H	α-helix	trans	-69.8	-37.9	179.4	-169.1	63.4	30.4	0	0	112.5	Y159 T175 V179 L180 R181 T332	Y159-Q177 HydrophobicContact CE1-CG 4.44Å; Y159-Q177 HydrophobicContact CE2-CG 3.71Å; Y159-Q177 WeakPolarHBondContact OH-CB 3.45Å; Y159-Q177 WeakPolarHBondContact OH-CG 3.35Å; T175-Q177 PolarHBondContact O-N 3.15Å; T175-Q177 PolarHBondContact OG1-N 3.07Å; Q177-V179 VanDerWaalsContact C-N 3.34Å; Q177-L180 PolarHBondContact O-N 3.37Å; Q177-R181 HydrophobicContact CG-CG 4.5Å; Q177-R181 VanDerWaalsContact O-CB 3.3Å; Q177-R181 WeakPolarHBondContact O-CB 3.44Å; Q177-R181 WeakPolarHBondContact O-CG 3.39Å; Q177-R181 PolarHBondContact O-N 3.37Å; Q177-T332 PolarHBondContact OE1-O 3.22Å
178	D	98.5	Very high	96.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-43.9	172	-57	-62.2	0	0	0	110.1	V79 Y159 Y160 R166 Y172 P174 T175 L180 R181 V182	V79-D178 HydrophobicContact CG2-CB 4.29Å; Y159-D178 VanDerWaalsContact CE1-OD1 3.23Å; Y159-D178 WeakPolarHBondContact CE1-OD1 3.19Å; Y159-D178 PolarHBondContact OH-OD1 3.1Å; Y159-D178 VanDerWaalsContact OH-OD1 3.1Å; Y160-D178 HydrophobicContact CE1-CB 4.11Å; Y160-D178 VanDerWaalsContact CE1-OD1 3.27Å; Y160-D178 WeakPolarHBondContact CE1-OD1 3.49Å; Y160-D178 PolarHBondContact OH-O 3.26Å; R166-D178 IonicContact CZ-OD1 3.36Å; R166-D178 IonicContact CZ-OD2 2.96Å; R166-D178 IonicContact NH1-OD1 3.15Å; R166-D178 PolarHBondContact NH1-OD1 2.94Å; R166-D178 IonicContact NH1-OD2 3.43Å; R166-D178 PolarHBondContact NH1-OD2 3.43Å; R166-D178 IonicContact NH2-OD1 2.7Å; R166-D178 PolarHBondContact NH2-OD1 3.15Å; R166-D178 IonicContact NH2-OD2 3.24Å; Y172-D178 VanDerWaalsContact OH-CG 3.25Å; Y172-D178 PolarHBondContact OH-OD2 3.43Å; P174-D178 HydrophobicContact CB-CB 3.96Å; T175-D178 WeakPolarHBondContact CA-OD2 3.27Å; T175-D178 VanDerWaalsContact CB-OD2 3.29Å; T175-D178 WeakPolarHBondContact CB-OD2 3.32Å; T175-D178 WeakPolarHBondContact CG2-OD2 3.23Å; T175-D178 PolarHBondContact N-OD2 2.68Å; T175-D178 PolarHBondContact O-N 3.05Å; T175-D178 VanDerWaalsContact O-N 3.16Å; T175-D178 VanDerWaalsContact OG1-CG 3.3Å; T175-D178 PolarHBondContact OG1-N 2.71Å; T175-D178 VanDerWaalsContact OG1-N 3.15Å; T175-D178 PolarHBondContact OG1-OD2 3.49Å; D178-L180 VanDerWaalsContact C-N 3.31Å; D178-L180 PolarHBondContact O-N 2.65Å; D178-R181 PolarHBondContact O-N 3.35Å; D178-V182 WeakPolarHBondContact O-CB 3.39Å; D178-V182 WeakPolarHBondContact O-CG1 3.3Å; D178-V182 PolarHBondContact O-N 2.84Å
179	V	98.3	Very high	96.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-39.3	176.2	176.7	0	0	0	0	111.8	K57 Y67 K72 F75 P174 T175 Q176 Q177 V182	K57-V179 HydrophobicContact CD-CG1 4.43Å; K57-V179 VanDerWaalsContact CD-O 3.3Å; K57-V179 WeakPolarHBondContact CD-O 3.36Å; K57-V179 WeakPolarHBondContact CE-O 3.48Å; K57-V179 PolarHBondContact NZ-O 2.94Å; Y67-V179 HydrophobicContact CD1-CG1 4Å; Y67-V179 HydrophobicContact CD2-CG1 3.89Å; Y67-V179 HydrophobicContact CE1-CG1 3.85Å; Y67-V179 HydrophobicContact CE2-CG1 3.74Å; Y67-V179 HydrophobicContact CG-CG1 4.03Å; K72-V179 HydrophobicContact CG-CG2 4.22Å; F75-V179 HydrophobicContact CB-CG2 4.45Å; F75-V179 HydrophobicContact CD2-CB 4.48Å; F75-V179 HydrophobicContact CD2-CG1 4.13Å; F75-V179 HydrophobicContact CD2-CG2 3.69Å; F75-V179 HydrophobicContact CE1-CG1 4.39Å; F75-V179 HydrophobicContact CE2-CG1 3.8Å; F75-V179 HydrophobicContact CE2-CG2 4.15Å; F75-V179 HydrophobicContact CG-CG2 4.11Å; F75-V179 HydrophobicContact CZ-CG1 3.94Å; P174-V179 HydrophobicContact CB-CG2 4.49Å; T175-V179 WeakPolarHBondContact O-CG2 3.38Å; T175-V179 PolarHBondContact O-N 2.78Å; Q176-V179 PolarHBondContact O-N 3Å; Q177-V179 VanDerWaalsContact C-N 3.34Å; V179-V182 WeakPolarHBondContact O-CG1 3.46Å
180	L	98.2	Very high	96.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-69.8	-36.3	176.7	-71.6	171.1	0	0	0	112.8	T54 K57 Q58 I61 Q176 Q177 D178	T54-L180 HydrophobicContact CG2-CB 4.39Å; T54-L180 HydrophobicContact CG2-CD2 4.03Å; T54-L180 PolarHBondContact OG1-O 3.3Å; K57-L180 HydrophobicContact CB-CD2 3.91Å; Q58-L180 HydrophobicContact CG-CD2 3.78Å; I61-L180 HydrophobicContact CD1-CD1 4.26Å; I61-L180 HydrophobicContact CD1-CD2 3.84Å; I61-L180 HydrophobicContact CD1-CG 4.12Å; Q176-L180 HydrophobicContact CG-CD1 4.34Å; Q176-L180 WeakPolarHBondContact O-CG 3.46Å; Q176-L180 PolarHBondContact O-N 3.34Å; Q177-L180 PolarHBondContact O-N 3.37Å; D178-L180 VanDerWaalsContact C-N 3.31Å; D178-L180 PolarHBondContact O-N 2.65Å
181	R	98.2	Very high	96.5	Very high	54 Å²	54	45.1 Å²	45.1	20%	0.204	25%	0.252	C	S	.	.	H	α-helix	trans	-90.1	-21.8	-174.1	-75.6	-176.8	175.9	-90.6	-4.2	114.3	S156 Y159 Y160 Q177 D178 R183 T332	S156-R181 WeakPolarHBondContact CB-O 3.27Å; S156-R181 WeakPolarHBondContact OG-CB 3.32Å; S156-R181 PolarHBondContact OG-O 2.89Å; Y159-R181 HydrophobicContact CD1-CB 4.22Å; Y159-R181 HydrophobicContact CD1-CG 4.33Å; Y159-R181 HydrophobicContact CE1-CB 4.37Å; Y160-R181 HydrophobicContact CE2-CB 4.41Å; Q177-R181 HydrophobicContact CG-CG 4.5Å; Q177-R181 VanDerWaalsContact O-CB 3.3Å; Q177-R181 WeakPolarHBondContact O-CB 3.44Å; Q177-R181 WeakPolarHBondContact O-CG 3.39Å; Q177-R181 PolarHBondContact O-N 3.37Å; D178-R181 PolarHBondContact O-N 3.35Å; R181-R183 PolarHBondContact O-N 3.27Å; R181-T332 HydrophobicContact CG-CG2 4.17Å
182	V	98.1	Very high	96.3	Very high	4 Å²	4	45 Å²	45	2%	0.024	24%	0.235	C	C	.	.			trans	-65.3	126.7	179	70	0	0	0	0	110.6	K57 F75 L78 V79 Y160 D178 V179	K57-V182 PolarHBondContact NZ-O 3.15Å; K57-V182 VanDerWaalsContact NZ-O 3.12Å; F75-V182 HydrophobicContact CD1-CG1 3.63Å; F75-V182 HydrophobicContact CE1-CG1 4.18Å; F75-V182 HydrophobicContact CG-CG1 4.44Å; L78-V182 HydrophobicContact CB-CG2 3.59Å; V79-V182 HydrophobicContact CG2-CB 4.3Å; V79-V182 HydrophobicContact CG2-CG2 4.16Å; Y160-V182 WeakPolarHBondContact OH-CA 3.35Å; Y160-V182 PolarHBondContact OH-N 3.42Å; Y160-V182 VanDerWaalsContact OH-N 3.08Å; D178-V182 WeakPolarHBondContact O-CB 3.39Å; D178-V182 WeakPolarHBondContact O-CG1 3.3Å; D178-V182 PolarHBondContact O-N 2.84Å; V179-V182 WeakPolarHBondContact O-CG1 3.46Å
183	R	96.1	Very high	95.9	Very high	57 Å²	57	48.2 Å²	48.2	22%	0.215	26%	0.258	C	S	.	.			trans	-91.4	125.1	-179.7	178.2	59.6	175.7	140.5	-4.6	109.7	E49 N82 R181	E49-R183 IonicContact OE1-NE 2.8Å; E49-R183 PolarHBondContact OE1-NE 3.03Å; N82-R183 PolarHBondContact ND2-O 3.17Å; N82-R183 VanDerWaalsContact OD1-CB 3.32Å; N82-R183 WeakPolarHBondContact OD1-CB 3.39Å; N82-R183 PolarHBondContact OD1-N 2.9Å; R181-R183 PolarHBondContact O-N 3.27Å
184	V	95.1	Very high	95.3	Very high	63 Å²	63	46.7 Å²	46.7	38%	0.382	25%	0.249	S	C	.	.			trans	-127.7	124	164.7	-174.8	0	0	0	0	107	L78 T186	L78-V184 HydrophobicContact CD1-CG2 3.72Å; L78-V184 HydrophobicContact CD2-CG2 4.08Å; L78-V184 HydrophobicContact CG-CG2 4.41Å; V184-T186 PolarHBondContact O-N 2.82Å
185	P	94.8	Very high	94.5	Very high	76 Å²	76	52.4 Å²	52.4	49%	0.494	28%	0.279	S	S	.	.			trans	-57.5	118.7	169.3	-26.9	37.4	0	0	0	110.8	T187	P185-T187 PolarHBondContact O-N 2.87Å
186	T	95.1	Very high	93.6	Very high	19 Å²	19	51.1 Å²	51.1	12%	0.117	27%	0.27	C	S	.	.			trans	-72.9	123.4	175.7	-45.4	0	0	0	0	109.3	S53 V184 I190 G207	S53-T186 PolarHBondContact OG-OG1 2.9Å; V184-T186 PolarHBondContact O-N 2.82Å; T186-I190 HydrophobicContact CG2-CD1 4.42Å; T186-G207 WeakPolarHBondContact O-CA 3.41Å
187	T	93.3	Very high	92.5	Very high	101 Å²	101	56.6 Å²	56.6	62%	0.62	30%	0.296	S	S	*	.			trans	-113	135	176.4	58.3	0	0	0	0	109.8	P185 E212	P185-T187 PolarHBondContact O-N 2.87Å; T187-E212 WeakPolarHBondContact CA-OE2 3.38Å
188	G	92.2	Very high	91.5	Very high	20 Å²	20	58.3 Å²	58.3	21%	0.206	31%	0.314	C	S	.	.	S	Bend	trans	76.1	-152.1	-180	0	0	0	0	0	113.8	G207 E212	G188-G207 PolarHBondContact O-N 3.08Å; G188-E212 PolarHBondContact N-OE2 3.24Å
189	I	94.1	Very high	90.8	Very high	59 Å²	59	59.6 Å²	59.6	30%	0.303	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	125.2	-176.2	-54.3	176.9	0	0	0	107.2	V204 V206 K215 H218 C219	I189-V204 HydrophobicContact CG2-CG1 3.51Å; I189-V206 HydrophobicContact CB-CG1 4.36Å; I189-V206 HydrophobicContact CG1-CG1 4.01Å; I189-V206 HydrophobicContact CG2-CG1 4.09Å; I189-K215 WeakPolarHBondContact CD1-O 3.36Å; I189-H218 HydrophobicContact CD1-CB 3.78Å; I189-C219 HydrophobicContact CD1-CB 4.32Å; I189-C219 HydrophobicContact CG2-CB 4.32Å
190	I	94.6	Very high	90.3	Very high	69 Å²	69	62.1 Å²	62.1	35%	0.354	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.1	179.6	-50.8	174.2	0	0	0	108.2	T186 Y192 D205	T186-I190 HydrophobicContact CG2-CD1 4.42Å; I190-Y192 HydrophobicContact CB-CE2 3.83Å; I190-Y192 HydrophobicContact CG2-CD2 4.25Å; I190-Y192 HydrophobicContact CG2-CE1 4.18Å; I190-Y192 HydrophobicContact CG2-CE2 3.46Å; I190-Y192 VanDerWaalsContact CG2-CE2 3.46Å; I190-Y192 VanDerWaalsContact CG2-CZ 3.43Å; I190-Y192 WeakPolarHBondContact CG2-OH 3.22Å; I190-D205 PolarHBondContact N-O 2.68Å; I190-D205 PolarHBondContact O-N 2.79Å
191	E	94.9	Very high	90	Very high	84 Å²	84	62.1 Å²	62.1	39%	0.393	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.2	179.2	-57.9	-170.1	174.1	0	0	111.2	R202 M203 V204	E191-R202 HydrophobicContact CB-CG 4.48Å; E191-R202 VanDerWaalsContact OE2-CD 3.26Å; E191-R202 WeakPolarHBondContact OE2-CD 3.38Å; E191-R202 IonicContact OE2-CZ 3.42Å; E191-R202 IonicContact OE2-NE 2.69Å; E191-R202 IonicContact OE2-NH1 3.69Å; E191-R202 PolarHBondContact OE2-NH1 3.42Å; E191-M203 CarbonylContact C-O 3.54Å; E191-M203 WeakPolarHBondContact CA-O 3.31Å; E191-V204 HydrophobicContact CG-CG1 4.38Å; E191-V204 HydrophobicContact CG-CG2 4.19Å
192	Y	92	Very high	89.8	Confident	82 Å²	82	62.4 Å²	62.4	32%	0.322	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	106.6	180	-60.2	-90.8	0	0	0	108.8	I56 I190 F194 M203 D205	I56-Y192 HydrophobicContact CD1-CD2 4.27Å; I56-Y192 HydrophobicContact CG1-CD2 4.47Å; I56-Y192 HydrophobicContact CG2-CD1 3.91Å; I56-Y192 HydrophobicContact CG2-CD2 3.55Å; I56-Y192 HydrophobicContact CG2-CE1 4.01Å; I56-Y192 HydrophobicContact CG2-CE2 3.67Å; I56-Y192 HydrophobicContact CG2-CG 3.66Å; I190-Y192 HydrophobicContact CB-CE2 3.83Å; I190-Y192 HydrophobicContact CG2-CD2 4.25Å; I190-Y192 HydrophobicContact CG2-CE1 4.18Å; I190-Y192 HydrophobicContact CG2-CE2 3.46Å; I190-Y192 VanDerWaalsContact CG2-CE2 3.46Å; I190-Y192 VanDerWaalsContact CG2-CZ 3.43Å; I190-Y192 WeakPolarHBondContact CG2-OH 3.22Å; Y192-F194 WeakPolarHBondContact O-CD2 3.42Å; Y192-F194 WeakPolarHBondContact O-CE2 3.27Å; Y192-M203 PolarHBondContact N-O 3.39Å; Y192-M203 PolarHBondContact O-N 2.85Å; Y192-D205 HydrophobicContact CD2-CB 4.5Å; Y192-D205 HydrophobicContact CE2-CB 4.01Å
193	P	90.2	Very high	89.6	Confident	83 Å²	83	62.2 Å²	62.2	54%	0.539	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.4	172.3	30.9	-32.1	0	0	0	110.2
194	F	85.3	Confident	89.7	Confident	21 Å²	21	59.5 Å²	59.5	9%	0.092	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.1	172.3	-59.3	-82.7	0	0	0	109.6	M59 Y192 L196 F201 M203	M59-F194 HydrophobicContact CB-CD1 4.16Å; M59-F194 HydrophobicContact CB-CD2 4.49Å; M59-F194 HydrophobicContact CB-CE1 3.53Å; M59-F194 HydrophobicContact CB-CE2 3.89Å; M59-F194 HydrophobicContact CB-CZ 3.37Å; M59-F194 HydrophobicContact CG-CZ 4.44Å; Y192-F194 WeakPolarHBondContact O-CD2 3.42Å; Y192-F194 WeakPolarHBondContact O-CE2 3.27Å; F194-L196 PolarHBondContact O-N 3.08Å; F194-F201 HydrophobicContact CB-CB 4.39Å; F194-F201 PolarHBondContact N-O 2.87Å; F194-F201 PolarHBondContact O-N 2.89Å; F194-M203 HydrophobicContact CD2-CB 4.36Å; F194-M203 HydrophobicContact CD2-CE 4.34Å; F194-M203 HydrophobicContact CD2-CG 3.82Å; F194-M203 HydrophobicContact CD2-SD 4.02Å; F194-M203 HydrophobicContact CE2-CB 3.92Å; F194-M203 HydrophobicContact CE2-CE 4.42Å; F194-M203 HydrophobicContact CE2-CG 3.69Å; F194-M203 HydrophobicContact CE2-SD 3.6Å; F194-M203 VanDerWaalsContact CE2-SD 3.6Å; F194-M203 HydrophobicContact CZ-SD 4.49Å
195	D	82.2	Confident	89.7	Confident	121 Å²	121	56.5 Å²	56.5	65%	0.647	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	108.5	174.1	-67.4	-37.1	0	0	0	109.7	I200	D195-I200 WeakPolarHBondContact OD1-CG1 3.48Å
196	L	78.6	Confident	89.9	Confident	27 Å²	27	52.9 Å²	52.9	14%	0.141	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	93.3	173	-66.1	-178.1	0	0	0	109.3	H63 F194 S198 V199 F201 F341 K345	H63-L196 HydrophobicContact CB-CD2 3.85Å; H63-L196 WeakPolarHBondContact ND1-CD2 3.45Å; F194-L196 PolarHBondContact O-N 3.08Å; L196-S198 PolarHBondContact O-N 2.65Å; L196-V199 CarbonylContact C-O 3.6Å; L196-V199 PolarHBondContact N-O 2.88Å; L196-V199 PolarHBondContact O-N 3.4Å; L196-V199 VanDerWaalsContact O-N 3.07Å; L196-V199 VanDerWaalsContact O-O 3.06Å; L196-F201 HydrophobicContact CB-CD2 3.98Å; L196-F201 HydrophobicContact CB-CE2 4.07Å; L196-F201 HydrophobicContact CD1-CD2 3.51Å; L196-F201 HydrophobicContact CD1-CE2 3.7Å; L196-F201 HydrophobicContact CD1-CG 4.42Å; L196-F201 HydrophobicContact CG-CD2 3.97Å; L196-F201 HydrophobicContact CG-CE2 4.35Å; L196-F341 HydrophobicContact CD1-CE1 3.77Å; L196-F341 HydrophobicContact CD1-CZ 4.26Å; L196-K345 HydrophobicContact CD1-CD 4.32Å
197	Q	74.7	Confident	89.9	Confident	197 Å²	197	52 Å²	52	92%	0.921	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	-105.6	179.1	-55.9	173.2	-30.1	0	0	111.6
198	S	76.4	Confident	89.9	Confident	87 Å²	87	47.3 Å²	47.3	61%	0.608	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-0.1	-178.3	61.2	0	0	0	0	114.1	L196	L196-S198 PolarHBondContact O-N 2.65Å
199	V	84.4	Confident	90	Very high	26 Å²	26	47.9 Å²	47.9	16%	0.158	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.3	-175.9	-179.3	0	0	0	0	109.5	R38 L40 L196 F201 L349	R38-V199 WeakPolarHBondContact O-CA 3.32Å; R38-V199 WeakPolarHBondContact O-CG1 3.38Å; L40-V199 HydrophobicContact CD1-CG1 3.56Å; L40-V199 HydrophobicContact CG-CG1 3.69Å; L196-V199 CarbonylContact C-O 3.6Å; L196-V199 PolarHBondContact N-O 2.88Å; L196-V199 PolarHBondContact O-N 3.4Å; L196-V199 VanDerWaalsContact O-N 3.07Å; L196-V199 VanDerWaalsContact O-O 3.06Å; V199-F201 HydrophobicContact CB-CE2 4.27Å; V199-F201 HydrophobicContact CG1-CD2 4.22Å; V199-F201 HydrophobicContact CG1-CE2 3.85Å; V199-F201 HydrophobicContact CG1-CZ 4.2Å; V199-L349 HydrophobicContact CB-CD2 4.38Å; V199-L349 HydrophobicContact CG1-CD2 4.14Å; V199-L349 HydrophobicContact CG2-CD2 3.88Å
200	I	87.9	Confident	90	Very high	54 Å²	54	49.1 Å²	49.1	28%	0.277	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118	177.8	-52.8	-177	0	0	0	107.5	R38 E39 L40 D195	R38-I200 PolarHBondContact O-N 3.39Å; E39-I200 CarbonylContact C-O 3.57Å; E39-I200 VanDerWaalsContact CA-O 3.32Å; E39-I200 WeakPolarHBondContact CA-O 3.4Å; E39-I200 HydrophobicContact CG-CB 4.3Å; E39-I200 HydrophobicContact CG-CG2 4.32Å; L40-I200 PolarHBondContact N-O 2.76Å; D195-I200 WeakPolarHBondContact OD1-CG1 3.48Å
201	F	91.1	Very high	89.9	Confident	1 Å²	1	50 Å²	50	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113	172.1	-73.3	-88.4	0	0	0	109.2	L40 L42 F194 L196 V199 K345 I348 L349	L40-F201 HydrophobicContact CB-CD1 4.07Å; L40-F201 HydrophobicContact CB-CE1 4.2Å; L40-F201 HydrophobicContact CD1-CD1 4.43Å; L40-F201 HydrophobicContact CD1-CE1 3.78Å; L40-F201 HydrophobicContact CD1-CZ 3.98Å; L40-F201 WeakPolarHBondContact O-CA 3.01Å; L42-F201 HydrophobicContact CD1-CB 4.21Å; L42-F201 HydrophobicContact CD1-CD1 3.43Å; L42-F201 VanDerWaalsContact CD1-CD1 3.43Å; L42-F201 HydrophobicContact CD1-CE1 4.2Å; L42-F201 HydrophobicContact CD1-CG 4.22Å; L42-F201 HydrophobicContact CD2-CD1 4.11Å; L42-F201 HydrophobicContact CD2-CE1 4.47Å; L42-F201 HydrophobicContact CG-CD1 3.89Å; F194-F201 HydrophobicContact CB-CB 4.39Å; F194-F201 PolarHBondContact N-O 2.87Å; F194-F201 PolarHBondContact O-N 2.89Å; L196-F201 HydrophobicContact CB-CD2 3.98Å; L196-F201 HydrophobicContact CB-CE2 4.07Å; L196-F201 HydrophobicContact CD1-CD2 3.51Å; L196-F201 HydrophobicContact CD1-CE2 3.7Å; L196-F201 HydrophobicContact CD1-CG 4.42Å; L196-F201 HydrophobicContact CG-CD2 3.97Å; L196-F201 HydrophobicContact CG-CE2 4.35Å; V199-F201 HydrophobicContact CB-CE2 4.27Å; V199-F201 HydrophobicContact CG1-CD2 4.22Å; V199-F201 HydrophobicContact CG1-CE2 3.85Å; V199-F201 HydrophobicContact CG1-CZ 4.2Å; F201-K345 HydrophobicContact CE2-CG 4.05Å; F201-K345 HydrophobicContact CZ-CG 3.72Å; F201-I348 HydrophobicContact CE1-CD1 4.49Å; F201-I348 HydrophobicContact CE1-CG2 4.29Å; F201-L349 HydrophobicContact CZ-CD2 4.26Å; F201-L349 HydrophobicContact CZ-CG 4.38Å
202	R	93.8	Very high	89.9	Confident	59 Å²	59	47.2 Å²	47.2	22%	0.223	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	100.8	173.2	-179.7	178.7	-65.6	-75.9	-11	108.8	E39 L40 K41 L42 E191	E39-R202 HydrophobicContact CG-CB 4.17Å; E39-R202 WeakPolarHBondContact OE1-CD 3.44Å; E39-R202 IonicContact OE1-CZ 3.51Å; E39-R202 IonicContact OE1-NE 3.3Å; E39-R202 PolarHBondContact OE1-NE 3.21Å; E39-R202 IonicContact OE1-NH2 2.8Å; E39-R202 IonicContact OE2-CZ 3.63Å; E39-R202 IonicContact OE2-NE 2.77Å; E39-R202 PolarHBondContact OE2-NE 3.02Å; E39-R202 IonicContact OE2-NH2 3.63Å; E39-R202 PolarHBondContact OE2-NH2 3.13Å; L40-R202 PolarHBondContact O-N 2.83Å; K41-R202 WeakPolarHBondContact CA-O 3.31Å; L42-R202 PolarHBondContact N-O 3.45Å; E191-R202 HydrophobicContact CB-CG 4.48Å; E191-R202 VanDerWaalsContact OE2-CD 3.26Å; E191-R202 WeakPolarHBondContact OE2-CD 3.38Å; E191-R202 IonicContact OE2-CZ 3.42Å; E191-R202 IonicContact OE2-NE 2.69Å; E191-R202 IonicContact OE2-NH1 3.69Å; E191-R202 PolarHBondContact OE2-NH1 3.42Å
203	M	95.1	Very high	90.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.9	175.8	-61.3	-167	177.3	0	0	111	L42 L44 F55 I56 M59 E191 Y192 F194 F341	L42-M203 HydrophobicContact CB-CG 4.17Å; L42-M203 HydrophobicContact CD1-CE 3.69Å; L42-M203 HydrophobicContact CD1-CG 4.02Å; L42-M203 CarbonylContact O-C 3.6Å; L42-M203 WeakPolarHBondContact O-CA 3.43Å; L44-M203 HydrophobicContact CD1-CB 3.95Å; L44-M203 HydrophobicContact CD1-CG 4.38Å; L44-M203 HydrophobicContact CD1-SD 4.44Å; F55-M203 HydrophobicContact CE1-CE 4.28Å; F55-M203 HydrophobicContact CE1-SD 4.46Å; I56-M203 HydrophobicContact CD1-CB 3.47Å; I56-M203 VanDerWaalsContact CD1-CB 3.47Å; I56-M203 HydrophobicContact CD1-CG 4.18Å; I56-M203 HydrophobicContact CD1-SD 3.61Å; M59-M203 HydrophobicContact CB-CE 4.43Å; M59-M203 HydrophobicContact CB-SD 4.27Å; M59-M203 HydrophobicContact CG-CE 3.56Å; M59-M203 HydrophobicContact CG-SD 3.63Å; M59-M203 HydrophobicContact SD-CE 3.68Å; E191-M203 CarbonylContact C-O 3.54Å; E191-M203 WeakPolarHBondContact CA-O 3.31Å; Y192-M203 PolarHBondContact N-O 3.39Å; Y192-M203 PolarHBondContact O-N 2.85Å; F194-M203 HydrophobicContact CD2-CB 4.36Å; F194-M203 HydrophobicContact CD2-CE 4.34Å; F194-M203 HydrophobicContact CD2-CG 3.82Å; F194-M203 HydrophobicContact CD2-SD 4.02Å; F194-M203 HydrophobicContact CE2-CB 3.92Å; F194-M203 HydrophobicContact CE2-CE 4.42Å; F194-M203 HydrophobicContact CE2-CG 3.69Å; F194-M203 HydrophobicContact CE2-SD 3.6Å; F194-M203 VanDerWaalsContact CE2-SD 3.6Å; F194-M203 HydrophobicContact CZ-SD 4.49Å; M203-F341 HydrophobicContact CE-CD2 4.31Å; M203-F341 HydrophobicContact CE-CE2 3.34Å; M203-F341 HydrophobicContact CE-CZ 3.49Å; M203-F341 VanDerWaalsContact CE-CZ 3.49Å
204	V	97	Very high	90.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	111.9	-180	-171.9	0	0	0	0	108.4	K41 L42 L43 L44 I189 E191 V206 C219	K41-V204 HydrophobicContact CG-CG2 4.06Å; L42-V204 PolarHBondContact O-N 3.34Å; L43-V204 HydrophobicContact CD1-CB 3.82Å; L43-V204 HydrophobicContact CD1-CG1 3.89Å; L44-V204 PolarHBondContact N-O 3.04Å; I189-V204 HydrophobicContact CG2-CG1 3.51Å; E191-V204 HydrophobicContact CG-CG1 4.38Å; E191-V204 HydrophobicContact CG-CG2 4.19Å; V204-V206 HydrophobicContact CG1-CG1 4.2Å; V204-C219 HydrophobicContact CG1-CB 3.94Å
205	D	97.1	Very high	90.8	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.6	174.2	-166.8	22.9	0	0	0	110.1	K52 S53 I56 I190 Y192	K52-D205 WeakPolarHBondContact CB-OD1 3.48Å; S53-D205 WeakPolarHBondContact CA-OD2 3.44Å; S53-D205 WeakPolarHBondContact CB-OD2 3.43Å; S53-D205 PolarHBondContact OG-OD2 3.08Å; I56-D205 HydrophobicContact CG1-CB 4.11Å; I190-D205 PolarHBondContact N-O 2.68Å; I190-D205 PolarHBondContact O-N 2.79Å; Y192-D205 HydrophobicContact CD2-CB 4.5Å; Y192-D205 HydrophobicContact CE2-CB 4.01Å
206	V	97.1	Very high	91.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151	-177.4	-61.6	0	0	0	0	111.2	L43 L44 L45 K52 I189 V204 G208 W216	L43-V206 HydrophobicContact CD1-CG1 4.44Å; L44-V206 WeakPolarHBondContact O-CG2 3.24Å; L45-V206 HydrophobicContact CD2-CG2 3.8Å; K52-V206 WeakPolarHBondContact CE-O 3.44Å; I189-V206 HydrophobicContact CB-CG1 4.36Å; I189-V206 HydrophobicContact CG1-CG1 4.01Å; I189-V206 HydrophobicContact CG2-CG1 4.09Å; V204-V206 HydrophobicContact CG1-CG1 4.2Å; V206-G208 PolarHBondContact O-N 3.46Å; V206-W216 HydrophobicContact CG2-CD2 4.28Å; V206-W216 HydrophobicContact CG2-CG 4.26Å; V206-W216 HydrophobicContact CG2-CZ2 4.19Å; V206-W216 VanDerWaalsContact CG2-NE1 3.3Å
207	G	95.6	Very high	92.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.01	25%	0.253	C	S	.	.			trans	-57.9	127.7	172.4	0	0	0	0	0	112.1	T186 G188 W216	T186-G207 WeakPolarHBondContact O-CA 3.41Å; G188-G207 PolarHBondContact O-N 3.08Å; G207-W216 WeakPolarHBondContact O-CZ2 3.29Å; G207-W216 PolarHBondContact O-NE1 3.42Å
208	G	93.5	Very high	93	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.021	24%	0.242	C	C	.	.			trans	-86.6	-19.1	-177.5	0	0	0	0	0	115	G46 G48 V206 R213	G46-G208 WeakPolarHBondContact O-CA 3.44Å; G48-G208 PolarHBondContact N-O 2.83Å; V206-G208 PolarHBondContact O-N 3.46Å; G208-R213 PolarHBondContact O-NE 3.23Å
209	Q	93.9	Very high	93.9	Very high	32 Å²	32	46.7 Å²	46.7	15%	0.15	21%	0.214	C	C	.	.	S	Bend	trans	-65	150.3	-178.6	-60.2	89.3	-27	0	0	110.6	S211 E212 R213	Q209-S211 PolarHBondContact O-N 3.2Å; Q209-S211 VanDerWaalsContact O-N 3.14Å; Q209-E212 PolarHBondContact O-N 3.47Å; Q209-R213 WeakPolarHBondContact O-CG 3.17Å; Q209-R213 PolarHBondContact O-N 2.97Å
210	R	94	Very high	94.4	Very high	85 Å²	85	46 Å²	46	32%	0.321	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-37.5	-176.5	-76.4	-178.1	165.6	179.5	-5.7	112.9	E212 R213 E241 E245 E250	R210-E212 VanDerWaalsContact C-N 3.26Å; R210-E212 PolarHBondContact O-N 3.03Å; R210-R213 PolarHBondContact O-N 2.87Å; R210-E241 PolarHBondContact N-OE1 3.09Å; R210-E245 IonicContact CZ-OE2 3.51Å; R210-E245 IonicContact NH1-OE1 2.84Å; R210-E245 PolarHBondContact NH1-OE1 3.48Å; R210-E245 IonicContact NH1-OE2 3.71Å; R210-E245 PolarHBondContact NH1-OE2 2.89Å; R210-E245 IonicContact NH2-OE1 3.26Å; R210-E245 IonicContact NH2-OE2 2.71Å; R210-E245 PolarHBondContact NH2-OE2 3.16Å; R210-E250 IonicContact CZ-OE1 3.44Å; R210-E250 IonicContact CZ-OE2 2.78Å; R210-E250 IonicContact NE-OE1 3.68Å; R210-E250 PolarHBondContact NE-OE1 3.13Å; R210-E250 IonicContact NE-OE2 2.56Å; R210-E250 IonicContact NH2-OE1 2.53Å; R210-E250 PolarHBondContact NH2-OE1 3.43Å; R210-E250 IonicContact NH2-OE2 2.86Å; R210-E250 PolarHBondContact NH2-OE2 2.98Å
211	S	93.6	Very high	94.6	Very high	88 Å²	88	49.4 Å²	49.4	62%	0.615	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.8	177.6	53.4	0	0	0	0	114.2	Q209	Q209-S211 PolarHBondContact O-N 3.2Å; Q209-S211 VanDerWaalsContact O-N 3.14Å
212	E	95.5	Very high	94.5	Very high	24 Å²	24	56.2 Å²	56.2	11%	0.112	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-21.5	-175.4	-63.9	-60.8	106.8	0	0	112.8	T187 G188 Q209 R210 R214 K215	T187-E212 WeakPolarHBondContact CA-OE2 3.38Å; G188-E212 PolarHBondContact N-OE2 3.24Å; Q209-E212 PolarHBondContact O-N 3.47Å; R210-E212 VanDerWaalsContact C-N 3.26Å; R210-E212 PolarHBondContact O-N 3.03Å; E212-R214 PolarHBondContact O-N 3.37Å; E212-R214 VanDerWaalsContact O-N 3.13Å; E212-K215 WeakPolarHBondContact O-CB 3.36Å; E212-K215 PolarHBondContact O-N 2.95Å; E212-K215 IonicContact OE1-NZ 2.94Å; E212-K215 PolarHBondContact OE1-NZ 3.01Å; E212-K215 IonicContact OE2-NZ 3.73Å; E212-K215 PolarHBondContact OE2-NZ 3.39Å
213	R	95.1	Very high	94.6	Very high	49 Å²	49	53.9 Å²	53.9	19%	0.185	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.1	-26.5	-172.6	-56.5	-165.2	-168.7	153.1	7.2	114.6	G208 Q209 R210 K215 W216 E250	G208-R213 PolarHBondContact O-NE 3.23Å; Q209-R213 WeakPolarHBondContact O-CG 3.17Å; Q209-R213 PolarHBondContact O-N 2.97Å; R210-R213 PolarHBondContact O-N 2.87Å; R213-K215 PolarHBondContact O-N 2.81Å; R213-W216 HydrophobicContact CB-CD2 4.15Å; R213-W216 HydrophobicContact CB-CE3 4.45Å; R213-W216 HydrophobicContact CB-CZ2 4.37Å; R213-W216 HydrophobicContact CG-CD2 4.37Å; R213-W216 HydrophobicContact CG-CH2 4Å; R213-W216 HydrophobicContact CG-CZ2 3.7Å; R213-W216 HydrophobicContact CG-CZ3 4.45Å; R213-W216 VanDerWaalsContact O-CB 3.3Å; R213-W216 WeakPolarHBondContact O-CB 3.11Å; R213-W216 VanDerWaalsContact O-CG 3.29Å; R213-W216 PolarHBondContact O-N 2.85Å; R213-W216 VanDerWaalsContact O-N 3.1Å; R213-E250 IonicContact CZ-OE1 2.73Å; R213-E250 IonicContact NH1-OE1 2.87Å; R213-E250 PolarHBondContact NH1-OE1 3.32Å; R213-E250 IonicContact NH2-OE1 2.92Å; R213-E250 PolarHBondContact NH2-OE1 3.04Å
214	R	93.7	Very high	94.5	Very high	224 Å²	224	55.1 Å²	55.1	85%	0.845	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-60	-27.1	175.1	-66.8	-178.9	-178.8	177.1	0.7	112.4	E212 W216	E212-R214 PolarHBondContact O-N 3.37Å; E212-R214 VanDerWaalsContact O-N 3.13Å; R214-W216 VanDerWaalsContact C-N 3.32Å
215	K	95.7	Very high	94.4	Very high	78 Å²	78	55.1 Å²	55.1	34%	0.339	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-76.8	-19.9	-179.7	-57.3	173.3	-173.1	167.1	0	112	I189 E212 R213 I217 H218	I189-K215 WeakPolarHBondContact CD1-O 3.36Å; E212-K215 WeakPolarHBondContact O-CB 3.36Å; E212-K215 PolarHBondContact O-N 2.95Å; E212-K215 IonicContact OE1-NZ 2.94Å; E212-K215 PolarHBondContact OE1-NZ 3.01Å; E212-K215 IonicContact OE2-NZ 3.73Å; E212-K215 PolarHBondContact OE2-NZ 3.39Å; R213-K215 PolarHBondContact O-N 2.81Å; K215-I217 PolarHBondContact O-N 3.25Å; K215-H218 WeakPolarHBondContact O-CB 3.46Å; K215-H218 PolarHBondContact O-CD2 2.96Å; K215-H218 PolarHBondContact O-N 3.2Å; K215-H218 VanDerWaalsContact O-N 3.1Å
216	W	96	Very high	94.4	Very high	10 Å²	10	55.1 Å²	55.1	4%	0.038	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-59.6	-33	-172.5	-66.6	2.1	0	0	0	113.7	L45 V206 G207 R213 R214 H218 C219 F220 L254 I258	L45-W216 HydrophobicContact CD2-CD2 3.89Å; L45-W216 HydrophobicContact CD2-CE3 3.71Å; L45-W216 HydrophobicContact CD2-CG 4.49Å; L45-W216 HydrophobicContact CD2-CH2 4.19Å; L45-W216 HydrophobicContact CD2-CZ2 4.35Å; L45-W216 HydrophobicContact CD2-CZ3 3.86Å; V206-W216 HydrophobicContact CG2-CD2 4.28Å; V206-W216 HydrophobicContact CG2-CG 4.26Å; V206-W216 HydrophobicContact CG2-CZ2 4.19Å; V206-W216 VanDerWaalsContact CG2-NE1 3.3Å; G207-W216 WeakPolarHBondContact O-CZ2 3.29Å; G207-W216 PolarHBondContact O-NE1 3.42Å; R213-W216 HydrophobicContact CB-CD2 4.15Å; R213-W216 HydrophobicContact CB-CE3 4.45Å; R213-W216 HydrophobicContact CB-CZ2 4.37Å; R213-W216 HydrophobicContact CG-CD2 4.37Å; R213-W216 HydrophobicContact CG-CH2 4Å; R213-W216 HydrophobicContact CG-CZ2 3.7Å; R213-W216 HydrophobicContact CG-CZ3 4.45Å; R213-W216 VanDerWaalsContact O-CB 3.3Å; R213-W216 WeakPolarHBondContact O-CB 3.11Å; R213-W216 VanDerWaalsContact O-CG 3.29Å; R213-W216 PolarHBondContact O-N 2.85Å; R213-W216 VanDerWaalsContact O-N 3.1Å; R214-W216 VanDerWaalsContact C-N 3.32Å; W216-H218 PolarHBondContact O-N 3.43Å; W216-C219 PolarHBondContact O-N 3.4Å; W216-C219 PolarHBondContact O-SG 3.18Å; W216-F220 HydrophobicContact CB-CE1 3.67Å; W216-F220 HydrophobicContact CB-CZ 3.89Å; W216-F220 WeakPolarHBondContact O-CD1 3.34Å; W216-F220 VanDerWaalsContact O-CE1 3.25Å; W216-F220 WeakPolarHBondContact O-CE1 3.24Å; W216-L254 HydrophobicContact CH2-CD1 4Å; W216-L254 HydrophobicContact CH2-CD2 3.83Å; W216-L254 HydrophobicContact CH2-CG 4.39Å; W216-L254 HydrophobicContact CZ3-CD1 3.72Å; W216-L254 HydrophobicContact CZ3-CD2 4.32Å; W216-L254 HydrophobicContact CZ3-CG 4.39Å; W216-I258 HydrophobicContact CE3-CD1 4.17Å; W216-I258 HydrophobicContact CZ3-CD1 4.02Å; W216-I258 HydrophobicContact CZ3-CG1 4.45Å
217	I	93.1	Very high	94.4	Very high	93 Å²	93	55.1 Å²	55.1	48%	0.477	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-54.3	-28.4	178.5	-166.1	166.1	0	0	0	112.9	K215 C219 F220	K215-I217 PolarHBondContact O-N 3.25Å; I217-C219 PolarHBondContact O-N 3.35Å; I217-C219 VanDerWaalsContact O-N 3.13Å; I217-F220 PolarHBondContact O-N 2.82Å
218	H	93.4	Very high	94.6	Very high	152 Å²	152	55.1 Å²	55.1	70%	0.704	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-70.7	-3.4	178.9	-59.9	-61.8	0	0	0	114.4	I189 K215 W216	I189-H218 HydrophobicContact CD1-CB 3.78Å; K215-H218 WeakPolarHBondContact O-CB 3.46Å; K215-H218 PolarHBondContact O-CD2 2.96Å; K215-H218 PolarHBondContact O-N 3.2Å; K215-H218 VanDerWaalsContact O-N 3.1Å; W216-H218 PolarHBondContact O-N 3.43Å
219	C	94.8	Very high	94.8	Very high	2 Å²	2	55 Å²	55	1%	0.014	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-126.5	13	176.8	65.8	0	0	0	0	113.9	K41 L43 I189 V204 W216 I217 V223	K41-C219 WeakPolarHBondContact CE-O 3.1Å; K41-C219 PolarHBondContact NZ-O 3.28Å; L43-C219 HydrophobicContact CD1-CB 4.47Å; L43-C219 WeakPolarHBondContact CD1-SG 3.42Å; I189-C219 HydrophobicContact CD1-CB 4.32Å; I189-C219 HydrophobicContact CG2-CB 4.32Å; V204-C219 HydrophobicContact CG1-CB 3.94Å; W216-C219 PolarHBondContact O-N 3.4Å; W216-C219 PolarHBondContact O-SG 3.18Å; I217-C219 PolarHBondContact O-N 3.35Å; I217-C219 VanDerWaalsContact O-N 3.13Å; C219-V223 WeakPolarHBondContact O-CG2 3.49Å
220	F	94.6	Very high	95.1	Very high	10 Å²	10	53.5 Å²	53.5	4%	0.044	25%	0.252	C	S	.	.			trans	-80.6	-17.4	-176.3	-75.8	9.1	0	0	0	114.3	L43 W216 I217 I258 Y261 W263 F264	L43-F220 HydrophobicContact CD2-CD1 3.78Å; L43-F220 HydrophobicContact CD2-CE1 3.9Å; W216-F220 HydrophobicContact CB-CE1 3.67Å; W216-F220 HydrophobicContact CB-CZ 3.89Å; W216-F220 WeakPolarHBondContact O-CD1 3.34Å; W216-F220 VanDerWaalsContact O-CE1 3.25Å; W216-F220 WeakPolarHBondContact O-CE1 3.24Å; I217-F220 PolarHBondContact O-N 2.82Å; F220-I258 HydrophobicContact CZ-CD1 4.36Å; F220-Y261 AromaticContact CE2-CD2 3.97Å; F220-Y261 HydrophobicContact CE2-CD2 3.97Å; F220-Y261 HydrophobicContact CE2-CE2 4.11Å; F220-W263 HydrophobicContact CB-CB 4.11Å; F220-W263 HydrophobicContact CB-CD2 3.95Å; F220-W263 HydrophobicContact CB-CE3 4.05Å; F220-W263 HydrophobicContact CB-CG 3.99Å; F220-W263 HydrophobicContact CD2-CB 4.1Å; F220-W263 AromaticContact CD2-CD1 3.75Å; F220-W263 HydrophobicContact CD2-CD2 4.41Å; F220-W263 AromaticContact CD2-CG 3.83Å; F220-W263 HydrophobicContact CD2-CG 3.83Å; F220-W263 HydrophobicContact CG-CB 4.47Å; F220-W263 HydrophobicContact CG-CG 4.4Å; F220-F264 HydrophobicContact CB-CE1 4.27Å; F220-F264 HydrophobicContact CB-CZ 4.27Å; F220-F264 HydrophobicContact CD1-CE1 4.03Å; F220-F264 HydrophobicContact CD1-CE2 4.32Å; F220-F264 AromaticContact CD1-CZ 3.38Å; F220-F264 HydrophobicContact CD1-CZ 3.38Å; F220-F264 HydrophobicContact CD2-CE2 4.13Å; F220-F264 AromaticContact CD2-CZ 3.81Å; F220-F264 HydrophobicContact CD2-CZ 3.81Å; F220-F264 HydrophobicContact CE1-CE1 4.49Å; F220-F264 HydrophobicContact CE1-CE2 4.09Å; F220-F264 AromaticContact CE1-CZ 3.46Å; F220-F264 HydrophobicContact CE1-CZ 3.46Å; F220-F264 VanDerWaalsContact CE1-CZ 3.46Å; F220-F264 AromaticContact CE2-CE2 3.9Å; F220-F264 HydrophobicContact CE2-CE2 3.9Å; F220-F264 AromaticContact CE2-CZ 3.89Å; F220-F264 HydrophobicContact CE2-CZ 3.89Å; F220-F264 HydrophobicContact CG-CE1 4.05Å; F220-F264 HydrophobicContact CG-CE2 4.34Å; F220-F264 AromaticContact CG-CZ 3.56Å; F220-F264 HydrophobicContact CG-CZ 3.56Å; F220-F264 AromaticContact CZ-CE2 3.87Å; F220-F264 HydrophobicContact CZ-CE2 3.87Å; F220-F264 AromaticContact CZ-CZ 3.72Å; F220-F264 HydrophobicContact CZ-CZ 3.72Å
221	E	92.1	Very high	95.3	Very high	126 Å²	126	49.5 Å²	49.5	59%	0.589	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	138.2	176.3	-68.6	-177.2	-178.3	0	0	112.1	K41 V223 W263	K41-E221 WeakPolarHBondContact CD-O 3.34Å; K41-E221 PolarHBondContact NZ-O 3.19Å; E221-V223 VanDerWaalsContact C-N 3.28Å; E221-V223 PolarHBondContact O-N 2.75Å; E221-W263 HydrophobicContact CG-CZ3 3.95Å
222	N	90.2	Very high	95.5	Very high	144 Å²	144	45.3 Å²	45.3	77%	0.77	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	38.7	171.5	-54.4	-44.6	0	0	0	114	K41 T224	K41-N222 WeakPolarHBondContact CB-O 3.32Å; K41-N222 WeakPolarHBondContact CD-O 3.41Å; N222-T224 PolarHBondContact O-N 2.91Å
223	V	95.2	Very high	95.6	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.067	20%	0.202	C	C	.	.			trans	-78.5	117.8	175	173.9	0	0	0	0	109.9	K41 L43 C219 E221 S225 I226 F264 S267	K41-V223 HydrophobicContact CD-CG2 4.03Å; L43-V223 HydrophobicContact CB-CG1 3.76Å; L43-V223 HydrophobicContact CB-CG2 4.02Å; L43-V223 HydrophobicContact CD2-CG2 3.96Å; C219-V223 WeakPolarHBondContact O-CG2 3.49Å; E221-V223 VanDerWaalsContact C-N 3.28Å; E221-V223 PolarHBondContact O-N 2.75Å; V223-S225 WeakPolarHBondContact CG1-O 3.4Å; V223-I226 HydrophobicContact CG1-CG1 4.29Å; V223-F264 HydrophobicContact CB-CD1 4.2Å; V223-F264 HydrophobicContact CB-CE1 4.08Å; V223-F264 HydrophobicContact CG1-CD1 4.32Å; V223-F264 HydrophobicContact CG1-CE1 4.25Å; V223-F264 HydrophobicContact CG2-CE1 3.98Å; V223-S267 WeakPolarHBondContact O-CB 3.46Å; V223-S267 PolarHBondContact O-OG 3.34Å
224	T	93.5	Very high	95.7	Very high	26 Å²	26	41.9 Å²	41.9	16%	0.16	19%	0.194	C	C	.	.	S	Bend	trans	-72.1	-46.9	175.6	-53.3	0	0	0	0	111.4	L40 K41 N222 S267 S268 I348 N352	L40-T224 HydrophobicContact CB-CG2 4.25Å; L40-T224 HydrophobicContact CD2-CG2 4.01Å; K41-T224 PolarHBondContact N-OG1 3.45Å; K41-T224 WeakPolarHBondContact O-CB 3.4Å; K41-T224 PolarHBondContact O-N 2.94Å; N222-T224 PolarHBondContact O-N 2.91Å; T224-S267 WeakPolarHBondContact O-CA 3.47Å; T224-S268 PolarHBondContact O-N 3.47Å; T224-S268 VanDerWaalsContact O-N 3.16Å; T224-S268 PolarHBondContact O-OG 3.4Å; T224-I348 HydrophobicContact CG2-CG2 4.1Å; T224-N352 WeakPolarHBondContact CG2-ND2 3.15Å; T224-N352 WeakPolarHBondContact CG2-OD1 3.29Å
225	S	95.2	Very high	95.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.2	-176.9	-54.1	0	0	0	0	111.1	K41 L42 L43 V223 S268 I348	K41-S225 PolarHBondContact O-N 2.87Å; L42-S225 WeakPolarHBondContact CA-O 3.36Å; L43-S225 PolarHBondContact N-O 2.65Å; V223-S225 WeakPolarHBondContact CG1-O 3.4Å; S225-S268 CarbonylContact C-O 3.49Å; S225-S268 WeakPolarHBondContact CA-O 3.47Å; S225-S268 WeakPolarHBondContact CB-OG 3.43Å; S225-S268 PolarHBondContact OG-OG 3.48Å; S225-I348 WeakPolarHBondContact OG-CG1 3.47Å
226	I	97.1	Very high	95.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.1	165.4	-60	159.4	0	0	0	108.2	L45 V223 F228 I258 F264 S268 V269 I270	L45-I226 HydrophobicContact CD1-CG2 3.98Å; L45-I226 HydrophobicContact CG-CG2 4.47Å; V223-I226 HydrophobicContact CG1-CG1 4.29Å; I226-F228 HydrophobicContact CG2-CB 4.33Å; I226-I258 HydrophobicContact CD1-CG2 3.83Å; I226-I258 HydrophobicContact CG2-CG2 4.13Å; I226-F264 HydrophobicContact CD1-CB 3.49Å; I226-F264 VanDerWaalsContact CD1-CB 3.49Å; I226-F264 HydrophobicContact CD1-CD1 3.91Å; I226-F264 HydrophobicContact CD1-CD2 3.7Å; I226-F264 HydrophobicContact CD1-CE2 4.32Å; I226-F264 HydrophobicContact CD1-CG 3.44Å; I226-F264 VanDerWaalsContact CD1-CG 3.44Å; I226-F264 HydrophobicContact CG1-CB 4.44Å; I226-F264 HydrophobicContact CG1-CD1 4.04Å; I226-F264 HydrophobicContact CG1-CE1 4.36Å; I226-F264 HydrophobicContact CG1-CG 4.11Å; I226-S268 PolarHBondContact N-O 3.24Å; I226-V269 HydrophobicContact CD1-CG2 4.08Å; I226-I270 PolarHBondContact O-N 3.28Å
227	M	97.5	Very high	95.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	99.2	166.9	-69.4	-175.8	178.2	0	0	108.3	L42 L43 L44 L45 F55 I270 F272 F341 V344 I348	L42-M227 HydrophobicContact CB-CE 4.31Å; L42-M227 HydrophobicContact CB-SD 4.4Å; L42-M227 HydrophobicContact CD1-CE 3.46Å; L42-M227 VanDerWaalsContact CD1-CE 3.46Å; L42-M227 HydrophobicContact CD1-SD 4.24Å; L42-M227 HydrophobicContact CD2-CE 4.14Å; L42-M227 HydrophobicContact CG-CE 4.17Å; L43-M227 PolarHBondContact O-N 3.45Å; L44-M227 CarbonylContact C-O 3.44Å; L44-M227 WeakPolarHBondContact CA-O 3.48Å; L44-M227 HydrophobicContact CG-CB 4.25Å; L45-M227 PolarHBondContact N-O 3.48Å; F55-M227 HydrophobicContact CE1-SD 4.21Å; M227-I270 WeakPolarHBondContact CA-O 3.26Å; M227-I270 HydrophobicContact CE-CD1 4.05Å; M227-I270 HydrophobicContact CG-CB 4.41Å; M227-I270 HydrophobicContact CG-CD1 4.24Å; M227-F272 HydrophobicContact CB-CD2 4.27Å; M227-F272 HydrophobicContact CB-CE2 3.92Å; M227-F272 HydrophobicContact CG-CE2 3.93Å; M227-F272 HydrophobicContact SD-CE2 3.89Å; M227-F272 HydrophobicContact SD-CZ 4.47Å; M227-F341 HydrophobicContact CE-CE2 4.2Å; M227-V344 HydrophobicContact CE-CG1 3.5Å; M227-V344 VanDerWaalsContact CE-CG1 3.5Å; M227-I348 HydrophobicContact CE-CD1 3.71Å
228	F	98.5	Very high	96	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.2	-179.4	-161.7	-84.3	0	0	0	110.5	L45 I226 V230 L254 F255 I258 I270 L271 F272 F313	L45-F228 HydrophobicContact CB-CD2 3.74Å; L45-F228 HydrophobicContact CB-CE2 4.16Å; L45-F228 WeakPolarHBondContact O-CA 3.4Å; I226-F228 HydrophobicContact CG2-CB 4.33Å; F228-V230 HydrophobicContact CD1-CG2 3.83Å; F228-V230 HydrophobicContact CE1-CG2 3.89Å; F228-L254 HydrophobicContact CE2-CD2 4.15Å; F228-L254 HydrophobicContact CE2-CG 3.98Å; F228-L254 HydrophobicContact CZ-CB 4.22Å; F228-L254 HydrophobicContact CZ-CD2 3.88Å; F228-L254 HydrophobicContact CZ-CG 3.88Å; F228-F255 HydrophobicContact CB-CD2 3.88Å; F228-F255 HydrophobicContact CB-CE2 3.9Å; F228-F255 HydrophobicContact CD1-CB 4.23Å; F228-F255 AromaticContact CD1-CD2 3.53Å; F228-F255 HydrophobicContact CD1-CD2 3.53Å; F228-F255 HydrophobicContact CD1-CE2 4.28Å; F228-F255 HydrophobicContact CD1-CG 4.25Å; F228-F255 AromaticContact CD2-CD2 3.77Å; F228-F255 HydrophobicContact CD2-CD2 3.77Å; F228-F255 HydrophobicContact CE1-CB 3.73Å; F228-F255 AromaticContact CE1-CD2 3.93Å; F228-F255 HydrophobicContact CE1-CD2 3.93Å; F228-F255 HydrophobicContact CE1-CG 4.24Å; F228-F255 HydrophobicContact CE2-CB 4.18Å; F228-F255 HydrophobicContact CE2-CD2 4.14Å; F228-F255 AromaticContact CG-CD2 3.44Å; F228-F255 HydrophobicContact CG-CD2 3.44Å; F228-F255 VanDerWaalsContact CG-CD2 3.44Å; F228-F255 HydrophobicContact CG-CE2 4.01Å; F228-F255 HydrophobicContact CG-CG 4.48Å; F228-F255 HydrophobicContact CZ-CB 3.69Å; F228-F255 HydrophobicContact CZ-CD2 4.21Å; F228-F255 HydrophobicContact CZ-CG 4.47Å; F228-I258 HydrophobicContact CD2-CG1 4.49Å; F228-I258 HydrophobicContact CD2-CG2 4.48Å; F228-I258 HydrophobicContact CE2-CB 4.45Å; F228-I258 HydrophobicContact CE2-CG1 4.09Å; F228-I270 PolarHBondContact N-O 3.3Å; F228-L271 HydrophobicContact CB-CD1 4.48Å; F228-L271 HydrophobicContact CD1-CD1 4.19Å; F228-F272 PolarHBondContact O-N 2.86Å; F228-F313 HydrophobicContact CE1-CE1 4.42Å
229	L	98.7	Very high	95.8	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.2	-179.4	-71.9	91.7	0	0	0	110.7	L44 L45 S50 K52 F55 F272	L44-L229 HydrophobicContact CB-CD1 4.39Å; L44-L229 HydrophobicContact CD2-CD1 4.29Å; L44-L229 HydrophobicContact CG-CD1 4.35Å; L45-L229 PolarHBondContact O-N 3.29Å; S50-L229 WeakPolarHBondContact CB-O 3.26Å; S50-L229 WeakPolarHBondContact OG-CB 3.27Å; S50-L229 PolarHBondContact OG-O 3.4Å; S50-L229 VanDerWaalsContact OG-O 3.11Å; K52-L229 HydrophobicContact CG-CB 4.26Å; K52-L229 HydrophobicContact CG-CD1 3.87Å; K52-L229 HydrophobicContact CG-CG 4.43Å; F55-L229 HydrophobicContact CB-CD2 4.22Å; L229-F272 HydrophobicContact CD1-CD2 4.12Å; L229-F272 HydrophobicContact CG-CB 3.99Å; L229-F272 HydrophobicContact CG-CD2 4.03Å; L229-F272 HydrophobicContact CG-CG 4.45Å
230	V	98.7	Very high	95.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.3	174.1	-179.4	0	0	0	0	108.5	F228 L232 M248 L271 F272 N274 F313	F228-V230 HydrophobicContact CD1-CG2 3.83Å; F228-V230 HydrophobicContact CE1-CG2 3.89Å; V230-L232 PolarHBondContact O-N 2.7Å; V230-M248 HydrophobicContact CG1-CE 4.15Å; V230-M248 HydrophobicContact CG1-SD 3.62Å; V230-L271 HydrophobicContact CG2-CD1 3.67Å; V230-F272 PolarHBondContact N-O 3.03Å; V230-N274 PolarHBondContact O-N 3.23Å; V230-F313 HydrophobicContact CB-CE1 4.46Å; V230-F313 HydrophobicContact CB-CZ 4.2Å; V230-F313 HydrophobicContact CG1-CE1 4.23Å; V230-F313 HydrophobicContact CG1-CE2 3.71Å; V230-F313 HydrophobicContact CG1-CZ 3.51Å; V230-F313 HydrophobicContact CG2-CD1 3.82Å; V230-F313 HydrophobicContact CG2-CE1 3.36Å; V230-F313 HydrophobicContact CG2-CE2 4.17Å; V230-F313 HydrophobicContact CG2-CG 4.42Å; V230-F313 HydrophobicContact CG2-CZ 3.56Å
231	A	98.4	Very high	95	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	109.6	169.5	0	0	0	0	0	109.9	S233 E234 M248 K275	A231-S233 PolarHBondContact O-N 3.32Å; A231-E234 HydrophobicContact CB-CB 4.3Å; A231-E234 VanDerWaalsContact CB-CD 3.49Å; A231-E234 HydrophobicContact CB-CG 3.61Å; A231-E234 WeakPolarHBondContact O-CB 3.47Å; A231-E234 PolarHBondContact O-N 3.39Å; A231-M248 VanDerWaalsContact O-CE 3.26Å; A231-M248 WeakPolarHBondContact O-CE 3.4Å; A231-K275 HydrophobicContact CB-CD 3.75Å; A231-K275 HydrophobicContact CB-CG 4.39Å
232	L	98.7	Very high	94.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-57.7	-34.6	177.7	-73.3	171.3	0	0	0	112.6	V230 E234 Y235 L273 N274 K276 L279 R306 I309 F328	V230-L232 PolarHBondContact O-N 2.7Å; L232-E234 PolarHBondContact O-N 3.27Å; L232-Y235 WeakPolarHBondContact O-CD1 3.34Å; L232-L273 HydrophobicContact CD1-CB 4.04Å; L232-L273 HydrophobicContact CD2-CB 3.98Å; L232-L273 HydrophobicContact CD2-CD2 3.67Å; L232-L273 HydrophobicContact CD2-CG 4.45Å; L232-L273 HydrophobicContact CG-CB 4.01Å; L232-N274 VanDerWaalsContact CB-O 3.24Å; L232-N274 WeakPolarHBondContact CB-O 3.36Å; L232-N274 WeakPolarHBondContact CG-O 3.35Å; L232-N274 PolarHBondContact N-O 3.19Å; L232-K276 HydrophobicContact CD1-CB 3.93Å; L232-L279 HydrophobicContact CB-CB 3.89Å; L232-L279 HydrophobicContact CB-CD2 3.92Å; L232-L279 HydrophobicContact CB-CG 4.42Å; L232-L279 HydrophobicContact CD1-CD2 4.08Å; L232-L279 HydrophobicContact CD2-CD2 4.23Å; L232-L279 HydrophobicContact CG-CD2 4.32Å; L232-R306 HydrophobicContact CD1-CG 3.99Å; L232-I309 HydrophobicContact CD2-CB 4.04Å; L232-I309 HydrophobicContact CD2-CD1 3.89Å; L232-I309 HydrophobicContact CD2-CG2 3.73Å; L232-F328 HydrophobicContact CD1-CD1 4.07Å
233	S	97.3	Very high	94.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-72.2	-5	-178.1	63.8	0	0	0	0	114.9	A231 Y235 K275 K282	A231-S233 PolarHBondContact O-N 3.32Å; S233-Y235 VanDerWaalsContact C-N 3.35Å; S233-K275 VanDerWaalsContact OG-CD 3.27Å; S233-K275 WeakPolarHBondContact OG-CD 3.36Å; S233-K282 PolarHBondContact O-NZ 3.47Å
234	E	97.1	Very high	94.3	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.009	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-88.8	1.9	-177	-72	-176.2	-176.4	0	0	113.4	A231 L232 D236 Q237 R247 K275	A231-E234 HydrophobicContact CB-CB 4.3Å; A231-E234 VanDerWaalsContact CB-CD 3.49Å; A231-E234 HydrophobicContact CB-CG 3.61Å; A231-E234 WeakPolarHBondContact O-CB 3.47Å; A231-E234 PolarHBondContact O-N 3.39Å; L232-E234 PolarHBondContact O-N 3.27Å; E234-D236 PolarHBondContact O-N 3.18Å; E234-Q237 PolarHBondContact O-N 2.93Å; E234-R247 HydrophobicContact CB-CB 3.77Å; E234-R247 HydrophobicContact CG-CB 4.33Å; E234-R247 IonicContact OE1-CZ 3.92Å; E234-R247 IonicContact OE1-NE 3.19Å; E234-R247 PolarHBondContact OE1-NE 2.87Å; E234-R247 IonicContact OE1-NH2 3.63Å; E234-R247 PolarHBondContact OE1-NH2 2.88Å; E234-R247 IonicContact OE2-CZ 2.68Å; E234-R247 IonicContact OE2-NE 3.48Å; E234-R247 PolarHBondContact OE2-NE 2.84Å; E234-R247 IonicContact OE2-NH2 3.64Å; E234-K275 IonicContact OE1-NZ 2.68Å
235	Y	97.8	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.9	-176.3	74.2	-87	0	0	0	114.7	L232 S233 N246 L279 K282 I283 S286 L288 Y291	L232-Y235 WeakPolarHBondContact O-CD1 3.34Å; S233-Y235 VanDerWaalsContact C-N 3.35Å; Y235-N246 PolarHBondContact O-ND2 3.48Å; Y235-L279 HydrophobicContact CD1-CD1 3.73Å; Y235-L279 HydrophobicContact CE1-CD1 3.51Å; Y235-K282 HydrophobicContact CE1-CB 4.07Å; Y235-K282 VanDerWaalsContact OH-C 3.32Å; Y235-K282 WeakPolarHBondContact OH-CB 3.4Å; Y235-K282 PolarHBondContact OH-O 3.36Å; Y235-I283 PolarHBondContact OH-N 3.38Å; Y235-S286 WeakPolarHBondContact OH-CB 3.36Å; Y235-S286 PolarHBondContact OH-O 3.1Å; Y235-L288 HydrophobicContact CD2-CD1 3.53Å; Y235-L288 HydrophobicContact CE2-CD1 4.25Å; Y235-L288 HydrophobicContact CG-CD1 3.81Å; Y235-Y291 HydrophobicContact CD2-CD2 4.11Å; Y235-Y291 HydrophobicContact CE2-CD2 4.23Å; Y235-Y291 HydrophobicContact CE2-CE2 4.5Å; Y235-Y291 WeakPolarHBondContact O-CB 3.35Å
236	D	96.8	Very high	94.4	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.037	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	21	-177.7	65.3	-10.1	0	0	0	112.5	E234 K282 S286 Y291	E234-D236 PolarHBondContact O-N 3.18Å; D236-K282 WeakPolarHBondContact OD1-CE 3.3Å; D236-K282 IonicContact OD1-NZ 3.78Å; D236-K282 PolarHBondContact OD1-NZ 3.02Å; D236-K282 WeakPolarHBondContact OD2-CE 3.45Å; D236-K282 IonicContact OD2-NZ 2.81Å; D236-K282 PolarHBondContact OD2-NZ 2.96Å; D236-S286 WeakPolarHBondContact CB-OG 3.31Å; D236-S286 WeakPolarHBondContact OD2-CB 3.32Å; D236-S286 PolarHBondContact OD2-OG 3.39Å; D236-Y291 HydrophobicContact CB-CD1 4.19Å; D236-Y291 HydrophobicContact CB-CD2 3.81Å; D236-Y291 HydrophobicContact CB-CE1 3.75Å; D236-Y291 HydrophobicContact CB-CE2 3.35Å; D236-Y291 HydrophobicContact CB-CG 4.22Å
237	Q	95.9	Very high	94.3	Very high	14 Å²	14	32 Å²	32	7%	0.065	17%	0.171	C	C	.	.			trans	-117.9	150	-178	-70.4	179.9	-32.6	0	0	111.7	E234 N246 R247	E234-Q237 PolarHBondContact O-N 2.93Å; Q237-N246 WeakPolarHBondContact O-CA 3.31Å; Q237-R247 HydrophobicContact CB-CG 4.16Å; Q237-R247 PolarHBondContact O-N 3.15Å
238	V	94.2	Very high	94.4	Very high	51 Å²	51	32 Å²	32	31%	0.309	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-95.8	157.6	172.1	-61	0	0	0	0	111.4	Q152 D243 E245 R247	Q152-V238 PolarHBondContact NE2-O 3.22Å; V238-D243 WeakPolarHBondContact CG1-O 3.41Å; V238-E245 CarbonylContact C-O 3.55Å; V238-E245 VanDerWaalsContact CA-O 3.23Å; V238-E245 WeakPolarHBondContact CA-O 3.32Å; V238-R247 VanDerWaalsContact C-CG 3.41Å; V238-R247 VanDerWaalsContact O-CD 3.31Å; V238-R247 WeakPolarHBondContact O-CD 3.31Å; V238-R247 VanDerWaalsContact O-CG 3.22Å; V238-R247 WeakPolarHBondContact O-CG 3.29Å
239	L	90.6	Very high	94.3	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	19%	0.189	C	C	.	.			trans	-64.5	151	177.7	-68.4	171.3	0	0	0	111.7	Q152 S242 E245 R247 E250	Q152-L239 PolarHBondContact NE2-O 2.98Å; L239-S242 WeakPolarHBondContact CB-O 3.31Å; L239-S242 PolarHBondContact N-O 3.28Å; L239-S242 CarbonylContact O-C 3.5Å; L239-S242 VanDerWaalsContact O-O 3.09Å; L239-E245 HydrophobicContact CD1-CB 3.78Å; L239-E245 HydrophobicContact CG-CB 4.3Å; L239-E245 PolarHBondContact N-O 3.18Å; L239-R247 HydrophobicContact CD2-CB 4.38Å; L239-R247 HydrophobicContact CD2-CG 3.89Å; L239-R247 HydrophobicContact CG-CG 4.31Å; L239-E250 HydrophobicContact CD1-CB 3.94Å; L239-E250 HydrophobicContact CD1-CG 3.95Å; L239-E250 HydrophobicContact CD2-CB 3.91Å; L239-E250 HydrophobicContact CD2-CG 3.79Å; L239-E250 HydrophobicContact CG-CB 4.28Å; L239-E250 HydrophobicContact CG-CG 4.46Å
240	V	86	Confident	94.3	Very high	94 Å²	94	36.6 Å²	36.6	57%	0.57	19%	0.193	S	C	*	.	S	Bend	trans	-65.6	-37.8	168.9	-179.3	0	0	0	0	109.4	Q152	Q152-V240 HydrophobicContact CB-CG2 4.49Å; Q152-V240 HydrophobicContact CG-CB 4.4Å; Q152-V240 HydrophobicContact CG-CG2 3.82Å; Q152-V240 VanDerWaalsContact OE1-CG2 3.31Å
241	E	86.5	Confident	94.2	Very high	91 Å²	91	36.7 Å²	36.7	43%	0.425	19%	0.193	S	C	.	.	S	Bend	trans	-82.9	-10.8	-176.9	-56.8	97.1	139.8	0	0	114.2	R210	R210-E241 PolarHBondContact N-OE1 3.09Å
242	S	87.6	Confident	94.2	Very high	25 Å²	25	38.1 Å²	38.1	18%	0.175	20%	0.2	C	C	.	.			trans	-158	114.7	-177	-173.7	0	0	0	0	110.7	L239 N244 E245	L239-S242 WeakPolarHBondContact CB-O 3.31Å; L239-S242 PolarHBondContact N-O 3.28Å; L239-S242 CarbonylContact O-C 3.5Å; L239-S242 VanDerWaalsContact O-O 3.09Å; S242-N244 PolarHBondContact O-N 3.21Å; S242-E245 VanDerWaalsContact CB-OE1 3.31Å; S242-E245 WeakPolarHBondContact CB-OE1 3.27Å; S242-E245 WeakPolarHBondContact OG-CG 3.25Å; S242-E245 PolarHBondContact OG-OE1 3.32Å
243	D	85.1	Confident	94.2	Very high	119 Å²	119	40.6 Å²	40.6	64%	0.636	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.5	-176	59.2	-9	0	0	0	114.2	V238	V238-D243 WeakPolarHBondContact CG1-O 3.41Å
244	N	88.9	Confident	94.2	Very high	144 Å²	144	41.2 Å²	41.2	77%	0.77	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	3.2	-178.4	-63.8	-37	0	0	0	113.8	S242	S242-N244 PolarHBondContact O-N 3.21Å
245	E	93.5	Very high	94.2	Very high	72 Å²	72	41.1 Å²	41.1	34%	0.336	22%	0.223	S	C	.	.	S	Bend	trans	-116.6	126.9	-175.7	-71.4	179.2	-118.7	0	0	111.4	R210 V238 L239 S242	R210-E245 IonicContact CZ-OE2 3.51Å; R210-E245 IonicContact NH1-OE1 2.84Å; R210-E245 PolarHBondContact NH1-OE1 3.48Å; R210-E245 IonicContact NH1-OE2 3.71Å; R210-E245 PolarHBondContact NH1-OE2 2.89Å; R210-E245 IonicContact NH2-OE1 3.26Å; R210-E245 IonicContact NH2-OE2 2.71Å; R210-E245 PolarHBondContact NH2-OE2 3.16Å; V238-E245 CarbonylContact C-O 3.55Å; V238-E245 VanDerWaalsContact CA-O 3.23Å; V238-E245 WeakPolarHBondContact CA-O 3.32Å; L239-E245 HydrophobicContact CD1-CB 3.78Å; L239-E245 HydrophobicContact CG-CB 4.3Å; L239-E245 PolarHBondContact N-O 3.18Å; S242-E245 VanDerWaalsContact CB-OE1 3.31Å; S242-E245 WeakPolarHBondContact CB-OE1 3.27Å; S242-E245 WeakPolarHBondContact OG-CG 3.25Å; S242-E245 PolarHBondContact OG-OE1 3.32Å
246	N	96.7	Very high	94.2	Very high	32 Å²	32	48.5 Å²	48.5	17%	0.171	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-69.5	131.9	176.3	-177.5	-72.5	0	0	0	111.2	Y235 Q237 M248 E249 E250	Y235-N246 PolarHBondContact O-ND2 3.48Å; Q237-N246 WeakPolarHBondContact O-CA 3.31Å; N246-M248 VanDerWaalsContact C-N 3.34Å; N246-M248 PolarHBondContact O-N 2.93Å; N246-M248 WeakPolarHBondContact OD1-CA 3.28Å; N246-M248 VanDerWaalsContact OD1-CB 3.28Å; N246-M248 WeakPolarHBondContact OD1-CB 3.42Å; N246-M248 PolarHBondContact OD1-N 3.18Å; N246-E249 HydrophobicContact CB-CB 4.13Å; N246-E249 HydrophobicContact CB-CG 4.13Å; N246-E249 PolarHBondContact O-N 3.45Å; N246-E249 PolarHBondContact OD1-N 3.38Å; N246-E249 VanDerWaalsContact OD1-N 3.16Å; N246-E250 PolarHBondContact O-N 3.11Å
247	R	96.7	Very high	94.1	Very high	11 Å²	11	50.9 Å²	50.9	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-37	-177.5	-71	-171.4	71.4	145.6	-11.8	113.2	G48 E49 E234 Q237 V238 L239 E250 S251	G48-R247 PolarHBondContact O-NH2 3.44Å; E49-R247 IonicContact OE2-CZ 4Å; E49-R247 IonicContact OE2-NH1 2.72Å; E49-R247 PolarHBondContact OE2-NH1 3.2Å; E49-R247 IonicContact OE2-NH2 3.09Å; E49-R247 PolarHBondContact OE2-NH2 3.26Å; E234-R247 HydrophobicContact CB-CB 3.77Å; E234-R247 HydrophobicContact CG-CB 4.33Å; E234-R247 IonicContact OE1-CZ 3.92Å; E234-R247 IonicContact OE1-NE 3.19Å; E234-R247 PolarHBondContact OE1-NE 2.87Å; E234-R247 IonicContact OE1-NH2 3.63Å; E234-R247 PolarHBondContact OE1-NH2 2.88Å; E234-R247 IonicContact OE2-CZ 2.68Å; E234-R247 IonicContact OE2-NE 3.48Å; E234-R247 PolarHBondContact OE2-NE 2.84Å; E234-R247 IonicContact OE2-NH2 3.64Å; Q237-R247 HydrophobicContact CB-CG 4.16Å; Q237-R247 PolarHBondContact O-N 3.15Å; V238-R247 VanDerWaalsContact C-CG 3.41Å; V238-R247 VanDerWaalsContact O-CD 3.31Å; V238-R247 WeakPolarHBondContact O-CD 3.31Å; V238-R247 VanDerWaalsContact O-CG 3.22Å; V238-R247 WeakPolarHBondContact O-CG 3.29Å; L239-R247 HydrophobicContact CD2-CB 4.38Å; L239-R247 HydrophobicContact CD2-CG 3.89Å; L239-R247 HydrophobicContact CG-CG 4.31Å; R247-E250 PolarHBondContact O-N 3.48Å; R247-S251 PolarHBondContact O-N 3.43Å
248	M	98	Very high	94.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-37.3	177.4	-178.5	72.1	73.3	0	0	111.4	V230 A231 N246 S251 K252 F292 I309 F313	V230-M248 HydrophobicContact CG1-CE 4.15Å; V230-M248 HydrophobicContact CG1-SD 3.62Å; A231-M248 VanDerWaalsContact O-CE 3.26Å; A231-M248 WeakPolarHBondContact O-CE 3.4Å; N246-M248 VanDerWaalsContact C-N 3.34Å; N246-M248 PolarHBondContact O-N 2.93Å; N246-M248 WeakPolarHBondContact OD1-CA 3.28Å; N246-M248 VanDerWaalsContact OD1-CB 3.28Å; N246-M248 WeakPolarHBondContact OD1-CB 3.42Å; N246-M248 PolarHBondContact OD1-N 3.18Å; M248-S251 WeakPolarHBondContact O-CB 3.47Å; M248-S251 PolarHBondContact O-N 3.46Å; M248-K252 WeakPolarHBondContact O-CG 3.49Å; M248-K252 PolarHBondContact O-N 3.34Å; M248-F292 HydrophobicContact CB-CE2 4.27Å; M248-F292 HydrophobicContact CB-CZ 3.79Å; M248-F292 HydrophobicContact CG-CE1 4.46Å; M248-F292 HydrophobicContact CG-CE2 4.2Å; M248-F292 HydrophobicContact CG-CZ 3.64Å; M248-I309 HydrophobicContact CE-CD1 4.25Å; M248-I309 HydrophobicContact CE-CG2 4.04Å; M248-I309 HydrophobicContact SD-CG2 4.08Å; M248-F313 HydrophobicContact SD-CE2 3.57Å; M248-F313 VanDerWaalsContact SD-CE2 3.57Å; M248-F313 HydrophobicContact SD-CZ 3.82Å
249	E	97.7	Very high	94.2	Very high	79 Å²	79	48.5 Å²	48.5	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-41.2	172.2	-75.2	-64.8	174.5	0	0	112.4	N246 S251 K252 A253 F292	N246-E249 HydrophobicContact CB-CB 4.13Å; N246-E249 HydrophobicContact CB-CG 4.13Å; N246-E249 PolarHBondContact O-N 3.45Å; N246-E249 PolarHBondContact OD1-N 3.38Å; N246-E249 VanDerWaalsContact OD1-N 3.16Å; E249-S251 VanDerWaalsContact C-N 3.3Å; E249-S251 PolarHBondContact O-N 3.15Å; E249-K252 WeakPolarHBondContact O-CB 3.31Å; E249-K252 PolarHBondContact O-N 3.09Å; E249-K252 IonicContact OE1-NZ 3.04Å; E249-K252 PolarHBondContact OE1-NZ 2.98Å; E249-K252 WeakPolarHBondContact OE2-CD 3.36Å; E249-K252 VanDerWaalsContact OE2-CE 3.31Å; E249-K252 WeakPolarHBondContact OE2-CE 3.22Å; E249-K252 IonicContact OE2-NZ 2.95Å; E249-K252 PolarHBondContact OE2-NZ 3.22Å; E249-A253 WeakPolarHBondContact O-CB 3.47Å; E249-A253 PolarHBondContact O-N 2.68Å; E249-F292 HydrophobicContact CG-CE1 4.11Å; E249-F292 HydrophobicContact CG-CZ 4.33Å; E249-F292 VanDerWaalsContact OE1-CE1 3.25Å; E249-F292 WeakPolarHBondContact OE1-CE1 3.28Å
250	E	97.3	Very high	94.3	Very high	19 Å²	19	51.5 Å²	51.5	9%	0.089	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-41.9	171.1	172.1	71	169.9	0	0	111.6	T47 R210 R213 L239 N246 R247 A253 L254	T47-E250 HydrophobicContact CG2-CG 4.01Å; R210-E250 IonicContact CZ-OE1 3.44Å; R210-E250 IonicContact CZ-OE2 2.78Å; R210-E250 IonicContact NE-OE1 3.68Å; R210-E250 PolarHBondContact NE-OE1 3.13Å; R210-E250 IonicContact NE-OE2 2.56Å; R210-E250 IonicContact NH2-OE1 2.53Å; R210-E250 PolarHBondContact NH2-OE1 3.43Å; R210-E250 IonicContact NH2-OE2 2.86Å; R210-E250 PolarHBondContact NH2-OE2 2.98Å; R213-E250 IonicContact CZ-OE1 2.73Å; R213-E250 IonicContact NH1-OE1 2.87Å; R213-E250 PolarHBondContact NH1-OE1 3.32Å; R213-E250 IonicContact NH2-OE1 2.92Å; R213-E250 PolarHBondContact NH2-OE1 3.04Å; L239-E250 HydrophobicContact CD1-CB 3.94Å; L239-E250 HydrophobicContact CD1-CG 3.95Å; L239-E250 HydrophobicContact CD2-CB 3.91Å; L239-E250 HydrophobicContact CD2-CG 3.79Å; L239-E250 HydrophobicContact CG-CB 4.28Å; L239-E250 HydrophobicContact CG-CG 4.46Å; N246-E250 PolarHBondContact O-N 3.11Å; R247-E250 PolarHBondContact O-N 3.48Å; E250-A253 PolarHBondContact O-N 3.44Å; E250-L254 WeakPolarHBondContact O-CB 3.23Å; E250-L254 PolarHBondContact O-N 3.01Å
251	S	98.3	Very high	94.8	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-40.9	176.3	-174.4	0	0	0	0	112	R247 M248 E249 F255	R247-S251 PolarHBondContact O-N 3.43Å; M248-S251 WeakPolarHBondContact O-CB 3.47Å; M248-S251 PolarHBondContact O-N 3.46Å; E249-S251 VanDerWaalsContact C-N 3.3Å; E249-S251 PolarHBondContact O-N 3.15Å; S251-F255 WeakPolarHBondContact O-CB 3.43Å; S251-F255 PolarHBondContact O-N 3.19Å
252	K	98.1	Very high	95.1	Very high	31 Å²	31	52.1 Å²	52.1	14%	0.135	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-50.7	174.1	-76.2	167.9	60.7	-164.5	0	111.3	M248 E249 L254 F255 R256 F292 M312 F313 L316	M248-K252 WeakPolarHBondContact O-CG 3.49Å; M248-K252 PolarHBondContact O-N 3.34Å; E249-K252 WeakPolarHBondContact O-CB 3.31Å; E249-K252 PolarHBondContact O-N 3.09Å; E249-K252 IonicContact OE1-NZ 3.04Å; E249-K252 PolarHBondContact OE1-NZ 2.98Å; E249-K252 WeakPolarHBondContact OE2-CD 3.36Å; E249-K252 VanDerWaalsContact OE2-CE 3.31Å; E249-K252 WeakPolarHBondContact OE2-CE 3.22Å; E249-K252 IonicContact OE2-NZ 2.95Å; E249-K252 PolarHBondContact OE2-NZ 3.22Å; K252-L254 VanDerWaalsContact C-N 3.31Å; K252-L254 PolarHBondContact O-N 3Å; K252-F255 PolarHBondContact O-N 3.23Å; K252-R256 PolarHBondContact O-N 3.25Å; K252-F292 HydrophobicContact CD-CE1 4.29Å; K252-M312 HydrophobicContact CD-SD 4.16Å; K252-F313 HydrophobicContact CB-CZ 4.39Å; K252-F313 HydrophobicContact CG-CD2 4.3Å; K252-F313 HydrophobicContact CG-CE1 4.11Å; K252-F313 HydrophobicContact CG-CE2 3.72Å; K252-F313 HydrophobicContact CG-CZ 3.6Å; K252-L316 HydrophobicContact CB-CD1 3.94Å; K252-L316 HydrophobicContact CG-CD1 4.25Å; K252-L316 WeakPolarHBondContact O-CD1 3.38Å
253	A	97.4	Very high	95.4	Very high	51 Å²	51	57.3 Å²	57.3	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-58.1	-45.9	179	0	0	0	0	0	111.2	E249 E250 R256 T257	E249-A253 WeakPolarHBondContact O-CB 3.47Å; E249-A253 PolarHBondContact O-N 2.68Å; E250-A253 PolarHBondContact O-N 3.44Å; A253-R256 PolarHBondContact O-N 3.18Å; A253-T257 PolarHBondContact O-N 2.9Å; A253-T257 PolarHBondContact O-OG1 3.09Å
254	L	97.4	Very high	95.9	Very high	14 Å²	14	51.6 Å²	51.6	7%	0.073	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-46.6	175.7	-179.5	64.1	0	0	0	112.1	T47 W216 F228 E250 K252 R256 T257 I258	T47-L254 HydrophobicContact CG2-CD2 4.19Å; W216-L254 HydrophobicContact CH2-CD1 4Å; W216-L254 HydrophobicContact CH2-CD2 3.83Å; W216-L254 HydrophobicContact CH2-CG 4.39Å; W216-L254 HydrophobicContact CZ3-CD1 3.72Å; W216-L254 HydrophobicContact CZ3-CD2 4.32Å; W216-L254 HydrophobicContact CZ3-CG 4.39Å; F228-L254 HydrophobicContact CE2-CD2 4.15Å; F228-L254 HydrophobicContact CE2-CG 3.98Å; F228-L254 HydrophobicContact CZ-CB 4.22Å; F228-L254 HydrophobicContact CZ-CD2 3.88Å; F228-L254 HydrophobicContact CZ-CG 3.88Å; E250-L254 WeakPolarHBondContact O-CB 3.23Å; E250-L254 PolarHBondContact O-N 3.01Å; K252-L254 VanDerWaalsContact C-N 3.31Å; K252-L254 PolarHBondContact O-N 3Å; L254-R256 PolarHBondContact O-N 3.38Å; L254-T257 WeakPolarHBondContact O-CB 3.43Å; L254-T257 PolarHBondContact O-N 3.07Å; L254-I258 HydrophobicContact CD1-CG1 4.44Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 2.84Å
255	F	98.1	Very high	95.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-48.1	178.6	-178.5	-114.1	0	0	0	111.4	F228 S251 K252 T257 I258 I259 V269 L271 F313 L316 I324	F228-F255 HydrophobicContact CB-CD2 3.88Å; F228-F255 HydrophobicContact CB-CE2 3.9Å; F228-F255 HydrophobicContact CD1-CB 4.23Å; F228-F255 AromaticContact CD1-CD2 3.53Å; F228-F255 HydrophobicContact CD1-CD2 3.53Å; F228-F255 HydrophobicContact CD1-CE2 4.28Å; F228-F255 HydrophobicContact CD1-CG 4.25Å; F228-F255 AromaticContact CD2-CD2 3.77Å; F228-F255 HydrophobicContact CD2-CD2 3.77Å; F228-F255 HydrophobicContact CE1-CB 3.73Å; F228-F255 AromaticContact CE1-CD2 3.93Å; F228-F255 HydrophobicContact CE1-CD2 3.93Å; F228-F255 HydrophobicContact CE1-CG 4.24Å; F228-F255 HydrophobicContact CE2-CB 4.18Å; F228-F255 HydrophobicContact CE2-CD2 4.14Å; F228-F255 AromaticContact CG-CD2 3.44Å; F228-F255 HydrophobicContact CG-CD2 3.44Å; F228-F255 VanDerWaalsContact CG-CD2 3.44Å; F228-F255 HydrophobicContact CG-CE2 4.01Å; F228-F255 HydrophobicContact CG-CG 4.48Å; F228-F255 HydrophobicContact CZ-CB 3.69Å; F228-F255 HydrophobicContact CZ-CD2 4.21Å; F228-F255 HydrophobicContact CZ-CG 4.47Å; S251-F255 WeakPolarHBondContact O-CB 3.43Å; S251-F255 PolarHBondContact O-N 3.19Å; K252-F255 PolarHBondContact O-N 3.23Å; F255-T257 VanDerWaalsContact C-N 3.31Å; F255-T257 PolarHBondContact O-N 3.24Å; F255-I258 PolarHBondContact O-N 3.33Å; F255-I258 VanDerWaalsContact O-N 3.12Å; F255-I259 HydrophobicContact CD1-CD1 4.08Å; F255-I259 HydrophobicContact CD1-CG2 4.42Å; F255-I259 HydrophobicContact CD2-CG2 3.95Å; F255-I259 HydrophobicContact CE1-CD1 3.76Å; F255-I259 HydrophobicContact CE1-CG2 4.01Å; F255-I259 HydrophobicContact CE2-CG2 3.49Å; F255-I259 VanDerWaalsContact CE2-CG2 3.49Å; F255-I259 HydrophobicContact CG-CG2 4.42Å; F255-I259 HydrophobicContact CZ-CD1 4.29Å; F255-I259 HydrophobicContact CZ-CG2 3.54Å; F255-I259 WeakPolarHBondContact O-CG1 3.45Å; F255-I259 PolarHBondContact O-N 3.34Å; F255-V269 HydrophobicContact CE2-CG1 4.01Å; F255-V269 HydrophobicContact CZ-CG1 4.15Å; F255-L271 HydrophobicContact CD2-CD1 4.41Å; F255-L271 HydrophobicContact CE2-CD1 4.06Å; F255-L271 HydrophobicContact CZ-CD1 4.29Å; F255-F313 HydrophobicContact CB-CD1 3.84Å; F255-F313 HydrophobicContact CB-CE1 3.84Å; F255-F313 HydrophobicContact CD1-CB 4.35Å; F255-F313 AromaticContact CD1-CD1 3.64Å; F255-F313 HydrophobicContact CD1-CD1 3.64Å; F255-F313 HydrophobicContact CD1-CE1 4.49Å; F255-F313 HydrophobicContact CD1-CG 4.46Å; F255-F313 HydrophobicContact CE1-CB 4.3Å; F255-F313 HydrophobicContact CE1-CD1 4.3Å; F255-F313 WeakPolarHBondContact CE1-O 3.31Å; F255-F313 AromaticContact CG-CD1 3.75Å; F255-F313 HydrophobicContact CG-CD1 3.75Å; F255-F313 HydrophobicContact CG-CE1 4.24Å; F255-L316 HydrophobicContact CD1-CB 4.4Å; F255-L316 HydrophobicContact CD1-CD1 4.04Å; F255-I324 HydrophobicContact CE1-CD1 4.02Å; F255-I324 HydrophobicContact CZ-CD1 3.85Å; F255-I324 HydrophobicContact CZ-CG2 4.4Å
256	R	97.2	Very high	95.7	Very high	155 Å²	155	55.2 Å²	55.2	59%	0.585	27%	0.274	S	S	*	.	H	α-helix	trans	-54.3	-48.5	175.8	-174.5	-178.4	-178.5	174.5	1.9	111.1	K252 A253 L254 I258 I259 T260 L316	K252-R256 PolarHBondContact O-N 3.25Å; A253-R256 PolarHBondContact O-N 3.18Å; L254-R256 PolarHBondContact O-N 3.38Å; R256-I258 PolarHBondContact O-N 3.39Å; R256-I259 WeakPolarHBondContact O-CG1 3.27Å; R256-T260 VanDerWaalsContact O-CG2 3.27Å; R256-T260 WeakPolarHBondContact O-CG2 3.41Å; R256-T260 PolarHBondContact O-N 2.93Å; R256-T260 PolarHBondContact O-OG1 3.19Å; R256-L316 HydrophobicContact CB-CB 4.44Å; R256-L316 HydrophobicContact CB-CD1 4.41Å; R256-L316 HydrophobicContact CB-CD2 4.47Å
257	T	96	Very high	95.6	Very high	57 Å²	57	54 Å²	54	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-57.2	-49	176.7	-61	0	0	0	0	111.7	A253 L254 F255 T260 Y261	A253-T257 PolarHBondContact O-N 2.9Å; A253-T257 PolarHBondContact O-OG1 3.09Å; L254-T257 WeakPolarHBondContact O-CB 3.43Å; L254-T257 PolarHBondContact O-N 3.07Å; F255-T257 VanDerWaalsContact C-N 3.31Å; F255-T257 PolarHBondContact O-N 3.24Å; T257-T260 PolarHBondContact O-N 3.45Å; T257-T260 PolarHBondContact O-OG1 2.72Å; T257-Y261 HydrophobicContact CG2-CD2 4.31Å; T257-Y261 HydrophobicContact CG2-CE1 4.08Å; T257-Y261 HydrophobicContact CG2-CE2 3.6Å; T257-Y261 VanDerWaalsContact CG2-CZ 3.45Å; T257-Y261 WeakPolarHBondContact CG2-OH 3.46Å; T257-Y261 PolarHBondContact O-N 3.19Å
258	I	95.8	Very high	95.5	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-50.2	-178	-68.1	-53.9	0	0	0	112.2	L45 W216 F220 I226 F228 L254 F255 R256 T260 Y261 F264	L45-I258 HydrophobicContact CD1-CB 4.48Å; L45-I258 HydrophobicContact CD1-CD1 3.82Å; L45-I258 HydrophobicContact CD1-CG1 3.99Å; L45-I258 HydrophobicContact CD1-CG2 3.63Å; W216-I258 HydrophobicContact CE3-CD1 4.17Å; W216-I258 HydrophobicContact CZ3-CD1 4.02Å; W216-I258 HydrophobicContact CZ3-CG1 4.45Å; F220-I258 HydrophobicContact CZ-CD1 4.36Å; I226-I258 HydrophobicContact CD1-CG2 3.83Å; I226-I258 HydrophobicContact CG2-CG2 4.13Å; F228-I258 HydrophobicContact CD2-CG1 4.49Å; F228-I258 HydrophobicContact CD2-CG2 4.48Å; F228-I258 HydrophobicContact CE2-CB 4.45Å; F228-I258 HydrophobicContact CE2-CG1 4.09Å; L254-I258 HydrophobicContact CD1-CG1 4.44Å; L254-I258 WeakPolarHBondContact O-CG1 3.32Å; L254-I258 PolarHBondContact O-N 2.84Å; F255-I258 PolarHBondContact O-N 3.33Å; F255-I258 VanDerWaalsContact O-N 3.12Å; R256-I258 PolarHBondContact O-N 3.39Å; I258-T260 PolarHBondContact O-N 3Å; I258-Y261 HydrophobicContact CD1-CD2 3.97Å; I258-Y261 HydrophobicContact CD1-CE2 4.03Å; I258-Y261 PolarHBondContact O-N 2.87Å; I258-Y261 VanDerWaalsContact O-N 3.12Å; I258-F264 HydrophobicContact CD1-CE2 4.34Å; I258-F264 HydrophobicContact CG2-CD2 4.17Å; I258-F264 HydrophobicContact CG2-CE2 4.09Å; I258-F264 WeakPolarHBondContact O-CD2 3.44Å
259	I	94.8	Very high	95.4	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.062	27%	0.273	C	S	.	.	H	α-helix	trans	-68.1	-21	-176	66.5	-179.1	0	0	0	113	F255 R256 V269 L316 N317	F255-I259 HydrophobicContact CD1-CD1 4.08Å; F255-I259 HydrophobicContact CD1-CG2 4.42Å; F255-I259 HydrophobicContact CD2-CG2 3.95Å; F255-I259 HydrophobicContact CE1-CD1 3.76Å; F255-I259 HydrophobicContact CE1-CG2 4.01Å; F255-I259 HydrophobicContact CE2-CG2 3.49Å; F255-I259 VanDerWaalsContact CE2-CG2 3.49Å; F255-I259 HydrophobicContact CG-CG2 4.42Å; F255-I259 HydrophobicContact CZ-CD1 4.29Å; F255-I259 HydrophobicContact CZ-CG2 3.54Å; F255-I259 WeakPolarHBondContact O-CG1 3.45Å; F255-I259 PolarHBondContact O-N 3.34Å; R256-I259 WeakPolarHBondContact O-CG1 3.27Å; I259-V269 HydrophobicContact CG2-CG1 4.1Å; I259-V269 HydrophobicContact CG2-CG2 4.37Å; I259-L316 HydrophobicContact CD1-CB 4.42Å; I259-N317 HydrophobicContact CD1-CB 4.28Å
260	T	94.3	Very high	95.3	Very high	72 Å²	72	50.7 Å²	50.7	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-88.8	-7.6	175.5	61.3	0	0	0	0	114.6	R256 T257 I258 P318	R256-T260 VanDerWaalsContact O-CG2 3.27Å; R256-T260 WeakPolarHBondContact O-CG2 3.41Å; R256-T260 PolarHBondContact O-N 2.93Å; R256-T260 PolarHBondContact O-OG1 3.19Å; T257-T260 PolarHBondContact O-N 3.45Å; T257-T260 PolarHBondContact O-OG1 2.72Å; I258-T260 PolarHBondContact O-N 3Å; T260-P318 HydrophobicContact CG2-CG 3.95Å
261	Y	94.5	Very high	95.4	Very high	98 Å²	98	49.8 Å²	49.8	38%	0.384	25%	0.251	S	S	.	.			trans	-70.2	131.3	-178.7	-86.9	-38.4	0	0	0	111.7	F220 T257 I258 W263 F264	F220-Y261 AromaticContact CE2-CD2 3.97Å; F220-Y261 HydrophobicContact CE2-CD2 3.97Å; F220-Y261 HydrophobicContact CE2-CE2 4.11Å; T257-Y261 HydrophobicContact CG2-CD2 4.31Å; T257-Y261 HydrophobicContact CG2-CE1 4.08Å; T257-Y261 HydrophobicContact CG2-CE2 3.6Å; T257-Y261 VanDerWaalsContact CG2-CZ 3.45Å; T257-Y261 WeakPolarHBondContact CG2-OH 3.46Å; T257-Y261 PolarHBondContact O-N 3.19Å; I258-Y261 HydrophobicContact CD1-CD2 3.97Å; I258-Y261 HydrophobicContact CD1-CE2 4.03Å; I258-Y261 PolarHBondContact O-N 2.87Å; I258-Y261 VanDerWaalsContact O-N 3.12Å; Y261-W263 PolarHBondContact O-N 3.39Å; Y261-W263 VanDerWaalsContact O-N 3.13Å; Y261-F264 HydrophobicContact CD2-CE2 4.22Å; Y261-F264 PolarHBondContact O-N 3.47Å
262	P	93.8	Very high	95.4	Very high	101 Å²	101	49.7 Å²	49.7	66%	0.656	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-56.9	-31.4	178	-27.5	35.3	0	0	0	113.9	F264 Q265	P262-F264 PolarHBondContact O-N 2.78Å; P262-Q265 WeakPolarHBondContact O-CB 3.42Å; P262-Q265 PolarHBondContact O-N 3.3Å
263	W	94.4	Very high	95.4	Very high	133 Å²	133	48.2 Å²	48.2	50%	0.504	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-51	-29.2	174.4	-68.7	102.3	0	0	0	113.6	F220 E221 Y261	F220-W263 HydrophobicContact CB-CB 4.11Å; F220-W263 HydrophobicContact CB-CD2 3.95Å; F220-W263 HydrophobicContact CB-CE3 4.05Å; F220-W263 HydrophobicContact CB-CG 3.99Å; F220-W263 HydrophobicContact CD2-CB 4.1Å; F220-W263 AromaticContact CD2-CD1 3.75Å; F220-W263 HydrophobicContact CD2-CD2 4.41Å; F220-W263 AromaticContact CD2-CG 3.83Å; F220-W263 HydrophobicContact CD2-CG 3.83Å; F220-W263 HydrophobicContact CG-CB 4.47Å; F220-W263 HydrophobicContact CG-CG 4.4Å; E221-W263 HydrophobicContact CG-CZ3 3.95Å; Y261-W263 PolarHBondContact O-N 3.39Å; Y261-W263 VanDerWaalsContact O-N 3.13Å
264	F	94.1	Very high	95.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-113.7	14.8	-172.5	-54.2	-52.7	0	0	0	113.6	L43 L45 F220 V223 I226 I258 Y261 P262 N266 S267 K322	L43-F264 HydrophobicContact CD2-CE1 3.86Å; L43-F264 HydrophobicContact CD2-CZ 3.73Å; L45-F264 HydrophobicContact CD1-CE2 4.5Å; L45-F264 HydrophobicContact CD1-CZ 4.43Å; F220-F264 HydrophobicContact CB-CE1 4.27Å; F220-F264 HydrophobicContact CB-CZ 4.27Å; F220-F264 HydrophobicContact CD1-CE1 4.03Å; F220-F264 HydrophobicContact CD1-CE2 4.32Å; F220-F264 AromaticContact CD1-CZ 3.38Å; F220-F264 HydrophobicContact CD1-CZ 3.38Å; F220-F264 HydrophobicContact CD2-CE2 4.13Å; F220-F264 AromaticContact CD2-CZ 3.81Å; F220-F264 HydrophobicContact CD2-CZ 3.81Å; F220-F264 HydrophobicContact CE1-CE1 4.49Å; F220-F264 HydrophobicContact CE1-CE2 4.09Å; F220-F264 AromaticContact CE1-CZ 3.46Å; F220-F264 HydrophobicContact CE1-CZ 3.46Å; F220-F264 VanDerWaalsContact CE1-CZ 3.46Å; F220-F264 AromaticContact CE2-CE2 3.9Å; F220-F264 HydrophobicContact CE2-CE2 3.9Å; F220-F264 AromaticContact CE2-CZ 3.89Å; F220-F264 HydrophobicContact CE2-CZ 3.89Å; F220-F264 HydrophobicContact CG-CE1 4.05Å; F220-F264 HydrophobicContact CG-CE2 4.34Å; F220-F264 AromaticContact CG-CZ 3.56Å; F220-F264 HydrophobicContact CG-CZ 3.56Å; F220-F264 AromaticContact CZ-CE2 3.87Å; F220-F264 HydrophobicContact CZ-CE2 3.87Å; F220-F264 AromaticContact CZ-CZ 3.72Å; F220-F264 HydrophobicContact CZ-CZ 3.72Å; V223-F264 HydrophobicContact CB-CD1 4.2Å; V223-F264 HydrophobicContact CB-CE1 4.08Å; V223-F264 HydrophobicContact CG1-CD1 4.32Å; V223-F264 HydrophobicContact CG1-CE1 4.25Å; V223-F264 HydrophobicContact CG2-CE1 3.98Å; I226-F264 HydrophobicContact CD1-CB 3.49Å; I226-F264 VanDerWaalsContact CD1-CB 3.49Å; I226-F264 HydrophobicContact CD1-CD1 3.91Å; I226-F264 HydrophobicContact CD1-CD2 3.7Å; I226-F264 HydrophobicContact CD1-CE2 4.32Å; I226-F264 HydrophobicContact CD1-CG 3.44Å; I226-F264 VanDerWaalsContact CD1-CG 3.44Å; I226-F264 HydrophobicContact CG1-CB 4.44Å; I226-F264 HydrophobicContact CG1-CD1 4.04Å; I226-F264 HydrophobicContact CG1-CE1 4.36Å; I226-F264 HydrophobicContact CG1-CG 4.11Å; I258-F264 HydrophobicContact CD1-CE2 4.34Å; I258-F264 HydrophobicContact CG2-CD2 4.17Å; I258-F264 HydrophobicContact CG2-CE2 4.09Å; I258-F264 WeakPolarHBondContact O-CD2 3.44Å; Y261-F264 HydrophobicContact CD2-CE2 4.22Å; Y261-F264 PolarHBondContact O-N 3.47Å; P262-F264 PolarHBondContact O-N 2.78Å; F264-N266 VanDerWaalsContact C-N 3.26Å; F264-N266 PolarHBondContact O-N 3.37Å; F264-S267 PolarHBondContact O-N 2.91Å; F264-K322 PolarHBondContact O-NZ 2.86Å
265	Q	90.6	Very high	95.5	Very high	144 Å²	144	46.3 Å²	46.3	67%	0.673	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-47.3	-177.3	-173.6	173.1	4.3	0	0	111.2	P262 K322	P262-Q265 WeakPolarHBondContact O-CB 3.42Å; P262-Q265 PolarHBondContact O-N 3.3Å; Q265-K322 PolarHBondContact O-NZ 2.86Å; Q265-K322 VanDerWaalsContact O-NZ 3.17Å
266	N	89.6	Confident	95.5	Very high	148 Å²	148	49 Å²	49	79%	0.791	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.4	-179.8	-58.9	-24.2	0	0	0	113.8	F264	F264-N266 VanDerWaalsContact C-N 3.26Å; F264-N266 PolarHBondContact O-N 3.37Å
267	S	93.6	Very high	95.6	Very high	6 Å²	6	44.1 Å²	44.1	4%	0.042	22%	0.223	C	C	.	.	S	Bend	trans	-76.9	134.8	177.7	-51	0	0	0	0	110.2	V223 T224 F264 K322	V223-S267 WeakPolarHBondContact O-CB 3.46Å; V223-S267 PolarHBondContact O-OG 3.34Å; T224-S267 WeakPolarHBondContact O-CA 3.47Å; F264-S267 PolarHBondContact O-N 2.91Å; S267-K322 VanDerWaalsContact O-CE 3.22Å; S267-K322 WeakPolarHBondContact O-CE 3.42Å; S267-K322 PolarHBondContact O-NZ 3.41Å
268	S	93.9	Very high	95.7	Very high	18 Å²	18	42.6 Å²	42.6	13%	0.126	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	149.8	167.9	51.6	0	0	0	0	110.7	T224 S225 I226	T224-S268 PolarHBondContact O-N 3.47Å; T224-S268 VanDerWaalsContact O-N 3.16Å; T224-S268 PolarHBondContact O-OG 3.4Å; S225-S268 CarbonylContact C-O 3.49Å; S225-S268 WeakPolarHBondContact CA-O 3.47Å; S225-S268 WeakPolarHBondContact CB-OG 3.43Å; S225-S268 PolarHBondContact OG-OG 3.48Å; I226-S268 PolarHBondContact N-O 3.24Å
269	V	96	Very high	95.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.1	-177.6	179.3	0	0	0	0	109.8	I226 F255 I259 I324 Y325	I226-V269 HydrophobicContact CD1-CG2 4.08Å; F255-V269 HydrophobicContact CE2-CG1 4.01Å; F255-V269 HydrophobicContact CZ-CG1 4.15Å; I259-V269 HydrophobicContact CG2-CG1 4.1Å; I259-V269 HydrophobicContact CG2-CG2 4.37Å; V269-I324 HydrophobicContact CB-CG1 4.46Å; V269-I324 HydrophobicContact CG1-CG1 4.28Å; V269-I324 HydrophobicContact CG1-CG2 4.39Å; V269-Y325 PolarHBondContact O-N 2.78Å
270	I	97.3	Very high	95.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.8	174.2	-63.2	142.4	0	0	0	108	I226 M227 F228 F272 Y325 V344 I348	I226-I270 PolarHBondContact O-N 3.28Å; M227-I270 WeakPolarHBondContact CA-O 3.26Å; M227-I270 HydrophobicContact CE-CD1 4.05Å; M227-I270 HydrophobicContact CG-CB 4.41Å; M227-I270 HydrophobicContact CG-CD1 4.24Å; F228-I270 PolarHBondContact N-O 3.3Å; I270-F272 HydrophobicContact CG2-CD1 4.43Å; I270-F272 HydrophobicContact CG2-CD2 4.36Å; I270-F272 HydrophobicContact CG2-CE1 3.91Å; I270-F272 HydrophobicContact CG2-CE2 3.91Å; I270-F272 HydrophobicContact CG2-CZ 3.67Å; I270-Y325 CarbonylContact C-O 3.59Å; I270-Y325 VanDerWaalsContact CA-O 3.26Å; I270-Y325 WeakPolarHBondContact CA-O 3.2Å; I270-V344 HydrophobicContact CD1-CG1 3.55Å; I270-V344 HydrophobicContact CG1-CG1 4.35Å; I270-V344 HydrophobicContact CG2-CG1 4.48Å; I270-V344 HydrophobicContact CG2-CG2 3.89Å; I270-I348 HydrophobicContact CD1-CD1 3.71Å; I270-I348 HydrophobicContact CD1-CG1 3.83Å
271	L	98.4	Very high	96	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.1	-179.9	179.1	66.5	0	0	0	109.8	F228 V230 F255 L273 L310 F313 I324 Y325 S326 H327	F228-L271 HydrophobicContact CB-CD1 4.48Å; F228-L271 HydrophobicContact CD1-CD1 4.19Å; V230-L271 HydrophobicContact CG2-CD1 3.67Å; F255-L271 HydrophobicContact CD2-CD1 4.41Å; F255-L271 HydrophobicContact CE2-CD1 4.06Å; F255-L271 HydrophobicContact CZ-CD1 4.29Å; L271-L273 HydrophobicContact CD2-CD1 4.11Å; L271-L273 HydrophobicContact CD2-CG 4.47Å; L271-L273 HydrophobicContact CG-CD1 4.21Å; L271-L273 HydrophobicContact CG-CG 4.35Å; L271-L310 HydrophobicContact CD2-CD1 4.2Å; L271-F313 HydrophobicContact CD1-CD1 4.18Å; L271-F313 HydrophobicContact CD1-CG 4.49Å; L271-F313 HydrophobicContact CD2-CB 3.57Å; L271-F313 HydrophobicContact CD2-CG 4.27Å; L271-I324 HydrophobicContact CB-CG2 3.66Å; L271-I324 HydrophobicContact CD2-CG2 4.27Å; L271-Y325 PolarHBondContact N-O 2.93Å; L271-S326 CarbonylContact O-C 3.52Å; L271-S326 VanDerWaalsContact O-CA 3.27Å; L271-S326 WeakPolarHBondContact O-CA 3.46Å; L271-H327 PolarHBondContact O-N 3.41Å
272	F	98.6	Very high	96.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115.7	171.8	-67.8	-58.3	0	0	0	110.3	F55 M227 F228 L229 V230 I270 N274 H327 T329 V340 V344	F55-F272 HydrophobicContact CE2-CE1 4.38Å; F55-F272 HydrophobicContact CE2-CE2 4.03Å; F55-F272 AromaticContact CE2-CZ 3.9Å; F55-F272 HydrophobicContact CE2-CZ 3.9Å; F55-F272 AromaticContact CZ-CE2 3.98Å; F55-F272 HydrophobicContact CZ-CE2 3.98Å; F55-F272 AromaticContact CZ-CZ 3.86Å; F55-F272 HydrophobicContact CZ-CZ 3.86Å; M227-F272 HydrophobicContact CB-CD2 4.27Å; M227-F272 HydrophobicContact CB-CE2 3.92Å; M227-F272 HydrophobicContact CG-CE2 3.93Å; M227-F272 HydrophobicContact SD-CE2 3.89Å; M227-F272 HydrophobicContact SD-CZ 4.47Å; F228-F272 PolarHBondContact O-N 2.86Å; L229-F272 HydrophobicContact CD1-CD2 4.12Å; L229-F272 HydrophobicContact CG-CB 3.99Å; L229-F272 HydrophobicContact CG-CD2 4.03Å; L229-F272 HydrophobicContact CG-CG 4.45Å; V230-F272 PolarHBondContact N-O 3.03Å; I270-F272 HydrophobicContact CG2-CD1 4.43Å; I270-F272 HydrophobicContact CG2-CD2 4.36Å; I270-F272 HydrophobicContact CG2-CE1 3.91Å; I270-F272 HydrophobicContact CG2-CE2 3.91Å; I270-F272 HydrophobicContact CG2-CZ 3.67Å; F272-N274 PolarHBondContact O-N 3.16Å; F272-H327 WeakPolarHBondContact CA-O 3.35Å; F272-H327 HydrophobicContact CD1-CB 3.94Å; F272-H327 HydrophobicContact CE1-CB 4.1Å; F272-T329 HydrophobicContact CD1-CG2 3.68Å; F272-T329 HydrophobicContact CE1-CG2 4.3Å; F272-T329 HydrophobicContact CG-CG2 4.47Å; F272-V340 HydrophobicContact CD1-CG1 4.02Å; F272-V340 HydrophobicContact CE1-CG1 3.34Å; F272-V340 HydrophobicContact CZ-CG1 4.28Å; F272-V344 HydrophobicContact CE1-CG2 3.96Å; F272-V344 HydrophobicContact CZ-CG2 3.87Å
273	L	98.8	Very high	96.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	87.5	170.7	-67.1	123.7	0	0	0	108	L232 L271 I309 L310 H327 F328 T329	L232-L273 HydrophobicContact CD1-CB 4.04Å; L232-L273 HydrophobicContact CD2-CB 3.98Å; L232-L273 HydrophobicContact CD2-CD2 3.67Å; L232-L273 HydrophobicContact CD2-CG 4.45Å; L232-L273 HydrophobicContact CG-CB 4.01Å; L271-L273 HydrophobicContact CD2-CD1 4.11Å; L271-L273 HydrophobicContact CD2-CG 4.47Å; L271-L273 HydrophobicContact CG-CD1 4.21Å; L271-L273 HydrophobicContact CG-CG 4.35Å; L273-I309 HydrophobicContact CD2-CG2 3.89Å; L273-L310 HydrophobicContact CD1-CB 4.09Å; L273-L310 HydrophobicContact CD1-CD1 3.61Å; L273-L310 HydrophobicContact CD1-CG 4.36Å; L273-L310 HydrophobicContact CD2-CB 4.35Å; L273-H327 PolarHBondContact N-O 2.67Å; L273-F328 HydrophobicContact CB-CD1 3.51Å; L273-F328 HydrophobicContact CB-CE1 3.76Å; L273-F328 HydrophobicContact CD1-CD1 4.18Å; L273-F328 HydrophobicContact CD1-CE1 3.83Å; L273-F328 HydrophobicContact CD1-CZ 4.32Å; L273-F328 HydrophobicContact CD2-CE1 4.24Å; L273-F328 HydrophobicContact CG-CD1 4.36Å; L273-F328 HydrophobicContact CG-CE1 4.15Å; L273-F328 CarbonylContact O-C 3.55Å; L273-F328 WeakPolarHBondContact O-CA 3.21Å; L273-T329 PolarHBondContact O-N 3.33Å
274	N	98.7	Very high	96.4	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	168.2	-170.4	-171.3	33.5	0	0	0	112.8	S50 V230 L232 F272 K276 T329 A331	S50-N274 PolarHBondContact O-ND2 3.35Å; V230-N274 PolarHBondContact O-N 3.23Å; L232-N274 VanDerWaalsContact CB-O 3.24Å; L232-N274 WeakPolarHBondContact CB-O 3.36Å; L232-N274 WeakPolarHBondContact CG-O 3.35Å; L232-N274 PolarHBondContact N-O 3.19Å; F272-N274 PolarHBondContact O-N 3.16Å; N274-K276 VanDerWaalsContact C-N 3.31Å; N274-K276 PolarHBondContact O-N 3.03Å; N274-T329 CarbonylContact C-O 3.2Å; N274-T329 WeakPolarHBondContact CA-O 3.42Å; N274-T329 VanDerWaalsContact CA-OG1 3.22Å; N274-T329 WeakPolarHBondContact CA-OG1 3.42Å; N274-T329 WeakPolarHBondContact CB-OG1 3.46Å; N274-T329 PolarHBondContact OD1-O 3.38Å; N274-T329 PolarHBondContact OD1-OG1 2.8Å; N274-A331 PolarHBondContact OD1-N 3.3Å
275	K	98.3	Very high	96.4	Very high	21 Å²	21	44.9 Å²	44.9	9%	0.091	21%	0.213	C	C	.	.			trans	60.5	38.1	-178.9	-50.2	-177.2	-173.8	177.7	0	112.6	E49 D155 A231 S233 E234 D277 L278 L279 T329	E49-K275 WeakPolarHBondContact O-CE 3.41Å; E49-K275 PolarHBondContact O-NZ 3Å; D155-K275 WeakPolarHBondContact OD2-CD 3.48Å; D155-K275 VanDerWaalsContact OD2-CE 3.31Å; D155-K275 WeakPolarHBondContact OD2-CE 3.46Å; D155-K275 IonicContact OD2-NZ 2.78Å; D155-K275 PolarHBondContact OD2-NZ 3.47Å; A231-K275 HydrophobicContact CB-CD 3.75Å; A231-K275 HydrophobicContact CB-CG 4.39Å; S233-K275 VanDerWaalsContact OG-CD 3.27Å; S233-K275 WeakPolarHBondContact OG-CD 3.36Å; E234-K275 IonicContact OE1-NZ 2.68Å; K275-D277 VanDerWaalsContact C-OD1 3.28Å; K275-D277 WeakPolarHBondContact CA-OD1 3.19Å; K275-D277 PolarHBondContact O-N 2.95Å; K275-L278 HydrophobicContact CB-CB 4.3Å; K275-L278 HydrophobicContact CB-CD1 4.24Å; K275-L278 HydrophobicContact CB-CG 4.42Å; K275-L278 HydrophobicContact CD-CD1 4.1Å; K275-L278 HydrophobicContact CG-CD1 4.48Å; K275-L278 PolarHBondContact O-N 2.88Å; K275-L278 VanDerWaalsContact O-N 3.15Å; K275-L279 PolarHBondContact O-N 2.56Å; K275-L279 VanDerWaalsContact O-N 3.11Å; K275-T329 PolarHBondContact N-O 3.26Å; K275-T329 VanDerWaalsContact N-O 3.08Å
276	K	98.1	Very high	96.7	Very high	55 Å²	55	38.3 Å²	38.3	24%	0.239	18%	0.183	C	C	.	.	H	α-helix	trans	-58.3	-32.4	178.3	70.6	-178.3	-175.1	179.4	0	112.7	L232 N274 L279 E280 F328 T329 C330 N336	L232-K276 HydrophobicContact CD1-CB 3.93Å; N274-K276 VanDerWaalsContact C-N 3.31Å; N274-K276 PolarHBondContact O-N 3.03Å; K276-L279 PolarHBondContact O-N 3.36Å; K276-E280 WeakPolarHBondContact O-CB 3.23Å; K276-E280 PolarHBondContact O-N 3.11Å; K276-F328 HydrophobicContact CD-CB 4.34Å; K276-T329 WeakPolarHBondContact CG-O 3.19Å; K276-T329 PolarHBondContact N-O 2.85Å; K276-C330 HydrophobicContact CG-CB 4.34Å; K276-N336 PolarHBondContact NZ-ND2 3.22Å
277	D	97.7	Very high	97	Very high	53 Å²	53	32.9 Å²	32.9	28%	0.283	15%	0.153	S	C	.	.	H	α-helix	trans	-63.5	-43.5	175.8	55.8	-51.2	0	0	0	112	K275 E280 E281 C330	K275-D277 VanDerWaalsContact C-OD1 3.28Å; K275-D277 WeakPolarHBondContact CA-OD1 3.19Å; K275-D277 PolarHBondContact O-N 2.95Å; D277-E280 PolarHBondContact O-N 3.37Å; D277-E281 PolarHBondContact O-N 3.25Å; D277-E281 VanDerWaalsContact O-N 3.13Å; D277-C330 PolarHBondContact OD1-SG 3.13Å; D277-C330 VanDerWaalsContact OD1-SG 3.39Å
278	L	97.8	Very high	97.2	Very high	26 Å²	26	32.6 Å²	32.6	14%	0.136	15%	0.151	C	C	.	.	H	α-helix	trans	-74.1	-32.2	178.3	-61.4	-175.8	0	0	0	112.4	D155 K275 K282	D155-L278 HydrophobicContact CB-CD1 3.59Å; K275-L278 HydrophobicContact CB-CB 4.3Å; K275-L278 HydrophobicContact CB-CD1 4.24Å; K275-L278 HydrophobicContact CB-CG 4.42Å; K275-L278 HydrophobicContact CD-CD1 4.1Å; K275-L278 HydrophobicContact CG-CD1 4.48Å; K275-L278 PolarHBondContact O-N 2.88Å; K275-L278 VanDerWaalsContact O-N 3.15Å; L278-K282 WeakPolarHBondContact O-CB 3.39Å; L278-K282 VanDerWaalsContact O-CG 3.23Å; L278-K282 WeakPolarHBondContact O-CG 3.21Å; L278-K282 PolarHBondContact O-N 3.47Å
279	L	98.3	Very high	97.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-44.5	170	174.3	66.4	0	0	0	110.9	L232 Y235 K275 K276 E281 K282 I283 A305 R306 I309	L232-L279 HydrophobicContact CB-CB 3.89Å; L232-L279 HydrophobicContact CB-CD2 3.92Å; L232-L279 HydrophobicContact CB-CG 4.42Å; L232-L279 HydrophobicContact CD1-CD2 4.08Å; L232-L279 HydrophobicContact CD2-CD2 4.23Å; L232-L279 HydrophobicContact CG-CD2 4.32Å; Y235-L279 HydrophobicContact CD1-CD1 3.73Å; Y235-L279 HydrophobicContact CE1-CD1 3.51Å; K275-L279 PolarHBondContact O-N 2.56Å; K275-L279 VanDerWaalsContact O-N 3.11Å; K276-L279 PolarHBondContact O-N 3.36Å; L279-E281 VanDerWaalsContact C-N 3.29Å; L279-E281 PolarHBondContact O-N 2.95Å; L279-K282 PolarHBondContact O-N 3.08Å; L279-I283 WeakPolarHBondContact O-CB 3.45Å; L279-I283 PolarHBondContact O-N 3.45Å; L279-A305 HydrophobicContact CD2-CB 4.37Å; L279-R306 HydrophobicContact CD2-CB 4.48Å; L279-R306 HydrophobicContact CD2-CG 3.44Å; L279-R306 VanDerWaalsContact CD2-CG 3.44Å; L279-I309 HydrophobicContact CD1-CD1 4.48Å; L279-I309 HydrophobicContact CD2-CD1 4.27Å
280	E	97.9	Very high	97.3	Very high	120 Å²	120	39.5 Å²	39.5	56%	0.561	19%	0.188	S	C	*	.	H	α-helix	trans	-59.6	-38.6	178.6	-176.4	170.3	-162.4	0	0	112.2	K276 D277 A302	K276-E280 WeakPolarHBondContact O-CB 3.23Å; K276-E280 PolarHBondContact O-N 3.11Å; D277-E280 PolarHBondContact O-N 3.37Å; E280-A302 HydrophobicContact CB-CB 4.01Å; E280-A302 HydrophobicContact CG-CB 3.97Å
281	E	96.5	Very high	97.3	Very high	68 Å²	68	43.2 Å²	43.2	32%	0.318	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-49.7	171.8	-174.3	-174.9	145.3	0	0	111.9	R148 D277 L279	R148-E281 IonicContact CZ-OE1 2.7Å; R148-E281 IonicContact NH2-OE1 3.51Å; R148-E281 PolarHBondContact NH2-OE1 3.46Å; D277-E281 PolarHBondContact O-N 3.25Å; D277-E281 VanDerWaalsContact O-N 3.13Å; L279-E281 VanDerWaalsContact C-N 3.29Å; L279-E281 PolarHBondContact O-N 2.95Å
282	K	96.7	Very high	97.3	Very high	20 Å²	20	43.2 Å²	43.2	9%	0.087	20%	0.202	C	C	.	.	H	α-helix	trans	-72.9	-35.3	-168.7	-71.8	175.7	68.8	167.5	0	113.7	S233 Y235 D236 L278 L279 M284 Y285 S286	S233-K282 PolarHBondContact O-NZ 3.47Å; Y235-K282 HydrophobicContact CE1-CB 4.07Å; Y235-K282 VanDerWaalsContact OH-C 3.32Å; Y235-K282 WeakPolarHBondContact OH-CB 3.4Å; Y235-K282 PolarHBondContact OH-O 3.36Å; D236-K282 WeakPolarHBondContact OD1-CE 3.3Å; D236-K282 IonicContact OD1-NZ 3.78Å; D236-K282 PolarHBondContact OD1-NZ 3.02Å; D236-K282 WeakPolarHBondContact OD2-CE 3.45Å; D236-K282 IonicContact OD2-NZ 2.81Å; D236-K282 PolarHBondContact OD2-NZ 2.96Å; L278-K282 WeakPolarHBondContact O-CB 3.39Å; L278-K282 VanDerWaalsContact O-CG 3.23Å; L278-K282 WeakPolarHBondContact O-CG 3.21Å; L278-K282 PolarHBondContact O-N 3.47Å; L279-K282 PolarHBondContact O-N 3.08Å; K282-M284 PolarHBondContact O-N 3.44Å; K282-Y285 PolarHBondContact O-N 3.05Å; K282-S286 PolarHBondContact O-N 3.13Å
283	I	97.1	Very high	97.2	Very high	3 Å²	3	48 Å²	48	2%	0.015	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.9	-176.6	-157.3	64.2	0	0	0	112.9	Y235 L279 Y285 L288 A302 A305	Y235-I283 PolarHBondContact OH-N 3.38Å; L279-I283 WeakPolarHBondContact O-CB 3.45Å; L279-I283 PolarHBondContact O-N 3.45Å; I283-Y285 VanDerWaalsContact C-N 3.3Å; I283-Y285 PolarHBondContact O-N 2.93Å; I283-L288 HydrophobicContact CD1-CB 3.93Å; I283-A302 HydrophobicContact CG2-CB 4.1Å; I283-A305 HydrophobicContact CD1-CB 3.85Å; I283-A305 HydrophobicContact CG1-CB 4.04Å
284	M	96.5	Very high	97.1	Very high	74 Å²	74	54.7 Å²	54.7	37%	0.365	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-28.6	175.9	-60.5	-54.1	-66.1	0	0	113.1	K282 R300	K282-M284 PolarHBondContact O-N 3.44Å; M284-R300 HydrophobicContact CE-CB 4.13Å; M284-R300 PolarHBondContact O-NE 3.38Å; M284-R300 HydrophobicContact SD-CB 3.83Å; M284-R300 HydrophobicContact SD-CG 4.47Å
285	Y	95	Very high	97.1	Very high	180 Å²	180	55.2 Å²	55.2	71%	0.706	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	-13.8	-171.4	-49.4	-79.2	0	0	0	114.3	K282 I283	K282-Y285 PolarHBondContact O-N 3.05Å; I283-Y285 VanDerWaalsContact C-N 3.3Å; I283-Y285 PolarHBondContact O-N 2.93Å
286	S	96.2	Very high	97	Very high	7 Å²	7	61.6 Å²	61.6	5%	0.049	30%	0.302	C	S	.	.	S	Bend	trans	-129.9	106	-179.1	177.5	0	0	0	0	108.2	Y235 D236 K282	Y235-S286 WeakPolarHBondContact OH-CB 3.36Å; Y235-S286 PolarHBondContact OH-O 3.1Å; D236-S286 WeakPolarHBondContact CB-OG 3.31Å; D236-S286 WeakPolarHBondContact OD2-CB 3.32Å; D236-S286 PolarHBondContact OD2-OG 3.39Å; K282-S286 PolarHBondContact O-N 3.13Å
287	H	95.5	Very high	96.8	Very high	33 Å²	33	60.2 Å²	60.2	15%	0.153	30%	0.302	C	S	.	.			trans	-84.4	133.7	-169.1	-60.3	-53.9	0	0	0	111.5	V289 D290	H287-V289 VanDerWaalsContact C-N 3.27Å; H287-V289 HydrophobicContact CB-CG1 4.39Å; H287-V289 PolarHBondContact O-N 2.87Å; H287-D290 WeakPolarHBondContact O-CB 3.3Å; H287-D290 PolarHBondContact O-N 3.35Å; H287-D290 VanDerWaalsContact O-N 3.16Å
288	L	97.4	Very high	96.8	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-61.3	-34.7	-173.5	-171.3	60.9	0	0	0	113.2	Y235 I283 D290 Y291 F292 Y295 A305 F308 I309	Y235-L288 HydrophobicContact CD2-CD1 3.53Å; Y235-L288 HydrophobicContact CE2-CD1 4.25Å; Y235-L288 HydrophobicContact CG-CD1 3.81Å; I283-L288 HydrophobicContact CD1-CB 3.93Å; L288-D290 PolarHBondContact O-N 2.84Å; L288-Y291 PolarHBondContact O-N 3.47Å; L288-Y291 VanDerWaalsContact O-N 3.1Å; L288-F292 HydrophobicContact CD1-CD2 3.71Å; L288-F292 HydrophobicContact CD1-CE2 4.38Å; L288-F292 HydrophobicContact CG-CD2 4.46Å; L288-F292 PolarHBondContact O-N 2.75Å; L288-Y295 HydrophobicContact CB-CD1 3.98Å; L288-Y295 HydrophobicContact CB-CE1 4.28Å; L288-Y295 HydrophobicContact CB-CG 4.21Å; L288-Y295 HydrophobicContact CD2-CD1 4.41Å; L288-Y295 HydrophobicContact CD2-CD2 3.75Å; L288-Y295 HydrophobicContact CD2-CE2 4Å; L288-Y295 HydrophobicContact CD2-CG 3.95Å; L288-Y295 HydrophobicContact CG-CD1 4.45Å; L288-Y295 HydrophobicContact CG-CD2 4.47Å; L288-Y295 HydrophobicContact CG-CG 4.17Å; L288-A305 HydrophobicContact CD2-CB 3.95Å; L288-F308 HydrophobicContact CD2-CB 4.44Å; L288-F308 HydrophobicContact CD2-CD1 3.61Å; L288-F308 HydrophobicContact CD2-CE1 4.2Å; L288-F308 HydrophobicContact CD2-CG 4.32Å; L288-F308 HydrophobicContact CG-CD1 4.38Å; L288-I309 HydrophobicContact CD1-CD1 4.4Å; L288-I309 HydrophobicContact CD2-CG1 4.36Å
289	V	97.3	Very high	96.6	Very high	51 Å²	51	65.8 Å²	65.8	31%	0.309	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-61	-25.9	179.2	69.2	0	0	0	0	113.5	H287 Y291 F292 P293 Y295	H287-V289 VanDerWaalsContact C-N 3.27Å; H287-V289 HydrophobicContact CB-CG1 4.39Å; H287-V289 PolarHBondContact O-N 2.87Å; V289-Y291 PolarHBondContact O-N 3.48Å; V289-F292 WeakPolarHBondContact CA-O 3.41Å; V289-F292 CarbonylContact O-C 3.54Å; V289-P293 WeakPolarHBondContact O-CA 2.99Å; V289-Y295 HydrophobicContact CB-CD1 4.23Å
290	D	96.3	Very high	96.5	Very high	112 Å²	112	72.9 Å²	72.9	60%	0.599	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.1	-20.1	179.2	-60.3	-29.9	0	0	0	112.1	H287 L288	H287-D290 WeakPolarHBondContact O-CB 3.3Å; H287-D290 PolarHBondContact O-N 3.35Å; H287-D290 VanDerWaalsContact O-N 3.16Å; L288-D290 PolarHBondContact O-N 2.84Å
291	Y	96.8	Very high	96.5	Very high	79 Å²	79	70 Å²	70	31%	0.31	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-29.9	-178.4	-59.2	-85.4	0	0	0	112.5	Y235 D236 L288 V289	Y235-Y291 HydrophobicContact CD2-CD2 4.11Å; Y235-Y291 HydrophobicContact CE2-CD2 4.23Å; Y235-Y291 HydrophobicContact CE2-CE2 4.5Å; Y235-Y291 WeakPolarHBondContact O-CB 3.35Å; D236-Y291 HydrophobicContact CB-CD1 4.19Å; D236-Y291 HydrophobicContact CB-CD2 3.81Å; D236-Y291 HydrophobicContact CB-CE1 3.75Å; D236-Y291 HydrophobicContact CB-CE2 3.35Å; D236-Y291 HydrophobicContact CB-CG 4.22Å; L288-Y291 PolarHBondContact O-N 3.47Å; L288-Y291 VanDerWaalsContact O-N 3.1Å; V289-Y291 PolarHBondContact O-N 3.48Å
292	F	97.6	Very high	96.6	Very high	1 Å²	1	67.5 Å²	67.5	0%	0.004	34%	0.339	C	S	.	.			trans	-129.3	84.4	177.8	-65.3	-86.2	0	0	0	108.7	M248 E249 K252 L288 V289 E294 Y295 F308 M312	M248-F292 HydrophobicContact CB-CE2 4.27Å; M248-F292 HydrophobicContact CB-CZ 3.79Å; M248-F292 HydrophobicContact CG-CE1 4.46Å; M248-F292 HydrophobicContact CG-CE2 4.2Å; M248-F292 HydrophobicContact CG-CZ 3.64Å; E249-F292 HydrophobicContact CG-CE1 4.11Å; E249-F292 HydrophobicContact CG-CZ 4.33Å; E249-F292 VanDerWaalsContact OE1-CE1 3.25Å; E249-F292 WeakPolarHBondContact OE1-CE1 3.28Å; K252-F292 HydrophobicContact CD-CE1 4.29Å; L288-F292 HydrophobicContact CD1-CD2 3.71Å; L288-F292 HydrophobicContact CD1-CE2 4.38Å; L288-F292 HydrophobicContact CG-CD2 4.46Å; L288-F292 PolarHBondContact O-N 2.75Å; V289-F292 WeakPolarHBondContact CA-O 3.41Å; V289-F292 CarbonylContact O-C 3.54Å; F292-E294 PolarHBondContact O-N 3.44Å; F292-Y295 WeakPolarHBondContact O-CB 3.03Å; F292-Y295 PolarHBondContact O-N 2.53Å; F292-F308 HydrophobicContact CB-CE1 3.76Å; F292-F308 HydrophobicContact CB-CZ 4.03Å; F292-F308 HydrophobicContact CG-CE1 4.2Å; F292-M312 HydrophobicContact CD1-CE 3.98Å; F292-M312 HydrophobicContact CD1-SD 3.5Å; F292-M312 VanDerWaalsContact CD1-SD 3.5Å; F292-M312 HydrophobicContact CE1-CE 3.96Å; F292-M312 HydrophobicContact CE1-SD 3.77Å; F292-M312 HydrophobicContact CG-CE 4.3Å; F292-M312 HydrophobicContact CG-SD 4.19Å; F292-M312 HydrophobicContact CZ-CE 4.31Å
293	P	97.3	Very high	96.6	Very high	99 Å²	99	71.9 Å²	71.9	64%	0.643	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-17	-174.7	-26.1	36.2	0	0	0	114.9	V289 Y295	V289-P293 WeakPolarHBondContact O-CA 2.99Å; P293-Y295 PolarHBondContact O-N 2.87Å
294	E	96.7	Very high	96.7	Very high	141 Å²	141	72.6 Å²	72.6	66%	0.659	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.5	174.3	-56	81.7	-179.8	0	0	113.5	F292 D296 F308	F292-E294 PolarHBondContact O-N 3.44Å; E294-D296 PolarHBondContact O-N 3.08Å; E294-F308 HydrophobicContact CB-CE2 4.39Å; E294-F308 HydrophobicContact CB-CZ 4.29Å
295	Y	97.7	Very high	96.8	Very high	16 Å²	16	69.1 Å²	69.1	6%	0.063	35%	0.349	C	S	.	.			trans	-72.5	114.9	175.9	179.2	-107.5	0	0	0	111.3	L288 V289 F292 P293 G297 P298 A304 F308	L288-Y295 HydrophobicContact CB-CD1 3.98Å; L288-Y295 HydrophobicContact CB-CE1 4.28Å; L288-Y295 HydrophobicContact CB-CG 4.21Å; L288-Y295 HydrophobicContact CD2-CD1 4.41Å; L288-Y295 HydrophobicContact CD2-CD2 3.75Å; L288-Y295 HydrophobicContact CD2-CE2 4Å; L288-Y295 HydrophobicContact CD2-CG 3.95Å; L288-Y295 HydrophobicContact CG-CD1 4.45Å; L288-Y295 HydrophobicContact CG-CD2 4.47Å; L288-Y295 HydrophobicContact CG-CG 4.17Å; V289-Y295 HydrophobicContact CB-CD1 4.23Å; F292-Y295 WeakPolarHBondContact O-CB 3.03Å; F292-Y295 PolarHBondContact O-N 2.53Å; P293-Y295 PolarHBondContact O-N 2.87Å; Y295-G297 WeakPolarHBondContact CE1-O 3.45Å; Y295-G297 VanDerWaalsContact CZ-CA 3.44Å; Y295-P298 PolarHBondContact OH-O 2.89Å; Y295-A304 WeakPolarHBondContact OH-CB 3.35Å; Y295-F308 HydrophobicContact CD2-CB 3.65Å; Y295-F308 AromaticContact CD2-CD1 3.94Å; Y295-F308 HydrophobicContact CD2-CD1 3.94Å; Y295-F308 AromaticContact CD2-CD2 3.71Å; Y295-F308 HydrophobicContact CD2-CD2 3.71Å; Y295-F308 HydrophobicContact CD2-CE1 4.48Å; Y295-F308 HydrophobicContact CD2-CE2 4.3Å; Y295-F308 AromaticContact CD2-CG 3.49Å; Y295-F308 HydrophobicContact CD2-CG 3.49Å; Y295-F308 VanDerWaalsContact CD2-CG 3.49Å; Y295-F308 HydrophobicContact CE2-CB 3.87Å; Y295-F308 HydrophobicContact CE2-CG 4.23Å; Y295-F308 HydrophobicContact CG-CD2 4.49Å; Y295-F308 HydrophobicContact CG-CG 4.41Å
296	D	95.8	Very high	96.9	Very high	155 Å²	155	63.5 Å²	63.5	83%	0.829	33%	0.326	S	S	*	.			trans	-106.8	4.3	179.4	64.8	-14.3	0	0	0	113.7	E294	E294-D296 PolarHBondContact O-N 3.08Å
297	G	95.3	Very high	97	Very high	25 Å²	25	68 Å²	68	26%	0.258	35%	0.347	S	S	.	.	S	Bend	trans	-76.3	170	179.7	0	0	0	0	0	114.2	Y295	Y295-G297 WeakPolarHBondContact CE1-O 3.45Å; Y295-G297 VanDerWaalsContact CZ-CA 3.44Å
298	P	96.4	Very high	97.2	Very high	73 Å²	73	68 Å²	68	47%	0.474	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-62.3	148.2	178.4	24.5	-32.2	0	0	0	112.5	Y295 D301 A304	Y295-P298 PolarHBondContact OH-O 2.89Å; P298-D301 HydrophobicContact CB-CB 4.26Å; P298-D301 HydrophobicContact CG-CB 3.71Å; P298-A304 HydrophobicContact CG-CB 4.06Å
299	Q	95.1	Very high	97.2	Very high	124 Å²	124	68 Å²	68	58%	0.579	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	150.6	169.9	-69.4	-174.7	-8.1	0	0	110.7	D301	Q299-D301 PolarHBondContact O-N 3.32Å
300	R	96.2	Very high	97.3	Very high	148 Å²	148	67.2 Å²	67.2	56%	0.558	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	28.1	176.4	-52.4	-173.3	171.7	155.9	5.8	114.1	M284	M284-R300 HydrophobicContact CE-CB 4.13Å; M284-R300 PolarHBondContact O-NE 3.38Å; M284-R300 HydrophobicContact SD-CB 3.83Å; M284-R300 HydrophobicContact SD-CG 4.47Å
301	D	97.5	Very high	97.4	Very high	60 Å²	60	67.4 Å²	67.4	32%	0.321	34%	0.335	S	S	.	.			trans	-113.4	105.9	175.7	-171.3	-34.8	0	0	0	109.9	P298 Q299 Q303 A304 A305	P298-D301 HydrophobicContact CB-CB 4.26Å; P298-D301 HydrophobicContact CG-CB 3.71Å; Q299-D301 PolarHBondContact O-N 3.32Å; D301-Q303 VanDerWaalsContact C-N 3.27Å; D301-Q303 PolarHBondContact O-N 3.2Å; D301-Q303 WeakPolarHBondContact OD1-CA 3.33Å; D301-Q303 WeakPolarHBondContact OD1-CB 3.23Å; D301-Q303 PolarHBondContact OD1-N 2.79Å; D301-A304 HydrophobicContact CB-CB 3.98Å; D301-A304 PolarHBondContact OD1-N 3.27Å; D301-A305 WeakPolarHBondContact O-CB 3.11Å; D301-A305 PolarHBondContact O-N 3.38Å; D301-A305 VanDerWaalsContact O-N 3.09Å
302	A	97.4	Very high	97.4	Very high	15 Å²	15	64.7 Å²	64.7	12%	0.124	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-23.5	-179.5	0	0	0	0	0	113.1	E280 I283 R306	E280-A302 HydrophobicContact CB-CB 4.01Å; E280-A302 HydrophobicContact CG-CB 3.97Å; I283-A302 HydrophobicContact CG2-CB 4.1Å; A302-R306 WeakPolarHBondContact O-CB 3.43Å; A302-R306 WeakPolarHBondContact O-CG 3.3Å; A302-R306 PolarHBondContact O-N 3.22Å; A302-R306 PolarHBondContact O-NE 3.08Å
303	Q	98	Very high	97.4	Very high	112 Å²	112	64.6 Å²	64.6	52%	0.523	33%	0.326	S	S	.	.	H	α-helix	trans	-77	-50.4	176.8	179.8	167.8	-5	0	0	110.4	D301 A305 R306 E307	D301-Q303 VanDerWaalsContact C-N 3.27Å; D301-Q303 PolarHBondContact O-N 3.2Å; D301-Q303 WeakPolarHBondContact OD1-CA 3.33Å; D301-Q303 WeakPolarHBondContact OD1-CB 3.23Å; D301-Q303 PolarHBondContact OD1-N 2.79Å; Q303-A305 VanDerWaalsContact C-N 3.3Å; Q303-A305 PolarHBondContact O-N 3.5Å; Q303-R306 WeakPolarHBondContact O-CB 3.38Å; Q303-R306 PolarHBondContact O-N 2.96Å; Q303-R306 VanDerWaalsContact O-N 3.11Å; Q303-E307 HydrophobicContact CG-CG 4.48Å; Q303-E307 VanDerWaalsContact CG-OE1 3.27Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.42Å; Q303-E307 PolarHBondContact NE2-OE1 2.86Å; Q303-E307 WeakPolarHBondContact O-CG 3.46Å; Q303-E307 PolarHBondContact O-N 3.32Å
304	A	98.2	Very high	97.4	Very high	19 Å²	19	62.6 Å²	62.6	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-41.9	177.2	0	0	0	0	0	111.7	Y295 P298 D301 R306 E307 F308	Y295-A304 WeakPolarHBondContact OH-CB 3.35Å; P298-A304 HydrophobicContact CG-CB 4.06Å; D301-A304 HydrophobicContact CB-CB 3.98Å; D301-A304 PolarHBondContact OD1-N 3.27Å; A304-R306 PolarHBondContact O-N 3.38Å; A304-E307 PolarHBondContact O-N 2.93Å; A304-F308 WeakPolarHBondContact O-CB 3.37Å; A304-F308 PolarHBondContact O-N 3.15Å
305	A	98.4	Very high	97.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-43.4	175	0	0	0	0	0	112.7	L279 I283 L288 D301 Q303 I309	L279-A305 HydrophobicContact CD2-CB 4.37Å; I283-A305 HydrophobicContact CD1-CB 3.85Å; I283-A305 HydrophobicContact CG1-CB 4.04Å; L288-A305 HydrophobicContact CD2-CB 3.95Å; D301-A305 WeakPolarHBondContact O-CB 3.11Å; D301-A305 PolarHBondContact O-N 3.38Å; D301-A305 VanDerWaalsContact O-N 3.09Å; Q303-A305 VanDerWaalsContact C-N 3.3Å; Q303-A305 PolarHBondContact O-N 3.5Å; A305-I309 VanDerWaalsContact O-CG1 3.3Å; A305-I309 WeakPolarHBondContact O-CG1 3.14Å; A305-I309 PolarHBondContact O-N 3Å
306	R	98.2	Very high	97.4	Very high	62 Å²	62	61.6 Å²	61.6	23%	0.234	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-43.7	177.3	-84.2	-175.3	-65	159.5	-1.7	112.5	L232 L279 A302 Q303 A304 I309 L310 F328	L232-R306 HydrophobicContact CD1-CG 3.99Å; L279-R306 HydrophobicContact CD2-CB 4.48Å; L279-R306 HydrophobicContact CD2-CG 3.44Å; L279-R306 VanDerWaalsContact CD2-CG 3.44Å; A302-R306 WeakPolarHBondContact O-CB 3.43Å; A302-R306 WeakPolarHBondContact O-CG 3.3Å; A302-R306 PolarHBondContact O-N 3.22Å; A302-R306 PolarHBondContact O-NE 3.08Å; Q303-R306 WeakPolarHBondContact O-CB 3.38Å; Q303-R306 PolarHBondContact O-N 2.96Å; Q303-R306 VanDerWaalsContact O-N 3.11Å; A304-R306 PolarHBondContact O-N 3.38Å; R306-I309 PolarHBondContact O-N 3.35Å; R306-L310 WeakPolarHBondContact O-CB 3.46Å; R306-L310 PolarHBondContact O-N 3.5Å; R306-F328 HydrophobicContact CB-CD1 4.21Å; R306-F328 HydrophobicContact CB-CE1 3.55Å; R306-F328 HydrophobicContact CB-CZ 3.75Å; R306-F328 HydrophobicContact CG-CD1 4.09Å; R306-F328 HydrophobicContact CG-CE1 3.88Å
307	E	98.3	Very high	97.3	Very high	103 Å²	103	55.8 Å²	55.8	48%	0.481	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-41.3	179.7	-71.9	173.9	-170.9	0	0	111.3	Q303 A304 L310 K311	Q303-E307 HydrophobicContact CG-CG 4.48Å; Q303-E307 VanDerWaalsContact CG-OE1 3.27Å; Q303-E307 WeakPolarHBondContact CG-OE1 3.42Å; Q303-E307 PolarHBondContact NE2-OE1 2.86Å; Q303-E307 WeakPolarHBondContact O-CG 3.46Å; Q303-E307 PolarHBondContact O-N 3.32Å; A304-E307 PolarHBondContact O-N 2.93Å; E307-L310 PolarHBondContact O-N 3.34Å; E307-K311 WeakPolarHBondContact O-CB 3.43Å; E307-K311 PolarHBondContact O-N 2.71Å
308	F	98.5	Very high	97.1	Very high	33 Å²	33	59.3 Å²	59.3	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-49.3	172.8	175.7	-96.5	0	0	0	112.1	L288 F292 E294 Y295 A304 L310 K311 M312	L288-F308 HydrophobicContact CD2-CB 4.44Å; L288-F308 HydrophobicContact CD2-CD1 3.61Å; L288-F308 HydrophobicContact CD2-CE1 4.2Å; L288-F308 HydrophobicContact CD2-CG 4.32Å; L288-F308 HydrophobicContact CG-CD1 4.38Å; F292-F308 HydrophobicContact CB-CE1 3.76Å; F292-F308 HydrophobicContact CB-CZ 4.03Å; F292-F308 HydrophobicContact CG-CE1 4.2Å; E294-F308 HydrophobicContact CB-CE2 4.39Å; E294-F308 HydrophobicContact CB-CZ 4.29Å; Y295-F308 HydrophobicContact CD2-CB 3.65Å; Y295-F308 AromaticContact CD2-CD1 3.94Å; Y295-F308 HydrophobicContact CD2-CD1 3.94Å; Y295-F308 AromaticContact CD2-CD2 3.71Å; Y295-F308 HydrophobicContact CD2-CD2 3.71Å; Y295-F308 HydrophobicContact CD2-CE1 4.48Å; Y295-F308 HydrophobicContact CD2-CE2 4.3Å; Y295-F308 AromaticContact CD2-CG 3.49Å; Y295-F308 HydrophobicContact CD2-CG 3.49Å; Y295-F308 VanDerWaalsContact CD2-CG 3.49Å; Y295-F308 HydrophobicContact CE2-CB 3.87Å; Y295-F308 HydrophobicContact CE2-CG 4.23Å; Y295-F308 HydrophobicContact CG-CD2 4.49Å; Y295-F308 HydrophobicContact CG-CG 4.41Å; A304-F308 WeakPolarHBondContact O-CB 3.37Å; A304-F308 PolarHBondContact O-N 3.15Å; F308-L310 PolarHBondContact O-N 3.07Å; F308-K311 WeakPolarHBondContact O-CB 3.13Å; F308-K311 PolarHBondContact O-N 2.93Å; F308-M312 HydrophobicContact CD1-CE 3.87Å; F308-M312 HydrophobicContact CD1-CG 4.15Å; F308-M312 HydrophobicContact CD1-SD 4.15Å; F308-M312 HydrophobicContact CE1-CE 3.61Å; F308-M312 HydrophobicContact CE1-CG 3.8Å; F308-M312 HydrophobicContact CE1-SD 3.43Å; F308-M312 WeakPolarHBondContact CE1-SD 3.25Å; F308-M312 HydrophobicContact CZ-CG 4.03Å; F308-M312 HydrophobicContact CZ-SD 3.91Å; F308-M312 WeakPolarHBondContact O-CG 3.47Å; F308-M312 PolarHBondContact O-N 3.42Å
309	I	98.6	Very high	96.8	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-42.9	179.1	-63.9	163.9	0	0	0	110.6	L232 M248 L273 L279 L288 A305 R306 K311 M312 F313	L232-I309 HydrophobicContact CD2-CB 4.04Å; L232-I309 HydrophobicContact CD2-CD1 3.89Å; L232-I309 HydrophobicContact CD2-CG2 3.73Å; M248-I309 HydrophobicContact CE-CD1 4.25Å; M248-I309 HydrophobicContact CE-CG2 4.04Å; M248-I309 HydrophobicContact SD-CG2 4.08Å; L273-I309 HydrophobicContact CD2-CG2 3.89Å; L279-I309 HydrophobicContact CD1-CD1 4.48Å; L279-I309 HydrophobicContact CD2-CD1 4.27Å; L288-I309 HydrophobicContact CD1-CD1 4.4Å; L288-I309 HydrophobicContact CD2-CG1 4.36Å; A305-I309 VanDerWaalsContact O-CG1 3.3Å; A305-I309 WeakPolarHBondContact O-CG1 3.14Å; A305-I309 PolarHBondContact O-N 3Å; R306-I309 PolarHBondContact O-N 3.35Å; I309-K311 VanDerWaalsContact C-N 3.3Å; I309-K311 PolarHBondContact O-N 2.85Å; I309-M312 HydrophobicContact CB-CE 4.01Å; I309-M312 HydrophobicContact CG1-CE 3.66Å; I309-M312 HydrophobicContact CG2-CE 4.1Å; I309-M312 WeakPolarHBondContact O-CB 3.49Å; I309-M312 PolarHBondContact O-N 2.82Å; I309-F313 HydrophobicContact CG2-CD2 4.11Å; I309-F313 HydrophobicContact CG2-CE2 4Å; I309-F313 WeakPolarHBondContact O-CD2 3.31Å; I309-F313 PolarHBondContact O-N 2.77Å
310	L	98.5	Very high	96.4	Very high	34 Å²	34	58.8 Å²	58.8	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-54.5	-49.1	173.5	167.1	60.7	0	0	0	111.2	L271 L273 R306 E307 F308 M312 F313 V314 S326 F328	L271-L310 HydrophobicContact CD2-CD1 4.2Å; L273-L310 HydrophobicContact CD1-CB 4.09Å; L273-L310 HydrophobicContact CD1-CD1 3.61Å; L273-L310 HydrophobicContact CD1-CG 4.36Å; L273-L310 HydrophobicContact CD2-CB 4.35Å; R306-L310 WeakPolarHBondContact O-CB 3.46Å; R306-L310 PolarHBondContact O-N 3.5Å; E307-L310 PolarHBondContact O-N 3.34Å; F308-L310 PolarHBondContact O-N 3.07Å; L310-M312 VanDerWaalsContact C-N 3.33Å; L310-M312 PolarHBondContact O-N 3.36Å; L310-F313 PolarHBondContact O-N 2.87Å; L310-F313 VanDerWaalsContact O-N 3.13Å; L310-V314 HydrophobicContact CD1-CG2 3.66Å; L310-V314 HydrophobicContact CG-CG2 4.32Å; L310-V314 WeakPolarHBondContact O-CG2 3.43Å; L310-V314 PolarHBondContact O-N 3.27Å; L310-S326 WeakPolarHBondContact CD1-OG 3.32Å; L310-F328 HydrophobicContact CB-CE1 4.41Å; L310-F328 HydrophobicContact CB-CZ 3.93Å; L310-F328 HydrophobicContact CD2-CE2 4.24Å; L310-F328 HydrophobicContact CD2-CZ 3.98Å
311	K	97.9	Very high	96	Very high	116 Å²	116	58.5 Å²	58.5	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-58.6	-44	178	179.3	168.5	175	49.3	0	111.8	E307 F308 I309 F313 V314 D315	E307-K311 WeakPolarHBondContact O-CB 3.43Å; E307-K311 PolarHBondContact O-N 2.71Å; F308-K311 WeakPolarHBondContact O-CB 3.13Å; F308-K311 PolarHBondContact O-N 2.93Å; I309-K311 VanDerWaalsContact C-N 3.3Å; I309-K311 PolarHBondContact O-N 2.85Å; K311-F313 PolarHBondContact O-N 3.18Å; K311-V314 PolarHBondContact O-N 3.44Å; K311-D315 VanDerWaalsContact CE-OD2 3.31Å; K311-D315 WeakPolarHBondContact CE-OD2 3.32Å; K311-D315 VanDerWaalsContact CG-OD2 3.27Å; K311-D315 WeakPolarHBondContact CG-OD2 3.33Å; K311-D315 VanDerWaalsContact NZ-CG 3.33Å; K311-D315 IonicContact NZ-OD1 2.77Å; K311-D315 PolarHBondContact NZ-OD1 2.65Å; K311-D315 VanDerWaalsContact NZ-OD1 3.09Å; K311-D315 IonicContact NZ-OD2 3.87Å; K311-D315 PolarHBondContact NZ-OD2 3.03Å; K311-D315 VanDerWaalsContact O-CB 3.32Å; K311-D315 WeakPolarHBondContact O-CB 3.42Å; K311-D315 VanDerWaalsContact O-CG 3.25Å; K311-D315 PolarHBondContact O-N 2.75Å
312	M	98	Very high	95.6	Very high	22 Å²	22	56.9 Å²	56.9	11%	0.108	31%	0.305	C	S	.	.	H	α-helix	trans	-54.7	-36.1	176.3	-72.8	-162.4	-70.1	0	0	113.1	K252 F292 F308 I309 L310 L316	K252-M312 HydrophobicContact CD-SD 4.16Å; F292-M312 HydrophobicContact CD1-CE 3.98Å; F292-M312 HydrophobicContact CD1-SD 3.5Å; F292-M312 VanDerWaalsContact CD1-SD 3.5Å; F292-M312 HydrophobicContact CE1-CE 3.96Å; F292-M312 HydrophobicContact CE1-SD 3.77Å; F292-M312 HydrophobicContact CG-CE 4.3Å; F292-M312 HydrophobicContact CG-SD 4.19Å; F292-M312 HydrophobicContact CZ-CE 4.31Å; F308-M312 HydrophobicContact CD1-CE 3.87Å; F308-M312 HydrophobicContact CD1-CG 4.15Å; F308-M312 HydrophobicContact CD1-SD 4.15Å; F308-M312 HydrophobicContact CE1-CE 3.61Å; F308-M312 HydrophobicContact CE1-CG 3.8Å; F308-M312 HydrophobicContact CE1-SD 3.43Å; F308-M312 WeakPolarHBondContact CE1-SD 3.25Å; F308-M312 HydrophobicContact CZ-CG 4.03Å; F308-M312 HydrophobicContact CZ-SD 3.91Å; F308-M312 WeakPolarHBondContact O-CG 3.47Å; F308-M312 PolarHBondContact O-N 3.42Å; I309-M312 HydrophobicContact CB-CE 4.01Å; I309-M312 HydrophobicContact CG1-CE 3.66Å; I309-M312 HydrophobicContact CG2-CE 4.1Å; I309-M312 WeakPolarHBondContact O-CB 3.49Å; I309-M312 PolarHBondContact O-N 2.82Å; L310-M312 VanDerWaalsContact C-N 3.33Å; L310-M312 PolarHBondContact O-N 3.36Å; M312-L316 WeakPolarHBondContact O-CG 3.26Å
313	F	98.3	Very high	95.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-82.5	-41.1	178.4	-81	-98.2	0	0	0	112.5	F228 V230 M248 K252 F255 L271 I309 L310 K311 D315 L316	F228-F313 HydrophobicContact CE1-CE1 4.42Å; V230-F313 HydrophobicContact CB-CE1 4.46Å; V230-F313 HydrophobicContact CB-CZ 4.2Å; V230-F313 HydrophobicContact CG1-CE1 4.23Å; V230-F313 HydrophobicContact CG1-CE2 3.71Å; V230-F313 HydrophobicContact CG1-CZ 3.51Å; V230-F313 HydrophobicContact CG2-CD1 3.82Å; V230-F313 HydrophobicContact CG2-CE1 3.36Å; V230-F313 HydrophobicContact CG2-CE2 4.17Å; V230-F313 HydrophobicContact CG2-CG 4.42Å; V230-F313 HydrophobicContact CG2-CZ 3.56Å; M248-F313 HydrophobicContact SD-CE2 3.57Å; M248-F313 VanDerWaalsContact SD-CE2 3.57Å; M248-F313 HydrophobicContact SD-CZ 3.82Å; K252-F313 HydrophobicContact CB-CZ 4.39Å; K252-F313 HydrophobicContact CG-CD2 4.3Å; K252-F313 HydrophobicContact CG-CE1 4.11Å; K252-F313 HydrophobicContact CG-CE2 3.72Å; K252-F313 HydrophobicContact CG-CZ 3.6Å; F255-F313 HydrophobicContact CB-CD1 3.84Å; F255-F313 HydrophobicContact CB-CE1 3.84Å; F255-F313 HydrophobicContact CD1-CB 4.35Å; F255-F313 AromaticContact CD1-CD1 3.64Å; F255-F313 HydrophobicContact CD1-CD1 3.64Å; F255-F313 HydrophobicContact CD1-CE1 4.49Å; F255-F313 HydrophobicContact CD1-CG 4.46Å; F255-F313 HydrophobicContact CE1-CB 4.3Å; F255-F313 HydrophobicContact CE1-CD1 4.3Å; F255-F313 WeakPolarHBondContact CE1-O 3.31Å; F255-F313 AromaticContact CG-CD1 3.75Å; F255-F313 HydrophobicContact CG-CD1 3.75Å; F255-F313 HydrophobicContact CG-CE1 4.24Å; L271-F313 HydrophobicContact CD1-CD1 4.18Å; L271-F313 HydrophobicContact CD1-CG 4.49Å; L271-F313 HydrophobicContact CD2-CB 3.57Å; L271-F313 HydrophobicContact CD2-CG 4.27Å; I309-F313 HydrophobicContact CG2-CD2 4.11Å; I309-F313 HydrophobicContact CG2-CE2 4Å; I309-F313 WeakPolarHBondContact O-CD2 3.31Å; I309-F313 PolarHBondContact O-N 2.77Å; L310-F313 PolarHBondContact O-N 2.87Å; L310-F313 VanDerWaalsContact O-N 3.13Å; K311-F313 PolarHBondContact O-N 3.18Å; F313-D315 VanDerWaalsContact C-N 3.31Å; F313-D315 PolarHBondContact O-N 3.39Å; F313-L316 WeakPolarHBondContact O-CB 3.39Å; F313-L316 PolarHBondContact O-N 2.94Å
314	V	97.1	Very high	95.2	Very high	56 Å²	56	56.9 Å²	56.9	34%	0.339	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-40.1	178.7	172.1	0	0	0	0	111	L310 K311 L316 N317	L310-V314 HydrophobicContact CD1-CG2 3.66Å; L310-V314 HydrophobicContact CG-CG2 4.32Å; L310-V314 WeakPolarHBondContact O-CG2 3.43Å; L310-V314 PolarHBondContact O-N 3.27Å; K311-V314 PolarHBondContact O-N 3.44Å; V314-L316 PolarHBondContact O-N 3.09Å; V314-L316 VanDerWaalsContact O-N 3.16Å; V314-N317 VanDerWaalsContact O-CB 3.23Å; V314-N317 WeakPolarHBondContact O-CB 3.44Å; V314-N317 PolarHBondContact O-N 3.13Å; V314-N317 VanDerWaalsContact O-N 3.09Å
315	D	96.3	Very high	95	Very high	101 Å²	101	59 Å²	59	54%	0.54	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	179	-70.3	-7.9	0	0	0	113.2	K311 F313 N317	K311-D315 VanDerWaalsContact CE-OD2 3.31Å; K311-D315 WeakPolarHBondContact CE-OD2 3.32Å; K311-D315 VanDerWaalsContact CG-OD2 3.27Å; K311-D315 WeakPolarHBondContact CG-OD2 3.33Å; K311-D315 VanDerWaalsContact NZ-CG 3.33Å; K311-D315 IonicContact NZ-OD1 2.77Å; K311-D315 PolarHBondContact NZ-OD1 2.65Å; K311-D315 VanDerWaalsContact NZ-OD1 3.09Å; K311-D315 IonicContact NZ-OD2 3.87Å; K311-D315 PolarHBondContact NZ-OD2 3.03Å; K311-D315 VanDerWaalsContact O-CB 3.32Å; K311-D315 WeakPolarHBondContact O-CB 3.42Å; K311-D315 VanDerWaalsContact O-CG 3.25Å; K311-D315 PolarHBondContact O-N 2.75Å; F313-D315 VanDerWaalsContact C-N 3.31Å; F313-D315 PolarHBondContact O-N 3.39Å; D315-N317 PolarHBondContact O-N 3.48Å
316	L	96.7	Very high	95	Very high	36 Å²	36	61.1 Å²	61.1	19%	0.188	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14	173	-64.7	170.1	0	0	0	112.9	K252 F255 R256 I259 M312 F313 V314 P318	K252-L316 HydrophobicContact CB-CD1 3.94Å; K252-L316 HydrophobicContact CG-CD1 4.25Å; K252-L316 WeakPolarHBondContact O-CD1 3.38Å; F255-L316 HydrophobicContact CD1-CB 4.4Å; F255-L316 HydrophobicContact CD1-CD1 4.04Å; R256-L316 HydrophobicContact CB-CB 4.44Å; R256-L316 HydrophobicContact CB-CD1 4.41Å; R256-L316 HydrophobicContact CB-CD2 4.47Å; I259-L316 HydrophobicContact CD1-CB 4.42Å; M312-L316 WeakPolarHBondContact O-CG 3.26Å; F313-L316 WeakPolarHBondContact O-CB 3.39Å; F313-L316 PolarHBondContact O-N 2.94Å; V314-L316 PolarHBondContact O-N 3.09Å; V314-L316 VanDerWaalsContact O-N 3.16Å; L316-P318 VanDerWaalsContact O-CD 3.24Å; L316-P318 WeakPolarHBondContact O-CD 3.34Å
317	N	94.5	Very high	95	Very high	32 Å²	32	60.1 Å²	60.1	17%	0.171	32%	0.322	C	S	.	.			trans	-73.6	112.8	-178.1	-171.7	17.8	0	0	0	111.4	I259 V314 D315 D319 K322 I324	I259-N317 HydrophobicContact CD1-CB 4.28Å; V314-N317 VanDerWaalsContact O-CB 3.23Å; V314-N317 WeakPolarHBondContact O-CB 3.44Å; V314-N317 PolarHBondContact O-N 3.13Å; V314-N317 VanDerWaalsContact O-N 3.09Å; D315-N317 PolarHBondContact O-N 3.48Å; N317-D319 VanDerWaalsContact C-N 3.27Å; N317-D319 PolarHBondContact ND2-O 3.31Å; N317-D319 PolarHBondContact O-N 3.46Å; N317-D319 PolarHBondContact OD1-N 3.34Å; N317-D319 PolarHBondContact OD1-O 3.1Å; N317-K322 PolarHBondContact ND2-O 3.27Å; N317-I324 HydrophobicContact CB-CD1 3.61Å
318	P	91	Very high	95	Very high	100 Å²	100	57.8 Å²	57.8	65%	0.649	31%	0.31	S	S	*	.	S	Bend	trans	-78	-14.8	178.2	34	-35.3	0	0	0	112.8	T260 L316	T260-P318 HydrophobicContact CG2-CG 3.95Å; L316-P318 VanDerWaalsContact O-CD 3.24Å; L316-P318 WeakPolarHBondContact O-CD 3.34Å
319	D	90.7	Very high	95	Very high	71 Å²	71	56.2 Å²	56.2	38%	0.38	30%	0.303	S	S	.	.			trans	-106.2	102.6	-175.8	-178.4	-4.6	0	0	0	110.3	N317 D321 K322	N317-D319 VanDerWaalsContact C-N 3.27Å; N317-D319 PolarHBondContact ND2-O 3.31Å; N317-D319 PolarHBondContact O-N 3.46Å; N317-D319 PolarHBondContact OD1-N 3.34Å; N317-D319 PolarHBondContact OD1-O 3.1Å; D319-D321 PolarHBondContact O-N 3.28Å; D319-D321 WeakPolarHBondContact OD1-CB 3.39Å; D319-D321 PolarHBondContact OD1-N 3.46Å; D319-K322 HydrophobicContact CB-CB 3.94Å; D319-K322 PolarHBondContact O-N 2.74Å; D319-K322 PolarHBondContact OD1-N 2.96Å
320	S	85.8	Confident	94.9	Very high	114 Å²	114	56.6 Å²	56.6	80%	0.797	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.1	179.8	55.2	0	0	0	0	114
321	D	87.5	Confident	94.9	Very high	142 Å²	142	55.2 Å²	55.2	76%	0.759	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-22.4	-179.7	-63.7	-23.2	0	0	0	111.2	D319 I323	D319-D321 PolarHBondContact O-N 3.28Å; D319-D321 WeakPolarHBondContact OD1-CB 3.39Å; D319-D321 PolarHBondContact OD1-N 3.46Å; D321-I323 PolarHBondContact O-N 3.13Å
322	K	89.1	Confident	94.8	Very high	27 Å²	27	51.1 Å²	51.1	12%	0.117	28%	0.284	C	S	.	.	S	Bend	trans	-82.5	103.3	177.2	-170.3	165.9	-171.8	160.5	0	111.3	F264 Q265 S267 N317 D319 I324	F264-K322 PolarHBondContact O-NZ 2.86Å; Q265-K322 PolarHBondContact O-NZ 2.86Å; Q265-K322 VanDerWaalsContact O-NZ 3.17Å; S267-K322 VanDerWaalsContact O-CE 3.22Å; S267-K322 WeakPolarHBondContact O-CE 3.42Å; S267-K322 PolarHBondContact O-NZ 3.41Å; N317-K322 PolarHBondContact ND2-O 3.27Å; D319-K322 HydrophobicContact CB-CB 3.94Å; D319-K322 PolarHBondContact O-N 2.74Å; D319-K322 PolarHBondContact OD1-N 2.96Å; K322-I324 PolarHBondContact O-N 2.88Å
323	I	91.4	Very high	94.8	Very high	105 Å²	105	53.4 Å²	53.4	54%	0.538	30%	0.296	S	S	.	.			trans	-72.1	129.4	177.8	-59	173	0	0	0	110.6	D321 Y325	D321-I323 PolarHBondContact O-N 3.13Å; I323-Y325 HydrophobicContact CB-CE2 4.16Å; I323-Y325 HydrophobicContact CG2-CD1 4.22Å; I323-Y325 HydrophobicContact CG2-CD2 4.28Å; I323-Y325 HydrophobicContact CG2-CE1 3.9Å; I323-Y325 HydrophobicContact CG2-CE2 3.95Å; I323-Y325 HydrophobicContact CG2-CG 4.41Å
324	I	95.3	Very high	94.8	Very high	21 Å²	21	54.5 Å²	54.5	11%	0.108	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	114.3	168.4	-64.5	169.3	0	0	0	108.6	F255 V269 L271 N317 K322 S326	F255-I324 HydrophobicContact CE1-CD1 4.02Å; F255-I324 HydrophobicContact CZ-CD1 3.85Å; F255-I324 HydrophobicContact CZ-CG2 4.4Å; V269-I324 HydrophobicContact CB-CG1 4.46Å; V269-I324 HydrophobicContact CG1-CG1 4.28Å; V269-I324 HydrophobicContact CG1-CG2 4.39Å; L271-I324 HydrophobicContact CB-CG2 3.66Å; L271-I324 HydrophobicContact CD2-CG2 4.27Å; N317-I324 HydrophobicContact CB-CD1 3.61Å; K322-I324 PolarHBondContact O-N 2.88Å; I324-S326 PolarHBondContact O-N 2.97Å
325	Y	95.5	Very high	94.9	Very high	64 Å²	64	56.1 Å²	56.1	25%	0.251	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.1	177.9	-62.6	-85.5	0	0	0	109.9	V269 I270 L271 I323 T347 L351	V269-Y325 PolarHBondContact O-N 2.78Å; I270-Y325 CarbonylContact C-O 3.59Å; I270-Y325 VanDerWaalsContact CA-O 3.26Å; I270-Y325 WeakPolarHBondContact CA-O 3.2Å; L271-Y325 PolarHBondContact N-O 2.93Å; I323-Y325 HydrophobicContact CB-CE2 4.16Å; I323-Y325 HydrophobicContact CG2-CD1 4.22Å; I323-Y325 HydrophobicContact CG2-CD2 4.28Å; I323-Y325 HydrophobicContact CG2-CE1 3.9Å; I323-Y325 HydrophobicContact CG2-CE2 3.95Å; I323-Y325 HydrophobicContact CG2-CG 4.41Å; Y325-T347 HydrophobicContact CD1-CG2 3.76Å; Y325-T347 HydrophobicContact CD2-CG2 3.84Å; Y325-T347 HydrophobicContact CE1-CG2 3.6Å; Y325-T347 HydrophobicContact CE2-CG2 3.68Å; Y325-T347 HydrophobicContact CG-CG2 3.87Å; Y325-L351 HydrophobicContact CE2-CD1 3.92Å
326	S	97.5	Very high	94.9	Very high	44 Å²	44	52.4 Å²	52.4	31%	0.308	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.2	-174.3	61.9	0	0	0	0	113.5	L271 L310 I324	L271-S326 CarbonylContact O-C 3.52Å; L271-S326 VanDerWaalsContact O-CA 3.27Å; L271-S326 WeakPolarHBondContact O-CA 3.46Å; L310-S326 WeakPolarHBondContact CD1-OG 3.32Å; I324-S326 PolarHBondContact O-N 2.97Å
327	H	98.1	Very high	95	Very high	42 Å²	42	50.7 Å²	50.7	19%	0.194	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	131.5	176.7	-61.6	-84.6	0	0	0	111.5	L271 F272 L273 T329 V340 V344	L271-H327 PolarHBondContact O-N 3.41Å; F272-H327 WeakPolarHBondContact CA-O 3.35Å; F272-H327 HydrophobicContact CD1-CB 3.94Å; F272-H327 HydrophobicContact CE1-CB 4.1Å; L273-H327 PolarHBondContact N-O 2.67Å; H327-T329 HydrophobicContact CB-CG2 4.49Å; H327-V340 HydrophobicContact CB-CG1 3.67Å; H327-V340 HydrophobicContact CB-CG2 4.32Å; H327-V344 WeakPolarHBondContact NE2-CG2 3.34Å
328	F	98.3	Very high	95.1	Very high	53 Å²	53	53.7 Å²	53.7	23%	0.232	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.5	169.4	-64.5	-69.3	0	0	0	110.6	L232 L273 K276 R306 L310	L232-F328 HydrophobicContact CD1-CD1 4.07Å; L273-F328 HydrophobicContact CB-CD1 3.51Å; L273-F328 HydrophobicContact CB-CE1 3.76Å; L273-F328 HydrophobicContact CD1-CD1 4.18Å; L273-F328 HydrophobicContact CD1-CE1 3.83Å; L273-F328 HydrophobicContact CD1-CZ 4.32Å; L273-F328 HydrophobicContact CD2-CE1 4.24Å; L273-F328 HydrophobicContact CG-CD1 4.36Å; L273-F328 HydrophobicContact CG-CE1 4.15Å; L273-F328 CarbonylContact O-C 3.55Å; L273-F328 WeakPolarHBondContact O-CA 3.21Å; K276-F328 HydrophobicContact CD-CB 4.34Å; R306-F328 HydrophobicContact CB-CD1 4.21Å; R306-F328 HydrophobicContact CB-CE1 3.55Å; R306-F328 HydrophobicContact CB-CZ 3.75Å; R306-F328 HydrophobicContact CG-CD1 4.09Å; R306-F328 HydrophobicContact CG-CE1 3.88Å; L310-F328 HydrophobicContact CB-CE1 4.41Å; L310-F328 HydrophobicContact CB-CZ 3.93Å; L310-F328 HydrophobicContact CD2-CE2 4.24Å; L310-F328 HydrophobicContact CD2-CZ 3.98Å
329	T	98.3	Very high	95.3	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.006	29%	0.287	C	S	.	.			trans	-126.4	153.2	-173.4	50.9	0	0	0	0	113.1	F272 L273 N274 K275 K276 H327 N336 I337 V340	F272-T329 HydrophobicContact CD1-CG2 3.68Å; F272-T329 HydrophobicContact CE1-CG2 4.3Å; F272-T329 HydrophobicContact CG-CG2 4.47Å; L273-T329 PolarHBondContact O-N 3.33Å; N274-T329 CarbonylContact C-O 3.2Å; N274-T329 WeakPolarHBondContact CA-O 3.42Å; N274-T329 VanDerWaalsContact CA-OG1 3.22Å; N274-T329 WeakPolarHBondContact CA-OG1 3.42Å; N274-T329 WeakPolarHBondContact CB-OG1 3.46Å; N274-T329 PolarHBondContact OD1-O 3.38Å; N274-T329 PolarHBondContact OD1-OG1 2.8Å; K275-T329 PolarHBondContact N-O 3.26Å; K275-T329 VanDerWaalsContact N-O 3.08Å; K276-T329 WeakPolarHBondContact CG-O 3.19Å; K276-T329 PolarHBondContact N-O 2.85Å; H327-T329 HydrophobicContact CB-CG2 4.49Å; T329-N336 WeakPolarHBondContact CA-OD1 3.43Å; T329-I337 HydrophobicContact CG2-CD1 3.93Å; T329-V340 HydrophobicContact CG2-CB 4.25Å; T329-V340 HydrophobicContact CG2-CG1 3.8Å; T329-V340 HydrophobicContact CG2-CG2 4.06Å
330	C	98.1	Very high	95.5	Very high	8 Å²	8	53.2 Å²	53.2	5%	0.054	27%	0.273	C	S	.	.			trans	-122.5	104.2	155.2	173.3	0	0	0	0	106.5	K276 D277 T332 D333 N336	K276-C330 HydrophobicContact CG-CB 4.34Å; D277-C330 PolarHBondContact OD1-SG 3.13Å; D277-C330 VanDerWaalsContact OD1-SG 3.39Å; C330-T332 PolarHBondContact O-N 3.38Å; C330-T332 PolarHBondContact SG-OG1 3.23Å; C330-D333 HydrophobicContact CB-CB 3.98Å; C330-D333 WeakPolarHBondContact O-CB 3.46Å; C330-D333 PolarHBondContact O-N 2.86Å; C330-N336 PolarHBondContact N-OD1 2.69Å
331	A	97.3	Very high	95.9	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.033	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.3	-176.7	0	0	0	0	0	113.7	T54 Q58 N274	T54-A331 HydrophobicContact CG2-CB 3.69Å; T54-A331 WeakPolarHBondContact CG2-O 3.26Å; Q58-A331 WeakPolarHBondContact CG-O 3.37Å; Q58-A331 PolarHBondContact NE2-O 3.44Å; N274-A331 PolarHBondContact OD1-N 3.3Å
332	T	97	Very high	96.1	Very high	30 Å²	30	43.2 Å²	43.2	18%	0.184	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.8	175	71.1	0	0	0	0	114.1	T54 Q177 R181 C330	T54-T332 HydrophobicContact CG2-CG2 4.31Å; Q177-T332 PolarHBondContact OE1-O 3.22Å; R181-T332 HydrophobicContact CG-CG2 4.17Å; C330-T332 PolarHBondContact O-N 3.38Å; C330-T332 PolarHBondContact SG-OG1 3.23Å
333	D	98	Very high	96.3	Very high	70 Å²	70	44 Å²	44	37%	0.374	23%	0.228	S	C	.	.			trans	-99.3	104.2	173.2	176.3	-10.8	0	0	0	109.2	C330 E335 N336 I337	C330-D333 HydrophobicContact CB-CB 3.98Å; C330-D333 WeakPolarHBondContact O-CB 3.46Å; C330-D333 PolarHBondContact O-N 2.86Å; D333-E335 VanDerWaalsContact C-N 3.3Å; D333-E335 PolarHBondContact O-N 2.75Å; D333-E335 PolarHBondContact OD1-N 3.16Å; D333-E335 VanDerWaalsContact OD1-N 3.07Å; D333-N336 HydrophobicContact CB-CB 3.83Å; D333-N336 VanDerWaalsContact CG-CB 3.42Å; D333-N336 PolarHBondContact O-N 3.1Å; D333-N336 PolarHBondContact OD1-N 3.3Å; D333-N336 WeakPolarHBondContact OD2-CB 3.35Å; D333-I337 PolarHBondContact O-N 3.44Å
334	T	97.8	Very high	96.3	Very high	24 Å²	24	39 Å²	39	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-36.8	-176.3	-54.1	0	0	0	0	112.5	Q58 I61 I62 R338	Q58-T334 PolarHBondContact NE2-OG1 2.89Å; Q58-T334 PolarHBondContact OE1-OG1 3.2Å; I61-T334 HydrophobicContact CG2-CG2 4.05Å; I62-T334 HydrophobicContact CD1-CG2 4.24Å; I62-T334 HydrophobicContact CG1-CG2 3.9Å; T334-R338 WeakPolarHBondContact O-CB 3.24Å; T334-R338 PolarHBondContact O-N 3.01Å
335	E	97.7	Very high	96.1	Very high	89 Å²	89	40.5 Å²	40.5	42%	0.416	21%	0.208	S	C	.	.	H	α-helix	trans	-73.8	-42.2	179.9	-68.8	-53.5	114.7	0	0	110.8	D333 I337 R338 F339	D333-E335 VanDerWaalsContact C-N 3.3Å; D333-E335 PolarHBondContact O-N 2.75Å; D333-E335 PolarHBondContact OD1-N 3.16Å; D333-E335 VanDerWaalsContact OD1-N 3.07Å; E335-I337 VanDerWaalsContact C-N 3.31Å; E335-I337 PolarHBondContact O-N 2.94Å; E335-R338 WeakPolarHBondContact O-CB 3.18Å; E335-R338 PolarHBondContact O-N 3.31Å; E335-R338 IonicContact OE1-CZ 3.78Å; E335-R338 IonicContact OE1-NE 3.48Å; E335-R338 PolarHBondContact OE1-NE 2.87Å; E335-R338 IonicContact OE1-NH2 3.8Å; E335-R338 PolarHBondContact OE1-NH2 3.24Å; E335-R338 IonicContact OE2-NE 3.72Å; E335-R338 PolarHBondContact OE2-NE 3.12Å; E335-F339 HydrophobicContact CB-CE2 4.41Å; E335-F339 WeakPolarHBondContact O-CD2 3.27Å; E335-F339 PolarHBondContact O-N 3.25Å
336	N	97.8	Very high	95.7	Very high	24 Å²	24	41.1 Å²	41.1	13%	0.128	22%	0.216	C	C	.	.	H	α-helix	trans	-56.1	-45.6	172.7	175.6	-110.1	0	0	0	112	K276 T329 C330 D333 V340	K276-N336 PolarHBondContact NZ-ND2 3.22Å; T329-N336 WeakPolarHBondContact CA-OD1 3.43Å; C330-N336 PolarHBondContact N-OD1 2.69Å; D333-N336 HydrophobicContact CB-CB 3.83Å; D333-N336 VanDerWaalsContact CG-CB 3.42Å; D333-N336 PolarHBondContact O-N 3.1Å; D333-N336 PolarHBondContact OD1-N 3.3Å; D333-N336 WeakPolarHBondContact OD2-CB 3.35Å; N336-V340 WeakPolarHBondContact O-CB 3.48Å; N336-V340 VanDerWaalsContact O-CG2 3.28Å; N336-V340 WeakPolarHBondContact O-CG2 3.47Å; N336-V340 PolarHBondContact O-N 3.4Å
337	I	97.8	Very high	95.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-38.1	177.9	-65.4	-51.3	0	0	0	112.1	F55 Q58 M59 I62 T329 D333 E335 F339 V340 F341	F55-I337 HydrophobicContact CD2-CD1 3.97Å; F55-I337 HydrophobicContact CD2-CG2 4.21Å; F55-I337 HydrophobicContact CE2-CD1 4.08Å; F55-I337 HydrophobicContact CE2-CG2 3.96Å; Q58-I337 HydrophobicContact CB-CB 4.33Å; Q58-I337 HydrophobicContact CB-CG2 3.73Å; Q58-I337 HydrophobicContact CG-CB 4.35Å; Q58-I337 HydrophobicContact CG-CG1 4.16Å; Q58-I337 HydrophobicContact CG-CG2 4.25Å; M59-I337 HydrophobicContact CE-CG2 3.47Å; M59-I337 VanDerWaalsContact CE-CG2 3.47Å; I62-I337 HydrophobicContact CD1-CB 4.12Å; I62-I337 HydrophobicContact CD1-CG2 3.75Å; T329-I337 HydrophobicContact CG2-CD1 3.93Å; D333-I337 PolarHBondContact O-N 3.44Å; E335-I337 VanDerWaalsContact C-N 3.31Å; E335-I337 PolarHBondContact O-N 2.94Å; I337-F339 PolarHBondContact O-N 2.8Å; I337-V340 PolarHBondContact O-N 3.48Å; I337-F341 VanDerWaalsContact O-CB 3.26Å; I337-F341 WeakPolarHBondContact O-CB 3.47Å; I337-F341 PolarHBondContact O-N 3.18Å
338	R	96.3	Very high	94.9	Very high	95 Å²	95	38.2 Å²	38.2	36%	0.358	20%	0.199	S	C	.	.	H	α-helix	trans	-58	-49	175.7	-171.4	-168.7	-51.2	-73.1	-3.5	111.7	I62 T334 E335 A342	I62-R338 HydrophobicContact CD1-CB 4.11Å; I62-R338 HydrophobicContact CG2-CB 4.45Å; I62-R338 HydrophobicContact CG2-CG 4.12Å; T334-R338 WeakPolarHBondContact O-CB 3.24Å; T334-R338 PolarHBondContact O-N 3.01Å; E335-R338 WeakPolarHBondContact O-CB 3.18Å; E335-R338 PolarHBondContact O-N 3.31Å; E335-R338 IonicContact OE1-CZ 3.78Å; E335-R338 IonicContact OE1-NE 3.48Å; E335-R338 PolarHBondContact OE1-NE 2.87Å; E335-R338 IonicContact OE1-NH2 3.8Å; E335-R338 PolarHBondContact OE1-NH2 3.24Å; E335-R338 IonicContact OE2-NE 3.72Å; E335-R338 PolarHBondContact OE2-NE 3.12Å; R338-A342 WeakPolarHBondContact O-CB 3.37Å; R338-A342 PolarHBondContact O-N 2.7Å; R338-A342 VanDerWaalsContact O-N 3.09Å
339	F	96.2	Very high	94.3	Very high	146 Å²	146	37.9 Å²	37.9	64%	0.64	20%	0.2	S	C	*	.	H	α-helix	trans	-65.3	-46.3	178.9	-74.4	-64.9	0	0	0	112.3	E335 I337 A342 A343	E335-F339 HydrophobicContact CB-CE2 4.41Å; E335-F339 WeakPolarHBondContact O-CD2 3.27Å; E335-F339 PolarHBondContact O-N 3.25Å; I337-F339 PolarHBondContact O-N 2.8Å; F339-A342 PolarHBondContact O-N 3.42Å; F339-A343 PolarHBondContact O-N 3.35Å
340	V	94.9	Very high	93.6	Very high	14 Å²	14	43.6 Å²	43.6	9%	0.085	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-44.4	-178.4	167	0	0	0	0	111.1	F272 H327 T329 N336 I337 A342 A343 V344	F272-V340 HydrophobicContact CD1-CG1 4.02Å; F272-V340 HydrophobicContact CE1-CG1 3.34Å; F272-V340 HydrophobicContact CZ-CG1 4.28Å; H327-V340 HydrophobicContact CB-CG1 3.67Å; H327-V340 HydrophobicContact CB-CG2 4.32Å; T329-V340 HydrophobicContact CG2-CB 4.25Å; T329-V340 HydrophobicContact CG2-CG1 3.8Å; T329-V340 HydrophobicContact CG2-CG2 4.06Å; N336-V340 WeakPolarHBondContact O-CB 3.48Å; N336-V340 VanDerWaalsContact O-CG2 3.28Å; N336-V340 WeakPolarHBondContact O-CG2 3.47Å; N336-V340 PolarHBondContact O-N 3.4Å; I337-V340 PolarHBondContact O-N 3.48Å; V340-A342 VanDerWaalsContact C-N 3.34Å; V340-A342 PolarHBondContact O-N 3.2Å; V340-A343 PolarHBondContact O-N 3.31Å; V340-V344 HydrophobicContact CG1-CG2 4.35Å; V340-V344 WeakPolarHBondContact O-CB 3.26Å; V340-V344 VanDerWaalsContact O-CG2 3.31Å; V340-V344 WeakPolarHBondContact O-CG2 3.36Å; V340-V344 PolarHBondContact O-N 3.2Å
341	F	93.5	Very high	92.9	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-69.2	-32.5	-180	-173.1	-106	0	0	0	112.6	L42 F55 M59 H63 L196 M203 M227 I337 A343 V344 K345	L42-F341 HydrophobicContact CD1-CE2 4.4Å; F55-F341 HydrophobicContact CE1-CD2 4.14Å; F55-F341 HydrophobicContact CZ-CB 4.42Å; F55-F341 AromaticContact CZ-CD2 3.79Å; F55-F341 HydrophobicContact CZ-CD2 3.79Å; F55-F341 HydrophobicContact CZ-CG 4.46Å; M59-F341 HydrophobicContact CE-CB 3.86Å; M59-F341 HydrophobicContact CE-CD1 4.09Å; M59-F341 HydrophobicContact CE-CD2 4.2Å; M59-F341 HydrophobicContact CE-CG 3.77Å; M59-F341 HydrophobicContact SD-CB 4.38Å; M59-F341 HydrophobicContact SD-CD1 3.61Å; M59-F341 HydrophobicContact SD-CD2 3.75Å; M59-F341 HydrophobicContact SD-CE1 3.69Å; M59-F341 HydrophobicContact SD-CE2 3.82Å; M59-F341 HydrophobicContact SD-CG 3.62Å; M59-F341 HydrophobicContact SD-CZ 3.78Å; H63-F341 AromaticContact CD2-CD1 3.84Å; H63-F341 AromaticContact CD2-CE1 3.76Å; H63-F341 AromaticContact NE2-CD1 3.24Å; H63-F341 WeakPolarHBondContact NE2-CD1 3.47Å; H63-F341 AromaticContact NE2-CE1 3.47Å; H63-F341 WeakPolarHBondContact NE2-CE1 3.2Å; L196-F341 HydrophobicContact CD1-CE1 3.77Å; L196-F341 HydrophobicContact CD1-CZ 4.26Å; M203-F341 HydrophobicContact CE-CD2 4.31Å; M203-F341 HydrophobicContact CE-CE2 3.34Å; M203-F341 HydrophobicContact CE-CZ 3.49Å; M203-F341 VanDerWaalsContact CE-CZ 3.49Å; M227-F341 HydrophobicContact CE-CE2 4.2Å; I337-F341 VanDerWaalsContact O-CB 3.26Å; I337-F341 WeakPolarHBondContact O-CB 3.47Å; I337-F341 PolarHBondContact O-N 3.18Å; F341-A343 PolarHBondContact O-N 2.84Å; F341-V344 HydrophobicContact CD2-CG1 4.47Å; F341-V344 PolarHBondContact O-N 3.46Å; F341-K345 WeakPolarHBondContact O-CB 3.35Å; F341-K345 PolarHBondContact O-N 3.44Å
342	A	92.6	Very high	91.9	Very high	45 Å²	45	46.6 Å²	46.6	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-58.9	-47	171.8	0	0	0	0	0	111.7	R338 F339 V340 K345 D346	R338-A342 WeakPolarHBondContact O-CB 3.37Å; R338-A342 PolarHBondContact O-N 2.7Å; R338-A342 VanDerWaalsContact O-N 3.09Å; F339-A342 PolarHBondContact O-N 3.42Å; V340-A342 VanDerWaalsContact C-N 3.34Å; V340-A342 PolarHBondContact O-N 3.2Å; A342-K345 PolarHBondContact O-N 2.9Å; A342-D346 PolarHBondContact O-N 3.02Å; A342-D346 VanDerWaalsContact O-N 3.13Å
343	A	92.3	Very high	90.8	Very high	42 Å²	42	48.6 Å²	48.6	35%	0.347	25%	0.25	S	C	.	.	H	α-helix	trans	-62.7	-45.4	176.5	0	0	0	0	0	112.1	F339 V340 F341 K345 D346 T347	F339-A343 PolarHBondContact O-N 3.35Å; V340-A343 PolarHBondContact O-N 3.31Å; F341-A343 PolarHBondContact O-N 2.84Å; A343-K345 PolarHBondContact O-N 3.01Å; A343-D346 PolarHBondContact O-N 3.19Å; A343-T347 PolarHBondContact O-N 3.18Å; A343-T347 PolarHBondContact O-OG1 2.8Å
344	V	92.1	Very high	89.2	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-45.6	178.4	164	0	0	0	0	111.8	M227 I270 F272 H327 V340 F341 D346 T347 I348	M227-V344 HydrophobicContact CE-CG1 3.5Å; M227-V344 VanDerWaalsContact CE-CG1 3.5Å; I270-V344 HydrophobicContact CD1-CG1 3.55Å; I270-V344 HydrophobicContact CG1-CG1 4.35Å; I270-V344 HydrophobicContact CG2-CG1 4.48Å; I270-V344 HydrophobicContact CG2-CG2 3.89Å; F272-V344 HydrophobicContact CE1-CG2 3.96Å; F272-V344 HydrophobicContact CZ-CG2 3.87Å; H327-V344 WeakPolarHBondContact NE2-CG2 3.34Å; V340-V344 HydrophobicContact CG1-CG2 4.35Å; V340-V344 WeakPolarHBondContact O-CB 3.26Å; V340-V344 VanDerWaalsContact O-CG2 3.31Å; V340-V344 WeakPolarHBondContact O-CG2 3.36Å; V340-V344 PolarHBondContact O-N 3.2Å; F341-V344 HydrophobicContact CD2-CG1 4.47Å; F341-V344 PolarHBondContact O-N 3.46Å; V344-D346 VanDerWaalsContact C-N 3.31Å; V344-D346 PolarHBondContact O-N 2.95Å; V344-T347 WeakPolarHBondContact O-CB 3.44Å; V344-T347 PolarHBondContact O-N 3.39Å; V344-I348 HydrophobicContact CG1-CD1 3.63Å; V344-I348 HydrophobicContact CG1-CG1 4.33Å; V344-I348 VanDerWaalsContact O-CG1 3.24Å; V344-I348 WeakPolarHBondContact O-CG1 3.49Å; V344-I348 PolarHBondContact O-N 2.76Å
345	K	90.3	Very high	87.5	Confident	54 Å²	54	57.1 Å²	57.1	24%	0.235	28%	0.284	C	S	.	.	H	α-helix	trans	-56.7	-46.8	176.5	-179.2	-153.9	64.7	163.7	0	110.6	L196 F201 F341 A342 A343 T347 I348 L349	L196-K345 HydrophobicContact CD1-CD 4.32Å; F201-K345 HydrophobicContact CE2-CG 4.05Å; F201-K345 HydrophobicContact CZ-CG 3.72Å; F341-K345 WeakPolarHBondContact O-CB 3.35Å; F341-K345 PolarHBondContact O-N 3.44Å; A342-K345 PolarHBondContact O-N 2.9Å; A343-K345 PolarHBondContact O-N 3.01Å; K345-T347 PolarHBondContact O-N 3.48Å; K345-I348 PolarHBondContact O-N 3.27Å; K345-L349 HydrophobicContact CD-CD1 4.31Å; K345-L349 HydrophobicContact CG-CD1 3.94Å; K345-L349 HydrophobicContact CG-CG 4.46Å; K345-L349 WeakPolarHBondContact O-CB 3.35Å; K345-L349 VanDerWaalsContact O-CG 3.25Å; K345-L349 WeakPolarHBondContact O-CG 3.41Å; K345-L349 PolarHBondContact O-N 2.95Å
346	D	88.2	Confident	85.8	Confident	77 Å²	77	57.5 Å²	57.5	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-41	179.8	-68.2	-11.4	0	0	0	111.6	A342 A343 V344 L349 Q350	A342-D346 PolarHBondContact O-N 3.02Å; A342-D346 VanDerWaalsContact O-N 3.13Å; A343-D346 PolarHBondContact O-N 3.19Å; V344-D346 VanDerWaalsContact C-N 3.31Å; V344-D346 PolarHBondContact O-N 2.95Å; D346-L349 PolarHBondContact O-N 3.25Å; D346-Q350 WeakPolarHBondContact O-CB 3.41Å; D346-Q350 VanDerWaalsContact O-CG 3.23Å; D346-Q350 WeakPolarHBondContact O-CG 3.46Å; D346-Q350 PolarHBondContact O-N 2.9Å
347	T	88.2	Confident	83.8	Confident	25 Å²	25	63.3 Å²	63.3	15%	0.153	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-49.2	173.3	-60	0	0	0	0	112.1	Y325 A343 V344 K345 L349 Q350 L351	Y325-T347 HydrophobicContact CD1-CG2 3.76Å; Y325-T347 HydrophobicContact CD2-CG2 3.84Å; Y325-T347 HydrophobicContact CE1-CG2 3.6Å; Y325-T347 HydrophobicContact CE2-CG2 3.68Å; Y325-T347 HydrophobicContact CG-CG2 3.87Å; A343-T347 PolarHBondContact O-N 3.18Å; A343-T347 PolarHBondContact O-OG1 2.8Å; V344-T347 WeakPolarHBondContact O-CB 3.44Å; V344-T347 PolarHBondContact O-N 3.39Å; K345-T347 PolarHBondContact O-N 3.48Å; T347-L349 PolarHBondContact O-N 3.09Å; T347-Q350 PolarHBondContact O-N 3.44Å; T347-L351 HydrophobicContact CG2-CD1 4.02Å; T347-L351 WeakPolarHBondContact O-CG 3.46Å; T347-L351 PolarHBondContact O-N 3.12Å
348	I	89.2	Confident	81.4	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-46.1	-178.7	-64.5	167.6	0	0	0	110.3	L40 L42 F201 T224 S225 M227 I270 V344 K345 Q350 L351 N352	L40-I348 HydrophobicContact CD1-CG2 3.86Å; L42-I348 HydrophobicContact CD2-CD1 3.73Å; F201-I348 HydrophobicContact CE1-CD1 4.49Å; F201-I348 HydrophobicContact CE1-CG2 4.29Å; T224-I348 HydrophobicContact CG2-CG2 4.1Å; S225-I348 WeakPolarHBondContact OG-CG1 3.47Å; M227-I348 HydrophobicContact CE-CD1 3.71Å; I270-I348 HydrophobicContact CD1-CD1 3.71Å; I270-I348 HydrophobicContact CD1-CG1 3.83Å; V344-I348 HydrophobicContact CG1-CD1 3.63Å; V344-I348 HydrophobicContact CG1-CG1 4.33Å; V344-I348 VanDerWaalsContact O-CG1 3.24Å; V344-I348 WeakPolarHBondContact O-CG1 3.49Å; V344-I348 PolarHBondContact O-N 2.76Å; K345-I348 PolarHBondContact O-N 3.27Å; I348-Q350 PolarHBondContact O-N 2.93Å; I348-L351 PolarHBondContact O-N 3.23Å; I348-N352 PolarHBondContact O-N 3.25Å; I348-N352 PolarHBondContact O-ND2 3.01Å
349	L	86.9	Confident	78.8	Confident	45 Å²	45	72.9 Å²	72.9	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-63.3	-42.7	179.7	-69.7	174.2	0	0	0	111.7	L40 V199 F201 K345 D346 T347 L351 N352 L353	L40-L349 HydrophobicContact CD1-CD2 3.87Å; V199-L349 HydrophobicContact CB-CD2 4.38Å; V199-L349 HydrophobicContact CG1-CD2 4.14Å; V199-L349 HydrophobicContact CG2-CD2 3.88Å; F201-L349 HydrophobicContact CZ-CD2 4.26Å; F201-L349 HydrophobicContact CZ-CG 4.38Å; K345-L349 HydrophobicContact CD-CD1 4.31Å; K345-L349 HydrophobicContact CG-CD1 3.94Å; K345-L349 HydrophobicContact CG-CG 4.46Å; K345-L349 WeakPolarHBondContact O-CB 3.35Å; K345-L349 VanDerWaalsContact O-CG 3.25Å; K345-L349 WeakPolarHBondContact O-CG 3.41Å; K345-L349 PolarHBondContact O-N 2.95Å; D346-L349 PolarHBondContact O-N 3.25Å; T347-L349 PolarHBondContact O-N 3.09Å; L349-L351 PolarHBondContact O-N 2.92Å; L349-N352 PolarHBondContact O-N 2.78Å; L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 VanDerWaalsContact O-CG 3.24Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.37Å
350	Q	83.9	Confident	77.9	Confident	122 Å²	122	69.2 Å²	69.2	57%	0.57	36%	0.363	S	S	*	.	H	α-helix	trans	-62.7	-40.4	177.2	-75.3	176.6	5.8	0	0	112.6	D346 T347 I348 K354	D346-Q350 WeakPolarHBondContact O-CB 3.41Å; D346-Q350 VanDerWaalsContact O-CG 3.23Å; D346-Q350 WeakPolarHBondContact O-CG 3.46Å; D346-Q350 PolarHBondContact O-N 2.9Å; T347-Q350 PolarHBondContact O-N 3.44Å; I348-Q350 PolarHBondContact O-N 2.93Å; Q350-K354 WeakPolarHBondContact O-CG 3.35Å; Q350-K354 PolarHBondContact O-N 3.43Å
351	L	82	Confident	77	Confident	56 Å²	56	72.1 Å²	72.1	29%	0.293	38%	0.378	S	S	.	.	H	α-helix	trans	-67.4	-42.1	177.9	-69.2	173.6	0	0	0	111.7	Y325 T347 I348 L349 E355	Y325-L351 HydrophobicContact CE2-CD1 3.92Å; T347-L351 HydrophobicContact CG2-CD1 4.02Å; T347-L351 WeakPolarHBondContact O-CG 3.46Å; T347-L351 PolarHBondContact O-N 3.12Å; I348-L351 PolarHBondContact O-N 3.23Å; L349-L351 PolarHBondContact O-N 2.92Å; L351-E355 PolarHBondContact O-N 3.48Å
352	N	76.8	Confident	76.1	Confident	18 Å²	18	76 Å²	76	10%	0.096	40%	0.398	C	S	.	.	H	α-helix	trans	-69	-39.6	177.7	-79.3	-92.3	0	0	0	112.3	L40 T224 I348 L349 K354 E355 Y356	L40-N352 HydrophobicContact CD2-CB 4.45Å; T224-N352 WeakPolarHBondContact CG2-ND2 3.15Å; T224-N352 WeakPolarHBondContact CG2-OD1 3.29Å; I348-N352 PolarHBondContact O-N 3.25Å; I348-N352 PolarHBondContact O-ND2 3.01Å; L349-N352 PolarHBondContact O-N 2.78Å; N352-K354 VanDerWaalsContact C-N 3.3Å; N352-K354 PolarHBondContact O-N 2.73Å; N352-E355 WeakPolarHBondContact O-CB 3.4Å; N352-E355 PolarHBondContact O-N 3.46Å; N352-E355 VanDerWaalsContact O-N 3.15Å; N352-Y356 WeakPolarHBondContact O-CD2 3.23Å; N352-Y356 PolarHBondContact O-N 2.78Å
353	L	73.3	Confident	75.1	Confident	72 Å²	72	77.8 Å²	77.8	38%	0.377	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-36.5	178.2	-74.7	170.5	0	0	0	112.7	L349 E355 Y356 N357 L358 V359	L349-L353 WeakPolarHBondContact O-CB 3.47Å; L349-L353 VanDerWaalsContact O-CG 3.24Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.37Å; L353-E355 VanDerWaalsContact C-N 3.32Å; L353-Y356 PolarHBondContact O-N 2.97Å; L353-N357 PolarHBondContact O-N 3.47Å; L353-L358 HydrophobicContact CD2-CB 3.97Å; L353-L358 HydrophobicContact CD2-CD1 3.91Å; L353-L358 PolarHBondContact O-N 2.77Å; L353-V359 HydrophobicContact CB-CG2 4.15Å
354	K	65.1	Low	74	Confident	141 Å²	141	80.1 Å²	80.1	61%	0.613	40%	0.403	S	S	*	.	H	α-helix	trans	-62.2	-39.5	173.4	-74.3	176.1	-179	-177.8	0	111.8	Q350 N352 Y356 N357	Q350-K354 WeakPolarHBondContact O-CG 3.35Å; Q350-K354 PolarHBondContact O-N 3.43Å; N352-K354 VanDerWaalsContact C-N 3.3Å; N352-K354 PolarHBondContact O-N 2.73Å; K354-Y356 VanDerWaalsContact C-N 3.28Å; K354-Y356 PolarHBondContact O-N 2.96Å; K354-N357 PolarHBondContact O-N 3.5Å
355	E	63.4	Low	72.8	Confident	132 Å²	132	85.4 Å²	85.4	62%	0.617	43%	0.43	S	S	*	.	H	α-helix	trans	-65.5	-31.5	177.7	-164.1	177.9	175.8	0	0	112.4	L351 N352 L353	L351-E355 PolarHBondContact O-N 3.48Å; N352-E355 WeakPolarHBondContact O-CB 3.4Å; N352-E355 PolarHBondContact O-N 3.46Å; N352-E355 VanDerWaalsContact O-N 3.15Å; L353-E355 VanDerWaalsContact C-N 3.32Å
356	Y	61.4	Low	71.6	Confident	98 Å²	98	87.6 Å²	87.6	38%	0.384	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	6.1	178.7	-68.6	-66.5	0	0	0	115.2	R37 N352 L353 K354 L358	R37-Y356 HydrophobicContact CG-CE1 4.1Å; N352-Y356 WeakPolarHBondContact O-CD2 3.23Å; N352-Y356 PolarHBondContact O-N 2.78Å; L353-Y356 PolarHBondContact O-N 2.97Å; K354-Y356 VanDerWaalsContact C-N 3.28Å; K354-Y356 PolarHBondContact O-N 2.96Å; Y356-L358 PolarHBondContact O-N 2.72Å
357	N	54.8	Low	70.3	Confident	146 Å²	146	88.5 Å²	88.5	78%	0.781	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37.7	-174.6	-66.7	-32	0	0	0	113.4	L353 K354	L353-N357 PolarHBondContact O-N 3.47Å; K354-N357 PolarHBondContact O-N 3.5Å
358	L	48.8	Very low	68.8	Low	126 Å²	126	93.8 Å²	93.8	66%	0.66	47%	0.471	S	S	*	.			trans	-95.8	10.1	178.6	-70.2	171.7	0	0	0	113.3	L353 Y356	L353-L358 HydrophobicContact CD2-CB 3.97Å; L353-L358 HydrophobicContact CD2-CD1 3.91Å; L353-L358 PolarHBondContact O-N 2.77Å; Y356-L358 PolarHBondContact O-N 2.72Å
359	V	40.6	Very low	67	Low	169 Å²	169	102.3 Å²	102.3	100%	1.024	51%	0.514	S	S	*	.			trans	-124.6	0	174.3	-174.6	0	0	0	0	109.8	L353	L353-V359 HydrophobicContact CB-CG2 4.15Å

Retrieved 359 of 359 residues in 172.8 ms (Link to these results)

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