A0A068BER1_MOUSE Loading...

Antigen peptide transporter 1

ABC transporter associated with antigen processing. In complex with TAP2 mediates unidirectional translocation of peptide antigens from cytosol to endoplasmic reticulum (ER) for loading onto MHC class I (MHCI) molecules. Uses the chemical energy of ATP to export peptides against the concentration gradient. During the transport cycle alternates between 'inward-facing' state with peptide binding site facing the cytosol to 'outward-facing' state with peptide binding site facing the ER lumen. Peptide antigen binding to ATP-loaded TAP1-TAP2 induces a switch to hydrolysis-competent 'outward-facing' conformation ready for peptide loading onto nascent MHCI molecules. Subsequently ATP hydrolysis resets the transporter to the 'inward facing' state for a new cycle. As a component of the peptide loading complex (PLC), acts as a molecular scaffold essential for peptide-MHCI assembly and antigen presentation.

AlphaFold DB , UniProt , Accession A0A068BER1, Species MOUSE (Mus musculus, Mouse), Gene Tap1, Length 724 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.5	Very low	50	Low	152 Å²	152	87.7 Å²	87.7	75%	0.749	49%	0.489	S	S	*	.				0	-49.3	0	-140.1	176	167.3	0	0	112.4	A3 H4 W68	M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.27Å; M1-H4 PolarHBondContact O-N 3.26Å; M1-W68 HydrophobicContact CB-CE3 4.27Å; M1-W68 HydrophobicContact CB-CH2 3.34Å; M1-W68 HydrophobicContact CB-CZ2 4.27Å; M1-W68 HydrophobicContact CB-CZ3 3.35Å; M1-W68 HydrophobicContact CE-CD2 3.92Å; M1-W68 HydrophobicContact CE-CE3 4.32Å; M1-W68 HydrophobicContact CE-CH2 4.14Å; M1-W68 HydrophobicContact CE-CZ2 3.62Å; M1-W68 HydrophobicContact CE-CZ3 4.47Å; M1-W68 HydrophobicContact CG-CD2 4.33Å; M1-W68 HydrophobicContact CG-CE3 3.79Å; M1-W68 HydrophobicContact CG-CH2 3.33Å; M1-W68 HydrophobicContact CG-CZ2 3.84Å; M1-W68 HydrophobicContact CG-CZ3 3.32Å; M1-W68 WeakPolarHBondContact O-CZ3 3.1Å; M1-W68 HydrophobicContact SD-CD2 4.44Å; M1-W68 HydrophobicContact SD-CE3 4.42Å; M1-W68 HydrophobicContact SD-CH2 3.39Å; M1-W68 WeakPolarHBondContact SD-CH2 3.45Å; M1-W68 HydrophobicContact SD-CZ2 3.29Å; M1-W68 WeakPolarHBondContact SD-CZ2 3.45Å; M1-W68 HydrophobicContact SD-CZ3 3.99Å
2	A	37.8	Very low	51.2	Low	62 Å²	62	83.9 Å²	83.9	51%	0.512	47%	0.467	S	S	.	.	H	α-helix	trans	-64.1	-34.6	176.1	0	0	0	0	0	113.4	H4 V5 W6	A2-H4 VanDerWaalsContact C-N 3.32Å; A2-H4 PolarHBondContact O-N 3.43Å; A2-V5 PolarHBondContact O-N 3.01Å; A2-W6 VanDerWaalsContact O-CD1 3.28Å; A2-W6 PolarHBondContact O-N 3.49Å
3	A	40.8	Very low	51.8	Low	70 Å²	70	81.8 Å²	81.8	58%	0.579	45%	0.453	S	S	*	.	H	α-helix	trans	-60.4	-34.8	178.6	0	0	0	0	0	114	M1 W6 L7	M1-A3 VanDerWaalsContact C-N 3.33Å; M1-A3 PolarHBondContact O-N 3.27Å; A3-W6 PolarHBondContact O-N 3.09Å; A3-L7 WeakPolarHBondContact O-CB 3.23Å; A3-L7 PolarHBondContact O-N 3.49Å
4	H	46.8	Very low	52.8	Low	143 Å²	143	81.9 Å²	81.9	66%	0.662	45%	0.452	S	S	*	.	H	α-helix	trans	-72.5	-29	179.6	-65.6	-56.3	0	0	0	112.8	M1 A2 L7 A8	M1-H4 PolarHBondContact O-N 3.26Å; A2-H4 VanDerWaalsContact C-N 3.32Å; A2-H4 PolarHBondContact O-N 3.43Å; H4-L7 PolarHBondContact O-N 3.39Å; H4-A8 WeakPolarHBondContact O-CB 3.44Å; H4-A8 PolarHBondContact O-N 3.07Å
5	V	52.7	Low	53.6	Low	39 Å²	39	80.7 Å²	80.7	24%	0.236	45%	0.448	C	S	.	.	H	α-helix	trans	-69.4	-42.2	174.9	178.7	0	0	0	0	110.6	A2 L7 A9 W68 L72	A2-V5 PolarHBondContact O-N 3.01Å; V5-L7 VanDerWaalsContact C-N 3.34Å; V5-A9 VanDerWaalsContact O-CB 3.27Å; V5-A9 WeakPolarHBondContact O-CB 3.26Å; V5-A9 PolarHBondContact O-N 3.26Å; V5-W68 HydrophobicContact CG2-CB 4.1Å; V5-W68 HydrophobicContact CG2-CE3 3.74Å; V5-L72 HydrophobicContact CG1-CD2 4.41Å
6	W	49.7	Very low	54.2	Low	188 Å²	188	76.1 Å²	76.1	71%	0.712	42%	0.422	S	S	*	.	H	α-helix	trans	-66.5	-35.7	175.9	-77	99.1	0	0	0	112.4	A2 A3 A10	A2-W6 VanDerWaalsContact O-CD1 3.28Å; A2-W6 PolarHBondContact O-N 3.49Å; A3-W6 PolarHBondContact O-N 3.09Å; W6-A10 VanDerWaalsContact O-CB 3.3Å; W6-A10 WeakPolarHBondContact O-CB 3.29Å; W6-A10 PolarHBondContact O-N 3.43Å
7	L	52.3	Low	54.5	Low	113 Å²	113	80.5 Å²	80.5	59%	0.592	43%	0.431	S	S	*	.	H	α-helix	trans	-72.2	-39.9	178	-150.6	131.9	0	0	0	112.1	A3 H4 V5 A10 L11	A3-L7 WeakPolarHBondContact O-CB 3.23Å; A3-L7 PolarHBondContact O-N 3.49Å; H4-L7 PolarHBondContact O-N 3.39Å; V5-L7 VanDerWaalsContact C-N 3.34Å; L7-A10 PolarHBondContact O-N 3.43Å; L7-L11 HydrophobicContact CD2-CD1 4.18Å; L7-L11 PolarHBondContact O-N 2.92Å
8	A	56.4	Low	54.8	Low	37 Å²	37	81.9 Å²	81.9	31%	0.306	44%	0.438	S	S	.	.	H	α-helix	trans	-68.3	-39.1	173.5	0	0	0	0	0	112.4	H4 L11 L12	H4-A8 WeakPolarHBondContact O-CB 3.44Å; H4-A8 PolarHBondContact O-N 3.07Å; A8-L11 PolarHBondContact O-N 3.09Å; A8-L12 PolarHBondContact O-N 2.97Å
9	A	56.9	Low	55	Low	11 Å²	11	83.3 Å²	83.3	9%	0.091	44%	0.444	C	S	.	.	H	α-helix	trans	-60.7	-48.4	171.1	0	0	0	0	0	110.5	V5 L11 L12 L13 L72	V5-A9 VanDerWaalsContact O-CB 3.27Å; V5-A9 WeakPolarHBondContact O-CB 3.26Å; V5-A9 PolarHBondContact O-N 3.26Å; A9-L11 VanDerWaalsContact C-N 3.32Å; A9-L11 PolarHBondContact O-N 2.92Å; A9-L12 WeakPolarHBondContact O-CB 3.48Å; A9-L12 PolarHBondContact O-N 3.01Å; A9-L13 WeakPolarHBondContact O-CG 3.48Å; A9-L13 PolarHBondContact O-N 3.27Å; A9-L72 HydrophobicContact CB-CD2 3.92Å
10	A	55.5	Low	55.3	Low	51 Å²	51	80.1 Å²	80.1	42%	0.421	43%	0.427	S	S	.	.	H	α-helix	trans	-59.6	-38.5	177.9	0	0	0	0	0	113.1	W6 L7 L13 L14	W6-A10 VanDerWaalsContact O-CB 3.3Å; W6-A10 WeakPolarHBondContact O-CB 3.29Å; W6-A10 PolarHBondContact O-N 3.43Å; L7-A10 PolarHBondContact O-N 3.43Å; A10-L13 PolarHBondContact O-N 3.21Å; A10-L14 WeakPolarHBondContact O-CB 3.23Å; A10-L14 PolarHBondContact O-N 3.34Å
11	L	61.9	Low	55.5	Low	99 Å²	99	79.5 Å²	79.5	52%	0.518	42%	0.419	S	S	.	.	H	α-helix	trans	-66	-42.9	174.5	-101.1	153	0	0	0	112.8	L7 A8 A9 L13 L14 V15	L7-L11 HydrophobicContact CD2-CD1 4.18Å; L7-L11 PolarHBondContact O-N 2.92Å; A8-L11 PolarHBondContact O-N 3.09Å; A9-L11 VanDerWaalsContact C-N 3.32Å; A9-L11 PolarHBondContact O-N 2.92Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.25Å; L11-L14 WeakPolarHBondContact O-CB 3.28Å; L11-L14 PolarHBondContact O-N 3.12Å; L11-V15 WeakPolarHBondContact O-CG2 3.29Å; L11-V15 PolarHBondContact O-N 3.25Å
12	L	63.7	Low	56.5	Low	42 Å²	42	76.3 Å²	76.3	22%	0.22	41%	0.41	C	S	.	.	H	α-helix	trans	-61	-40.5	173.7	-96.8	152.8	0	0	0	111.9	A8 A9 L14 D16 L51 V55	A8-L12 PolarHBondContact O-N 2.97Å; A9-L12 WeakPolarHBondContact O-CB 3.48Å; A9-L12 PolarHBondContact O-N 3.01Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L12-D16 VanDerWaalsContact O-CB 3.29Å; L12-D16 WeakPolarHBondContact O-CB 3.45Å; L12-D16 PolarHBondContact O-N 2.87Å; L12-L51 HydrophobicContact CD2-CD2 3.87Å; L12-V55 HydrophobicContact CD1-CG2 3.76Å; L12-V55 HydrophobicContact CD2-CG2 4.09Å
13	L	59.9	Low	57.5	Low	56 Å²	56	79.3 Å²	79.3	29%	0.293	42%	0.415	S	S	.	.	H	α-helix	trans	-64.5	-37.6	174.9	-65.8	-178.8	0	0	0	112.2	A9 A10 L11 W17 L79 Y120	A9-L13 WeakPolarHBondContact O-CG 3.48Å; A9-L13 PolarHBondContact O-N 3.27Å; A10-L13 PolarHBondContact O-N 3.21Å; L11-L13 VanDerWaalsContact C-N 3.31Å; L11-L13 PolarHBondContact O-N 3.25Å; L13-W17 VanDerWaalsContact O-CB 3.24Å; L13-W17 WeakPolarHBondContact O-CB 3.44Å; L13-W17 PolarHBondContact O-N 2.82Å; L13-L79 HydrophobicContact CD2-CD1 3.62Å; L13-Y120 HydrophobicContact CD1-CE1 4.21Å; L13-Y120 HydrophobicContact CD2-CE1 3.36Å; L13-Y120 WeakPolarHBondContact CD2-OH 3.27Å; L13-Y120 HydrophobicContact CG-CE1 4.38Å
14	L	64.7	Low	58.6	Low	84 Å²	84	76.7 Å²	76.7	44%	0.44	39%	0.391	S	S	.	.	H	α-helix	trans	-69.4	-43	177.3	-118.4	156.9	0	0	0	112.5	A10 L11 L12 W17 L18	A10-L14 WeakPolarHBondContact O-CB 3.23Å; A10-L14 PolarHBondContact O-N 3.34Å; L11-L14 WeakPolarHBondContact O-CB 3.28Å; L11-L14 PolarHBondContact O-N 3.12Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L14-W17 HydrophobicContact CD2-CE3 4.2Å; L14-W17 PolarHBondContact O-N 3.41Å; L14-L18 HydrophobicContact CD2-CD1 3.42Å; L14-L18 VanDerWaalsContact CD2-CD1 3.42Å; L14-L18 HydrophobicContact CD2-CG 4.31Å; L14-L18 PolarHBondContact O-N 2.9Å
15	V	64.7	Low	59.1	Low	64 Å²	64	71.8 Å²	71.8	39%	0.388	37%	0.372	S	S	.	.	H	α-helix	trans	-65.6	-41.6	176.7	171.2	0	0	0	0	111	L11 W17 L19	L11-V15 WeakPolarHBondContact O-CG2 3.29Å; L11-V15 PolarHBondContact O-N 3.25Å; V15-W17 VanDerWaalsContact C-N 3.28Å; V15-W17 PolarHBondContact O-N 2.82Å; V15-L19 HydrophobicContact CG1-CD1 4.38Å; V15-L19 PolarHBondContact O-N 2.96Å; V15-L19 VanDerWaalsContact O-N 3.13Å
16	D	64.1	Low	59.4	Low	7 Å²	7	71.9 Å²	71.9	4%	0.037	38%	0.381	C	S	.	.	I	π-helix	trans	-63.8	-35	175.1	-170.9	45.4	0	0	0	112.4	L12 R21 R47 L51	L12-D16 VanDerWaalsContact O-CB 3.29Å; L12-D16 WeakPolarHBondContact O-CB 3.45Å; L12-D16 PolarHBondContact O-N 2.87Å; D16-R21 PolarHBondContact O-N 2.88Å; D16-R47 IonicContact OD1-CZ 3.77Å; D16-R47 IonicContact OD1-NE 3.27Å; D16-R47 PolarHBondContact OD1-NE 2.93Å; D16-R47 IonicContact OD1-NH2 2.7Å; D16-R47 PolarHBondContact OD1-NH2 2.81Å; D16-R47 IonicContact OD2-CZ 3.32Å; D16-R47 IonicContact OD2-NE 3.51Å; D16-R47 IonicContact OD2-NH2 3.96Å; D16-R47 PolarHBondContact OD2-NH2 2.82Å; D16-L51 HydrophobicContact CB-CD2 4.39Å
17	W	58.7	Low	60	Low	150 Å²	150	67.1 Å²	67.1	57%	0.568	37%	0.368	S	S	*	.	I	π-helix	trans	-74.1	-43.4	179.4	-175.2	56.7	0	0	0	113.8	L13 L14 V15	L13-W17 VanDerWaalsContact O-CB 3.24Å; L13-W17 WeakPolarHBondContact O-CB 3.44Å; L13-W17 PolarHBondContact O-N 2.82Å; L14-W17 HydrophobicContact CD2-CE3 4.2Å; L14-W17 PolarHBondContact O-N 3.41Å; V15-W17 VanDerWaalsContact C-N 3.28Å; V15-W17 PolarHBondContact O-N 2.82Å
18	L	59.4	Low	60.3	Low	107 Å²	107	64.3 Å²	64.3	56%	0.56	35%	0.351	S	S	*	.	I	π-helix	trans	-87.6	-37.2	-173.1	-80.9	163.3	0	0	0	114.5	L14 P22	L14-L18 HydrophobicContact CD2-CD1 3.42Å; L14-L18 VanDerWaalsContact CD2-CD1 3.42Å; L14-L18 HydrophobicContact CD2-CG 4.31Å; L14-L18 PolarHBondContact O-N 2.9Å; L18-P22 WeakPolarHBondContact O-CG 3.28Å
19	L	59.2	Low	60.3	Low	107 Å²	107	65.3 Å²	65.3	56%	0.56	36%	0.356	S	S	*	.	I	π-helix	trans	-108.8	-50.9	-167.2	-79.4	158.8	0	0	0	113.3	V15	V15-L19 HydrophobicContact CG1-CD1 4.38Å; V15-L19 PolarHBondContact O-N 2.96Å; V15-L19 VanDerWaalsContact O-N 3.13Å
20	L	62.2	Low	60.4	Low	20 Å²	20	72.1 Å²	72.1	11%	0.105	39%	0.39	C	S	.	.	I	π-helix	trans	-76.5	-33.3	-171.7	-75.3	160	0	0	0	112.6	L24 I50 L51	L20-L24 HydrophobicContact CB-CD1 4.14Å; L20-L24 HydrophobicContact CD2-CD1 3.51Å; L20-L24 HydrophobicContact CD2-CG 4.28Å; L20-L24 HydrophobicContact CG-CD1 4.46Å; L20-L24 WeakPolarHBondContact O-CB 3.43Å; L20-L24 PolarHBondContact O-N 3.08Å; L20-I50 HydrophobicContact CD1-CG2 4.26Å; L20-I50 HydrophobicContact CD2-CB 4.22Å; L20-I50 HydrophobicContact CD2-CD1 3.76Å; L20-I50 HydrophobicContact CD2-CG2 3.84Å; L20-L51 HydrophobicContact CD1-CD2 3.72Å; L20-L51 HydrophobicContact CD1-CG 3.99Å
21	R	59.6	Low	60.4	Low	68 Å²	68	75.6 Å²	75.6	26%	0.257	40%	0.401	S	S	.	.	H	α-helix	trans	-66.7	-45.3	-177.3	-171.7	-179.5	-176.6	-166.4	2.4	114.9	D16 P25 N110	D16-R21 PolarHBondContact O-N 2.88Å; R21-P25 WeakPolarHBondContact O-CD 3.38Å; R21-N110 PolarHBondContact NH2-O 2.84Å
22	P	59.6	Low	60.1	Low	84 Å²	84	72.8 Å²	72.8	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-83	-32	179	29.2	-33.7	0	0	0	114	L18	L18-P22 WeakPolarHBondContact O-CG 3.28Å
23	M	58.2	Low	59.6	Low	125 Å²	125	75.5 Å²	75.5	62%	0.616	41%	0.408	S	S	*	.	H	α-helix	trans	-83.4	-41.8	-171.4	-75	-151.5	138.1	0	0	114.6	G26 I27	M23-G26 PolarHBondContact O-N 2.8Å; M23-I27 HydrophobicContact CB-CD1 4.31Å; M23-I27 WeakPolarHBondContact O-CD1 3.45Å; M23-I27 VanDerWaalsContact O-CG1 3.3Å; M23-I27 WeakPolarHBondContact O-CG1 3.34Å; M23-I27 PolarHBondContact O-N 2.88Å
24	L	63.6	Low	59.3	Low	15 Å²	15	81.5 Å²	81.5	8%	0.079	43%	0.434	C	S	.	.	H	α-helix	trans	-62.9	-43.1	-173.8	-81.1	165	0	0	0	114.3	L20 G26 I27 F28 V43 R47 I50	L20-L24 HydrophobicContact CB-CD1 4.14Å; L20-L24 HydrophobicContact CD2-CD1 3.51Å; L20-L24 HydrophobicContact CD2-CG 4.28Å; L20-L24 HydrophobicContact CG-CD1 4.46Å; L20-L24 WeakPolarHBondContact O-CB 3.43Å; L20-L24 PolarHBondContact O-N 3.08Å; L24-G26 VanDerWaalsContact C-N 3.31Å; L24-G26 PolarHBondContact O-N 3.23Å; L24-I27 PolarHBondContact O-N 2.84Å; L24-F28 HydrophobicContact CD2-CD2 4.06Å; L24-F28 HydrophobicContact CD2-CE2 3.7Å; L24-F28 WeakPolarHBondContact O-CD2 3.26Å; L24-F28 PolarHBondContact O-N 3.01Å; L24-F28 VanDerWaalsContact O-N 3.15Å; L24-V43 HydrophobicContact CB-CG1 4.36Å; L24-R47 HydrophobicContact CD1-CB 4.29Å; L24-I50 HydrophobicContact CD1-CD1 4.34Å; L24-I50 HydrophobicContact CD2-CD1 4.22Å
25	P	59.1	Low	59.1	Low	40 Å²	40	81 Å²	81	26%	0.26	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-33.7	179.7	-19.5	32	0	0	0	113.1	R21 S29	R21-P25 WeakPolarHBondContact O-CD 3.38Å; P25-S29 WeakPolarHBondContact O-CB 3.32Å; P25-S29 PolarHBondContact O-N 2.68Å; P25-S29 VanDerWaalsContact O-N 3.11Å; P25-S29 PolarHBondContact O-OG 2.77Å
26	G	58.9	Low	58.9	Low	41 Å²	41	81.7 Å²	81.7	42%	0.423	44%	0.441	S	S	.	.	H	α-helix	trans	-75.2	-29.2	179.4	0	0	0	0	0	113.9	M23 L24 S29	M23-G26 PolarHBondContact O-N 2.8Å; L24-G26 VanDerWaalsContact C-N 3.31Å; L24-G26 PolarHBondContact O-N 3.23Å; G26-S29 PolarHBondContact O-OG 3.16Å
27	I	60.8	Low	58.6	Low	89 Å²	89	83.4 Å²	83.4	46%	0.456	45%	0.449	S	S	.	.	H	α-helix	trans	-77	-41.8	176.4	-65.3	165	0	0	0	110.5	M23 L24	M23-I27 HydrophobicContact CB-CD1 4.31Å; M23-I27 WeakPolarHBondContact O-CD1 3.45Å; M23-I27 VanDerWaalsContact O-CG1 3.3Å; M23-I27 WeakPolarHBondContact O-CG1 3.34Å; M23-I27 PolarHBondContact O-N 2.88Å; L24-I27 PolarHBondContact O-N 2.84Å
28	F	59.1	Low	58.7	Low	53 Å²	53	80.9 Å²	80.9	23%	0.232	45%	0.447	C	S	.	.	H	α-helix	trans	-84.4	-12.6	-177	-78.8	-78	0	0	0	114.4	L24 L30 V42 V43	L24-F28 HydrophobicContact CD2-CD2 4.06Å; L24-F28 HydrophobicContact CD2-CE2 3.7Å; L24-F28 WeakPolarHBondContact O-CD2 3.26Å; L24-F28 PolarHBondContact O-N 3.01Å; L24-F28 VanDerWaalsContact O-N 3.15Å; F28-L30 VanDerWaalsContact C-N 3.26Å; F28-L30 PolarHBondContact O-N 2.71Å; F28-V42 HydrophobicContact CD1-CG1 3.76Å; F28-V42 HydrophobicContact CE1-CG1 3.64Å; F28-V42 HydrophobicContact CG-CG1 4.45Å; F28-V42 HydrophobicContact CZ-CG1 4.26Å; F28-V43 HydrophobicContact CB-CG2 4.15Å; F28-V43 HydrophobicContact CD2-CG2 4.39Å; F28-V43 HydrophobicContact CG-CG2 4.44Å
29	S	57.4	Low	59	Low	58 Å²	58	78.5 Å²	78.5	41%	0.406	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.6	170.6	61.4	0	0	0	0	113.2	P25 G26	P25-S29 WeakPolarHBondContact O-CB 3.32Å; P25-S29 PolarHBondContact O-N 2.68Å; P25-S29 VanDerWaalsContact O-N 3.11Å; P25-S29 PolarHBondContact O-OG 2.77Å; G26-S29 PolarHBondContact O-OG 3.16Å
30	L	57.2	Low	59.2	Low	154 Å²	154	75.7 Å²	75.7	81%	0.806	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-21.5	177.1	-101.3	137.4	0	0	0	113.9	F28	F28-L30 VanDerWaalsContact C-N 3.26Å; F28-L30 PolarHBondContact O-N 2.71Å
31	L	56.7	Low	59.3	Low	124 Å²	124	79 Å²	79	65%	0.649	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-19.6	-168	-102.1	132.3	0	0	0	115.3
32	V	55.3	Low	59.7	Low	41 Å²	41	78 Å²	78	25%	0.248	43%	0.43	C	S	.	.			trans	-135.6	90.1	-173.4	-175.2	0	0	0	0	110.9	L38 R39	V32-L38 HydrophobicContact CG1-CD2 4.28Å; V32-R39 HydrophobicContact CB-CG 4.29Å; V32-R39 HydrophobicContact CG1-CG 4.31Å; V32-R39 PolarHBondContact O-NE 3.1Å; V32-R39 PolarHBondContact O-NH2 3.3Å
33	P	53.4	Low	60	Low	99 Å²	99	75.6 Å²	75.6	64%	0.643	41%	0.414	S	S	*	.			trans	-76.5	-23.4	-167.2	-17.9	31.6	0	0	0	116.6	R39	P33-R39 VanDerWaalsContact CA-NH2 3.34Å; P33-R39 PolarHBondContact O-NH2 3.42Å
34	E	53.9	Low	60.4	Low	181 Å²	181	69.9 Å²	69.9	85%	0.846	39%	0.387	S	S	*	.	S	Bend	trans	-114.6	-6	-155.8	-59.3	-161.7	156.1	0	0	118.7
35	V	60.9	Low	60.5	Low	75 Å²	75	73.3 Å²	73.3	46%	0.455	40%	0.404	S	S	.	.			trans	-139.7	116.7	178.9	-168.3	0	0	0	0	113.5	L38 R39	V35-L38 HydrophobicContact CB-CB 4.02Å; V35-L38 HydrophobicContact CG1-CB 4.16Å; V35-L38 PolarHBondContact O-N 2.7Å; V35-R39 PolarHBondContact O-N 2.61Å
36	P	59.4	Low	60.9	Low	77 Å²	77	72.5 Å²	72.5	50%	0.5	40%	0.4	S	S	.	.	H	α-helix	trans	-68.6	-39.7	-174.3	24.5	-32	0	0	0	114.1	L38 R39 V40	P36-L38 PolarHBondContact O-N 3.36Å; P36-R39 WeakPolarHBondContact O-CB 3.24Å; P36-R39 PolarHBondContact O-N 2.95Å; P36-V40 PolarHBondContact O-N 3.39Å
37	L	58.4	Low	61.4	Low	43 Å²	43	71.9 Å²	71.9	23%	0.225	39%	0.385	C	S	.	.	H	α-helix	trans	-60.7	-43.6	175.6	-101.5	176.3	0	0	0	112.8	R39 V40 W41 L88 E91	L37-R39 VanDerWaalsContact C-N 3.27Å; L37-R39 PolarHBondContact O-N 3.02Å; L37-V40 PolarHBondContact O-N 2.99Å; L37-V40 VanDerWaalsContact O-N 3.15Å; L37-W41 PolarHBondContact O-N 2.92Å; L37-W41 VanDerWaalsContact O-N 3.12Å; L37-L88 HydrophobicContact CD1-CD1 4.48Å; L37-L88 HydrophobicContact CD2-CB 4.48Å; L37-L88 HydrophobicContact CD2-CD1 3.85Å; L37-E91 WeakPolarHBondContact CD1-OE2 3.28Å; L37-E91 VanDerWaalsContact CG-OE2 3.23Å; L37-E91 WeakPolarHBondContact CG-OE2 3.23Å
38	L	60.8	Low	61.8	Low	97 Å²	97	73.7 Å²	73.7	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-64.7	-36.1	-177.7	-156.4	117.8	0	0	0	110.5	V32 V35 P36 W41 V42	V32-L38 HydrophobicContact CG1-CD2 4.28Å; V35-L38 HydrophobicContact CB-CB 4.02Å; V35-L38 HydrophobicContact CG1-CB 4.16Å; V35-L38 PolarHBondContact O-N 2.7Å; P36-L38 PolarHBondContact O-N 3.36Å; L38-W41 PolarHBondContact O-N 3.19Å; L38-V42 HydrophobicContact CD2-CG2 4.35Å; L38-V42 WeakPolarHBondContact O-CB 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.24Å; L38-V42 PolarHBondContact O-N 3.33Å
39	R	64.8	Low	62.1	Low	57 Å²	57	73.1 Å²	73.1	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-61.1	-43.6	172.8	-68.4	-176.6	-164.7	-176	4.7	112.2	V32 P33 V35 P36 L37 W41 V42 V43	V32-R39 HydrophobicContact CB-CG 4.29Å; V32-R39 HydrophobicContact CG1-CG 4.31Å; V32-R39 PolarHBondContact O-NE 3.1Å; V32-R39 PolarHBondContact O-NH2 3.3Å; P33-R39 VanDerWaalsContact CA-NH2 3.34Å; P33-R39 PolarHBondContact O-NH2 3.42Å; V35-R39 PolarHBondContact O-N 2.61Å; P36-R39 WeakPolarHBondContact O-CB 3.24Å; P36-R39 PolarHBondContact O-N 2.95Å; L37-R39 VanDerWaalsContact C-N 3.27Å; L37-R39 PolarHBondContact O-N 3.02Å; R39-W41 VanDerWaalsContact C-N 3.35Å; R39-W41 PolarHBondContact O-N 2.69Å; R39-V42 PolarHBondContact O-N 3.49Å; R39-V43 WeakPolarHBondContact O-CB 3.3Å; R39-V43 VanDerWaalsContact O-CG2 3.25Å; R39-V43 WeakPolarHBondContact O-CG2 3.45Å; R39-V43 PolarHBondContact O-N 3.35Å
40	V	63.9	Low	62.8	Low	48 Å²	48	74.1 Å²	74.1	29%	0.291	39%	0.391	S	S	.	.	H	α-helix	trans	-66.5	-38.6	-179.1	-177.8	0	0	0	0	111.3	P36 L37 G44 P84 A87	P36-V40 PolarHBondContact O-N 3.39Å; L37-V40 PolarHBondContact O-N 2.99Å; L37-V40 VanDerWaalsContact O-N 3.15Å; V40-G44 PolarHBondContact O-N 3.22Å; V40-P84 HydrophobicContact CG1-CB 4.33Å; V40-A87 HydrophobicContact CB-CB 4.45Å; V40-A87 HydrophobicContact CG1-CB 3.76Å; V40-A87 HydrophobicContact CG2-CB 4.46Å
41	W	63.7	Low	63.2	Low	91 Å²	91	67.3 Å²	67.3	35%	0.345	36%	0.355	S	S	.	.	H	α-helix	trans	-68	-42.2	174.7	-83.9	95.2	0	0	0	112.9	L37 L38 R39 V43 G44 L45 L81 P84 L88	L37-W41 PolarHBondContact O-N 2.92Å; L37-W41 VanDerWaalsContact O-N 3.12Å; L38-W41 PolarHBondContact O-N 3.19Å; R39-W41 VanDerWaalsContact C-N 3.35Å; R39-W41 PolarHBondContact O-N 2.69Å; W41-V43 VanDerWaalsContact C-N 3.34Å; W41-V43 PolarHBondContact O-N 2.85Å; W41-G44 PolarHBondContact O-N 3.12Å; W41-L45 HydrophobicContact CE3-CD1 4.42Å; W41-L45 VanDerWaalsContact O-CB 3.3Å; W41-L45 WeakPolarHBondContact O-CB 3.44Å; W41-L45 WeakPolarHBondContact O-CG 3.19Å; W41-L45 PolarHBondContact O-N 3.2Å; W41-L81 HydrophobicContact CZ3-CD2 4.2Å; W41-P84 HydrophobicContact CD2-CB 3.93Å; W41-P84 HydrophobicContact CE3-CB 4.17Å; W41-P84 HydrophobicContact CG-CB 4.34Å; W41-P84 HydrophobicContact CZ2-CB 4.33Å; W41-P84 HydrophobicContact CZ3-CB 4.48Å; W41-L88 HydrophobicContact CZ2-CD2 4.4Å
42	V	67.7	Low	63.6	Low	47 Å²	47	62.5 Å²	62.5	29%	0.285	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176.3	170.5	0	0	0	0	111.1	F28 L38 R39 S46	F28-V42 HydrophobicContact CD1-CG1 3.76Å; F28-V42 HydrophobicContact CE1-CG1 3.64Å; F28-V42 HydrophobicContact CG-CG1 4.45Å; F28-V42 HydrophobicContact CZ-CG1 4.26Å; L38-V42 HydrophobicContact CD2-CG2 4.35Å; L38-V42 WeakPolarHBondContact O-CB 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.24Å; L38-V42 PolarHBondContact O-N 3.33Å; R39-V42 PolarHBondContact O-N 3.49Å; V42-S46 VanDerWaalsContact O-CB 3.26Å; V42-S46 WeakPolarHBondContact O-CB 3.4Å; V42-S46 PolarHBondContact O-N 2.91Å; V42-S46 PolarHBondContact O-OG 3.29Å
43	V	67.4	Low	64.1	Low	33 Å²	33	66.3 Å²	66.3	20%	0.2	35%	0.354	C	S	.	.	H	α-helix	trans	-67.3	-40.2	174.6	173.1	0	0	0	0	111.4	L24 F28 R39 W41 S46 R47	L24-V43 HydrophobicContact CB-CG1 4.36Å; F28-V43 HydrophobicContact CB-CG2 4.15Å; F28-V43 HydrophobicContact CD2-CG2 4.39Å; F28-V43 HydrophobicContact CG-CG2 4.44Å; R39-V43 WeakPolarHBondContact O-CB 3.3Å; R39-V43 VanDerWaalsContact O-CG2 3.25Å; R39-V43 WeakPolarHBondContact O-CG2 3.45Å; R39-V43 PolarHBondContact O-N 3.35Å; W41-V43 VanDerWaalsContact C-N 3.34Å; W41-V43 PolarHBondContact O-N 2.85Å; V43-S46 WeakPolarHBondContact CA-OG 3.49Å; V43-S46 PolarHBondContact O-OG 2.85Å; V43-R47 WeakPolarHBondContact O-CB 3.3Å; V43-R47 PolarHBondContact O-N 2.83Å
44	G	65.9	Low	64.6	Low	5 Å²	5	63.3 Å²	63.3	5%	0.052	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-43.1	176.2	0	0	0	0	0	113.9	V40 W41 R47 W48	V40-G44 PolarHBondContact O-N 3.22Å; W41-G44 PolarHBondContact O-N 3.12Å; G44-R47 PolarHBondContact O-N 3.44Å; G44-W48 WeakPolarHBondContact O-CB 3.48Å; G44-W48 PolarHBondContact O-N 2.91Å
45	L	66.6	Low	65.1	Low	86 Å²	86	55 Å²	55	45%	0.45	30%	0.303	S	S	.	.	H	α-helix	trans	-70.5	-39.1	178.6	-75.5	164.9	0	0	0	112.3	W41 W48 A49	W41-L45 HydrophobicContact CE3-CD1 4.42Å; W41-L45 VanDerWaalsContact O-CB 3.3Å; W41-L45 WeakPolarHBondContact O-CB 3.44Å; W41-L45 WeakPolarHBondContact O-CG 3.19Å; W41-L45 PolarHBondContact O-N 3.2Å; L45-W48 PolarHBondContact O-N 3.17Å; L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 2.8Å
46	S	67	Low	65	Low	23 Å²	23	59.6 Å²	59.6	16%	0.161	31%	0.312	C	S	.	.	H	α-helix	trans	-66	-39.6	173.5	55.6	0	0	0	0	111.6	V42 V43 A49 I50	V42-S46 VanDerWaalsContact O-CB 3.26Å; V42-S46 WeakPolarHBondContact O-CB 3.4Å; V42-S46 PolarHBondContact O-N 2.91Å; V42-S46 PolarHBondContact O-OG 3.29Å; V43-S46 WeakPolarHBondContact CA-OG 3.49Å; V43-S46 PolarHBondContact O-OG 2.85Å; S46-A49 PolarHBondContact O-N 3.33Å; S46-I50 WeakPolarHBondContact O-CD1 3.27Å; S46-I50 VanDerWaalsContact O-CG1 3.23Å; S46-I50 WeakPolarHBondContact O-CG1 3.26Å; S46-I50 PolarHBondContact O-N 3.29Å
47	R	68.4	Low	64.9	Low	29 Å²	29	58 Å²	58	11%	0.109	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-41.2	173.7	-166	177.3	-172.3	-179.5	5.6	112.4	D16 L24 V43 G44 L51	D16-R47 IonicContact OD1-CZ 3.77Å; D16-R47 IonicContact OD1-NE 3.27Å; D16-R47 PolarHBondContact OD1-NE 2.93Å; D16-R47 IonicContact OD1-NH2 2.7Å; D16-R47 PolarHBondContact OD1-NH2 2.81Å; D16-R47 IonicContact OD2-CZ 3.32Å; D16-R47 IonicContact OD2-NE 3.51Å; D16-R47 IonicContact OD2-NH2 3.96Å; D16-R47 PolarHBondContact OD2-NH2 2.82Å; L24-R47 HydrophobicContact CD1-CB 4.29Å; V43-R47 WeakPolarHBondContact O-CB 3.3Å; V43-R47 PolarHBondContact O-N 2.83Å; G44-R47 PolarHBondContact O-N 3.44Å; R47-L51 HydrophobicContact CG-CD1 4.07Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.5Å; R47-L51 PolarHBondContact O-N 3.48Å
48	W	69.3	Low	64.7	Low	126 Å²	126	59.9 Å²	59.9	48%	0.477	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-44.8	172.2	-177.5	66.9	0	0	0	112	G44 L45 G52 S80	G44-W48 WeakPolarHBondContact O-CB 3.48Å; G44-W48 PolarHBondContact O-N 2.91Å; L45-W48 PolarHBondContact O-N 3.17Å; W48-G52 WeakPolarHBondContact O-CA 3.48Å; W48-G52 PolarHBondContact O-N 3.5Å; W48-S80 WeakPolarHBondContact CB-OG 3.49Å
49	A	66.9	Low	64.4	Low	42 Å²	42	56.9 Å²	56.9	35%	0.347	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-43.7	179.4	0	0	0	0	0	112.1	L45 S46 G52 L53	L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 2.8Å; S46-A49 PolarHBondContact O-N 3.33Å; A49-G52 PolarHBondContact O-N 3.23Å; A49-L53 VanDerWaalsContact O-CB 3.28Å; A49-L53 WeakPolarHBondContact O-CB 3.14Å; A49-L53 WeakPolarHBondContact O-CD1 3.21Å; A49-L53 WeakPolarHBondContact O-CG 3.45Å; A49-L53 PolarHBondContact O-N 2.93Å
50	I	70.7	Confident	63.6	Low	79 Å²	79	57.2 Å²	57.2	41%	0.405	33%	0.328	S	S	.	.	H	α-helix	trans	-69.2	-45.5	-178.8	-63.8	161.1	0	0	0	111.3	L20 L24 S46 L53 G54	L20-I50 HydrophobicContact CD1-CG2 4.26Å; L20-I50 HydrophobicContact CD2-CB 4.22Å; L20-I50 HydrophobicContact CD2-CD1 3.76Å; L20-I50 HydrophobicContact CD2-CG2 3.84Å; L24-I50 HydrophobicContact CD1-CD1 4.34Å; L24-I50 HydrophobicContact CD2-CD1 4.22Å; S46-I50 WeakPolarHBondContact O-CD1 3.27Å; S46-I50 VanDerWaalsContact O-CG1 3.23Å; S46-I50 WeakPolarHBondContact O-CG1 3.26Å; S46-I50 PolarHBondContact O-N 3.29Å; I50-L53 PolarHBondContact O-N 3.32Å; I50-G54 PolarHBondContact O-N 3.28Å
51	L	67	Low	63	Low	10 Å²	10	61 Å²	61	5%	0.052	35%	0.351	C	S	.	.	H	α-helix	trans	-68	-36.6	176.5	-68.9	170.9	0	0	0	111.7	L12 D16 L20 R47 G54 V55 V76	L12-L51 HydrophobicContact CD2-CD2 3.87Å; D16-L51 HydrophobicContact CB-CD2 4.39Å; L20-L51 HydrophobicContact CD1-CD2 3.72Å; L20-L51 HydrophobicContact CD1-CG 3.99Å; R47-L51 HydrophobicContact CG-CD1 4.07Å; R47-L51 WeakPolarHBondContact O-CB 3.25Å; R47-L51 WeakPolarHBondContact O-CG 3.5Å; R47-L51 PolarHBondContact O-N 3.48Å; L51-G54 PolarHBondContact O-N 2.86Å; L51-V55 WeakPolarHBondContact O-CG2 3.39Å; L51-V55 PolarHBondContact O-N 2.97Å; L51-V76 HydrophobicContact CB-CG1 3.52Å; L51-V76 HydrophobicContact CD1-CG1 4.47Å
52	G	63.6	Low	62.3	Low	23 Å²	23	59.7 Å²	59.7	24%	0.237	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-40.8	175.6	0	0	0	0	0	113.3	W48 A49 R56	W48-G52 WeakPolarHBondContact O-CA 3.48Å; W48-G52 PolarHBondContact O-N 3.5Å; A49-G52 PolarHBondContact O-N 3.23Å; G52-R56 WeakPolarHBondContact O-CB 3.41Å; G52-R56 WeakPolarHBondContact O-CG 3.39Å; G52-R56 PolarHBondContact O-N 3.48Å
53	L	66.6	Low	61	Low	121 Å²	121	62.4 Å²	62.4	63%	0.634	38%	0.381	S	S	*	.	H	α-helix	trans	-68.6	-38.4	173.4	-80	162.9	0	0	0	111.7	A49 I50 R56 G57	A49-L53 VanDerWaalsContact O-CB 3.28Å; A49-L53 WeakPolarHBondContact O-CB 3.14Å; A49-L53 WeakPolarHBondContact O-CD1 3.21Å; A49-L53 WeakPolarHBondContact O-CG 3.45Å; A49-L53 PolarHBondContact O-N 2.93Å; I50-L53 PolarHBondContact O-N 3.32Å; L53-R56 PolarHBondContact O-N 3.08Å; L53-G57 PolarHBondContact O-N 3.13Å
54	G	64.6	Low	60	Low	37 Å²	37	64.2 Å²	64.2	38%	0.381	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-45.7	173.9	0	0	0	0	0	112.6	I50 L51 G57 V58	I50-G54 PolarHBondContact O-N 3.28Å; L51-G54 PolarHBondContact O-N 2.86Å; G54-G57 PolarHBondContact O-N 3.36Å; G54-V58 WeakPolarHBondContact O-CG2 3.19Å; G54-V58 PolarHBondContact O-N 3.04Å
55	V	62.6	Low	58.9	Low	5 Å²	5	66 Å²	66	3%	0.03	42%	0.42	C	S	.	.	H	α-helix	trans	-64.2	-41.1	175.9	171.3	0	0	0	0	111.4	L12 L51 L59 V76	L12-V55 HydrophobicContact CD1-CG2 3.76Å; L12-V55 HydrophobicContact CD2-CG2 4.09Å; L51-V55 WeakPolarHBondContact O-CG2 3.39Å; L51-V55 PolarHBondContact O-N 2.97Å; V55-L59 HydrophobicContact CG1-CD1 3.8Å; V55-L59 VanDerWaalsContact O-CB 3.28Å; V55-L59 WeakPolarHBondContact O-CB 3.48Å; V55-L59 WeakPolarHBondContact O-CD1 3.45Å; V55-L59 VanDerWaalsContact O-CG 3.29Å; V55-L59 WeakPolarHBondContact O-CG 3.5Å; V55-L59 PolarHBondContact O-N 2.91Å; V55-V76 HydrophobicContact CG2-CG2 4Å
56	R	59.9	Low	58.1	Low	172 Å²	172	68.6 Å²	68.6	65%	0.649	43%	0.43	S	S	*	.	H	α-helix	trans	-67.9	-36	175.7	-79.2	-177.9	178.1	166.2	1	113.3	G52 L53 L59 G60	G52-R56 WeakPolarHBondContact O-CB 3.41Å; G52-R56 WeakPolarHBondContact O-CG 3.39Å; G52-R56 PolarHBondContact O-N 3.48Å; L53-R56 PolarHBondContact O-N 3.08Å; R56-L59 WeakPolarHBondContact O-CB 3.4Å; R56-L59 PolarHBondContact O-N 3.47Å; R56-G60 PolarHBondContact O-N 2.88Å
57	G	56.6	Low	57.3	Low	43 Å²	43	70.3 Å²	70.3	44%	0.443	45%	0.451	S	S	.	.	H	α-helix	trans	-66.7	-43.1	175.7	0	0	0	0	0	112.2	L53 G54 G60 V61	L53-G57 PolarHBondContact O-N 3.13Å; G54-G57 PolarHBondContact O-N 3.36Å; G57-G60 PolarHBondContact O-N 3.1Å; G57-V61 WeakPolarHBondContact O-CG2 3.49Å; G57-V61 PolarHBondContact O-N 2.93Å
58	V	55.6	Low	56.7	Low	84 Å²	84	74.5 Å²	74.5	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-66.7	-39.9	174.1	175.1	0	0	0	0	111.3	G54 G60 V61 T62 L69	G54-V58 WeakPolarHBondContact O-CG2 3.19Å; G54-V58 PolarHBondContact O-N 3.04Å; V58-G60 VanDerWaalsContact C-N 3.26Å; V58-G60 PolarHBondContact O-N 2.99Å; V58-V61 PolarHBondContact O-N 2.8Å; V58-T62 PolarHBondContact O-N 2.98Å; V58-T62 PolarHBondContact O-OG1 3.2Å; V58-L69 HydrophobicContact CG1-CD2 4.2Å
59	L	53	Low	55.8	Low	33 Å²	33	70 Å²	70	17%	0.173	45%	0.452	C	S	.	.	H	α-helix	trans	-58.2	-35.5	171.9	-88.2	159.1	0	0	0	112.8	V55 R56 L69	V55-L59 HydrophobicContact CG1-CD1 3.8Å; V55-L59 VanDerWaalsContact O-CB 3.28Å; V55-L59 WeakPolarHBondContact O-CB 3.48Å; V55-L59 WeakPolarHBondContact O-CD1 3.45Å; V55-L59 VanDerWaalsContact O-CG 3.29Å; V55-L59 WeakPolarHBondContact O-CG 3.5Å; V55-L59 PolarHBondContact O-N 2.91Å; R56-L59 WeakPolarHBondContact O-CB 3.4Å; R56-L59 PolarHBondContact O-N 3.47Å; L59-L69 HydrophobicContact CD1-CB 4.38Å; L59-L69 HydrophobicContact CD2-CB 3.43Å; L59-L69 VanDerWaalsContact CD2-CB 3.43Å; L59-L69 HydrophobicContact CD2-CD2 4.25Å; L59-L69 HydrophobicContact CD2-CG 4.27Å; L59-L69 HydrophobicContact CG-CB 3.87Å; L59-L69 HydrophobicContact CG-CD2 3.89Å; L59-L69 HydrophobicContact CG-CG 4.43Å
60	G	48.7	Very low	55.1	Low	64 Å²	64	70.2 Å²	70.2	66%	0.66	45%	0.454	S	S	*	.	H	α-helix	trans	-73.4	-27.3	179.5	0	0	0	0	0	114.4	R56 G57 V58	R56-G60 PolarHBondContact O-N 2.88Å; G57-G60 PolarHBondContact O-N 3.1Å; V58-G60 VanDerWaalsContact C-N 3.26Å; V58-G60 PolarHBondContact O-N 2.99Å
61	V	51.3	Low	54.3	Low	128 Å²	128	68.1 Å²	68.1	78%	0.776	45%	0.448	S	S	*	.	H	α-helix	trans	-84.9	-27.7	-179.9	178.9	0	0	0	0	111.8	G57 V58 A63	G57-V61 WeakPolarHBondContact O-CG2 3.49Å; G57-V61 PolarHBondContact O-N 2.93Å; V58-V61 PolarHBondContact O-N 2.8Å; V61-A63 PolarHBondContact O-N 3.42Å
62	T	48	Very low	53.7	Low	64 Å²	64	68.1 Å²	68.1	39%	0.393	45%	0.448	S	S	.	.			trans	-100.4	80.5	177.4	60	0	0	0	0	111.7	V58 G64	V58-T62 PolarHBondContact O-N 2.98Å; V58-T62 PolarHBondContact O-OG1 3.2Å; T62-G64 VanDerWaalsContact C-N 3.32Å; T62-G64 PolarHBondContact O-N 3.18Å
63	A	41.1	Very low	53.5	Low	104 Å²	104	71.2 Å²	71.2	86%	0.86	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	86.1	173.2	0	0	0	0	0	110.8	V61	V61-A63 PolarHBondContact O-N 3.42Å
64	G	45.9	Very low	53	Low	71 Å²	71	67.5 Å²	67.5	73%	0.732	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	161.1	-13.7	175.2	0	0	0	0	0	116.7	T62	T62-G64 VanDerWaalsContact C-N 3.32Å; T62-G64 PolarHBondContact O-N 3.18Å
65	A	44.2	Very low	52.6	Low	41 Å²	41	67.6 Å²	67.6	34%	0.339	43%	0.431	S	S	.	.			trans	-111.3	45.5	-171.1	0	0	0	0	0	114.5	G67 L69	A65-G67 PolarHBondContact O-N 3.46Å; A65-L69 HydrophobicContact CB-CD1 4.09Å
66	H	50	Low	52.5	Low	141 Å²	141	67.7 Å²	67.7	65%	0.653	43%	0.432	S	S	*	.	H	α-helix	trans	-67.6	-30	-171.5	-78.6	36.3	0	0	0	114.7
67	G	49.5	Very low	52.5	Low	59 Å²	59	60.9 Å²	60.9	61%	0.608	41%	0.412	S	S	*	.	H	α-helix	trans	-77.6	-31	-171.9	0	0	0	0	0	115.4	A65	A65-G67 PolarHBondContact O-N 3.46Å
68	W	55.3	Low	52.6	Low	117 Å²	117	60.3 Å²	60.3	44%	0.443	40%	0.404	S	S	.	.	H	α-helix	trans	-104.3	-28.9	-165.2	-60	27.6	0	0	0	111.9	M1 V5 A70 A71	M1-W68 HydrophobicContact CB-CE3 4.27Å; M1-W68 HydrophobicContact CB-CH2 3.34Å; M1-W68 HydrophobicContact CB-CZ2 4.27Å; M1-W68 HydrophobicContact CB-CZ3 3.35Å; M1-W68 HydrophobicContact CE-CD2 3.92Å; M1-W68 HydrophobicContact CE-CE3 4.32Å; M1-W68 HydrophobicContact CE-CH2 4.14Å; M1-W68 HydrophobicContact CE-CZ2 3.62Å; M1-W68 HydrophobicContact CE-CZ3 4.47Å; M1-W68 HydrophobicContact CG-CD2 4.33Å; M1-W68 HydrophobicContact CG-CE3 3.79Å; M1-W68 HydrophobicContact CG-CH2 3.33Å; M1-W68 HydrophobicContact CG-CZ2 3.84Å; M1-W68 HydrophobicContact CG-CZ3 3.32Å; M1-W68 WeakPolarHBondContact O-CZ3 3.1Å; M1-W68 HydrophobicContact SD-CD2 4.44Å; M1-W68 HydrophobicContact SD-CE3 4.42Å; M1-W68 HydrophobicContact SD-CH2 3.39Å; M1-W68 WeakPolarHBondContact SD-CH2 3.45Å; M1-W68 HydrophobicContact SD-CZ2 3.29Å; M1-W68 WeakPolarHBondContact SD-CZ2 3.45Å; M1-W68 HydrophobicContact SD-CZ3 3.99Å; V5-W68 HydrophobicContact CG2-CB 4.1Å; V5-W68 HydrophobicContact CG2-CE3 3.74Å; W68-A70 VanDerWaalsContact C-N 3.35Å; W68-A71 VanDerWaalsContact O-CB 3.31Å; W68-A71 WeakPolarHBondContact O-CB 3.08Å; W68-A71 PolarHBondContact O-N 2.95Å
69	L	49.8	Very low	52.7	Low	31 Å²	31	57.4 Å²	57.4	16%	0.162	39%	0.385	C	S	.	.	H	α-helix	trans	-73.3	-24.9	170.9	-91.8	111.1	0	0	0	112.8	V58 L59 A65 A71 L72	V58-L69 HydrophobicContact CG1-CD2 4.2Å; L59-L69 HydrophobicContact CD1-CB 4.38Å; L59-L69 HydrophobicContact CD2-CB 3.43Å; L59-L69 VanDerWaalsContact CD2-CB 3.43Å; L59-L69 HydrophobicContact CD2-CD2 4.25Å; L59-L69 HydrophobicContact CD2-CG 4.27Å; L59-L69 HydrophobicContact CG-CB 3.87Å; L59-L69 HydrophobicContact CG-CD2 3.89Å; L59-L69 HydrophobicContact CG-CG 4.43Å; A65-L69 HydrophobicContact CB-CD1 4.09Å; L69-A71 PolarHBondContact O-N 3.04Å; L69-L72 HydrophobicContact CG-CD1 4.45Å; L69-L72 WeakPolarHBondContact O-CB 3.36Å; L69-L72 PolarHBondContact O-N 3.32Å; L69-L72 VanDerWaalsContact O-N 3.12Å
70	A	53.5	Low	52.9	Low	47 Å²	47	55.9 Å²	55.9	39%	0.388	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-61.6	-27.6	169.6	0	0	0	0	0	112.6	W68 L72 Q73	W68-A70 VanDerWaalsContact C-N 3.35Å; A70-L72 PolarHBondContact O-N 3.18Å; A70-Q73 PolarHBondContact O-N 3.43Å
71	A	52.9	Low	53.3	Low	35 Å²	35	56.3 Å²	56.3	29%	0.289	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-68.7	-16	175.7	0	0	0	0	0	113.7	W68 L69 P74	W68-A71 VanDerWaalsContact O-CB 3.31Å; W68-A71 WeakPolarHBondContact O-CB 3.08Å; W68-A71 PolarHBondContact O-N 2.95Å; L69-A71 PolarHBondContact O-N 3.04Å; A71-P74 WeakPolarHBondContact O-CD 3.09Å; A71-P74 WeakPolarHBondContact O-CG 3.45Å
72	L	55	Low	53.6	Low	10 Å²	10	51.7 Å²	51.7	5%	0.052	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-88.8	-19.3	-179.9	-69.2	165.8	0	0	0	113.4	V5 A9 L69 A70 L75 V76	V5-L72 HydrophobicContact CG1-CD2 4.41Å; A9-L72 HydrophobicContact CB-CD2 3.92Å; L69-L72 HydrophobicContact CG-CD1 4.45Å; L69-L72 WeakPolarHBondContact O-CB 3.36Å; L69-L72 PolarHBondContact O-N 3.32Å; L69-L72 VanDerWaalsContact O-N 3.12Å; A70-L72 PolarHBondContact O-N 3.18Å; L72-L75 WeakPolarHBondContact O-CB 3.24Å; L72-L75 PolarHBondContact O-N 3.18Å; L72-L75 VanDerWaalsContact O-N 3.17Å; L72-V76 PolarHBondContact O-N 3.45Å
73	Q	59.3	Low	54	Low	88 Å²	88	51.9 Å²	51.9	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-56.9	-44.2	176.2	-71.6	-175.9	-34.6	0	0	114.8	A70 L75 V76 A77	A70-Q73 PolarHBondContact O-N 3.43Å; Q73-L75 VanDerWaalsContact C-N 3.29Å; Q73-L75 PolarHBondContact O-N 3.01Å; Q73-V76 PolarHBondContact O-N 2.93Å; Q73-A77 PolarHBondContact O-N 2.72Å
74	P	56.6	Low	54.7	Low	43 Å²	43	47 Å²	47	28%	0.279	30%	0.297	S	S	.	.	H	α-helix	trans	-68.3	-28.5	176.3	24.1	-33.1	0	0	0	112.7	A71 A77 A78	A71-P74 WeakPolarHBondContact O-CD 3.09Å; A71-P74 WeakPolarHBondContact O-CG 3.45Å; P74-A77 PolarHBondContact O-N 3.03Å; P74-A78 VanDerWaalsContact O-CB 3.28Å; P74-A78 WeakPolarHBondContact O-CB 3.31Å; P74-A78 PolarHBondContact O-N 3.19Å
75	L	56.2	Low	55.2	Low	39 Å²	39	45.2 Å²	45.2	20%	0.204	28%	0.278	C	S	.	.	H	α-helix	trans	-70	-39.6	175.7	-165.2	143.7	0	0	0	110.7	L72 Q73 A78 L79	L72-L75 WeakPolarHBondContact O-CB 3.24Å; L72-L75 PolarHBondContact O-N 3.18Å; L72-L75 VanDerWaalsContact O-N 3.17Å; Q73-L75 VanDerWaalsContact C-N 3.29Å; Q73-L75 PolarHBondContact O-N 3.01Å; L75-A78 PolarHBondContact O-N 3.43Å; L75-L79 HydrophobicContact CD2-CD1 3.56Å; L75-L79 HydrophobicContact CD2-CG 4.36Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 WeakPolarHBondContact O-CG 3.5Å; L75-L79 PolarHBondContact O-N 2.84Å
76	V	60.2	Low	55.8	Low	8 Å²	8	47.1 Å²	47.1	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-43.5	171.8	172.1	0	0	0	0	111.9	L51 V55 L72 Q73 L79 S80	L51-V76 HydrophobicContact CB-CG1 3.52Å; L51-V76 HydrophobicContact CD1-CG1 4.47Å; V55-V76 HydrophobicContact CG2-CG2 4Å; L72-V76 PolarHBondContact O-N 3.45Å; Q73-V76 PolarHBondContact O-N 2.93Å; V76-L79 PolarHBondContact O-N 2.94Å; V76-S80 WeakPolarHBondContact O-CB 3.33Å; V76-S80 PolarHBondContact O-N 2.84Å; V76-S80 PolarHBondContact O-OG 3.2Å
77	A	59.4	Low	55.9	Low	28 Å²	28	41.4 Å²	41.4	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-65.5	-40.8	177.1	0	0	0	0	0	112.6	Q73 P74 S80 L81	Q73-A77 PolarHBondContact O-N 2.72Å; P74-A77 PolarHBondContact O-N 3.03Å; A77-S80 PolarHBondContact O-OG 2.98Å; A77-S80 VanDerWaalsContact O-OG 3.13Å; A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.46Å; A77-L81 PolarHBondContact O-N 3.07Å
78	A	58.2	Low	55.9	Low	32 Å²	32	41.6 Å²	41.6	26%	0.264	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-42.6	176.5	0	0	0	0	0	111.7	P74 L75 A82 A123	P74-A78 VanDerWaalsContact O-CB 3.28Å; P74-A78 WeakPolarHBondContact O-CB 3.31Å; P74-A78 PolarHBondContact O-N 3.19Å; L75-A78 PolarHBondContact O-N 3.43Å; A78-A82 WeakPolarHBondContact O-CB 3.37Å; A78-A82 PolarHBondContact O-N 3.45Å; A78-A82 VanDerWaalsContact O-N 3.13Å; A78-A123 HydrophobicContact CB-CB 4.31Å
79	L	58.7	Low	55.6	Low	22 Å²	22	40.7 Å²	40.7	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-69.4	-35.3	179.1	-71.4	174.5	0	0	0	113.4	L13 L75 V76 Y120	L13-L79 HydrophobicContact CD2-CD1 3.62Å; L75-L79 HydrophobicContact CD2-CD1 3.56Å; L75-L79 HydrophobicContact CD2-CG 4.36Å; L75-L79 WeakPolarHBondContact O-CB 3.49Å; L75-L79 WeakPolarHBondContact O-CG 3.5Å; L75-L79 PolarHBondContact O-N 2.84Å; V76-L79 PolarHBondContact O-N 2.94Å; L79-Y120 HydrophobicContact CD1-CE1 4.37Å; L79-Y120 HydrophobicContact CD2-CD1 4.15Å; L79-Y120 HydrophobicContact CD2-CD2 4.08Å; L79-Y120 HydrophobicContact CD2-CE1 3.57Å; L79-Y120 HydrophobicContact CD2-CE2 3.49Å; L79-Y120 VanDerWaalsContact CD2-CE2 3.49Å; L79-Y120 HydrophobicContact CD2-CG 4.38Å; L79-Y120 WeakPolarHBondContact CD2-OH 3.42Å
80	S	56.8	Low	55.6	Low	1 Å²	1	44.7 Å²	44.7	1%	0.007	26%	0.258	C	S	.	.	H	α-helix	trans	-81.3	-30.6	-178.1	62.6	0	0	0	0	113.9	W48 V76 A77 P84	W48-S80 WeakPolarHBondContact CB-OG 3.49Å; V76-S80 WeakPolarHBondContact O-CB 3.33Å; V76-S80 PolarHBondContact O-N 2.84Å; V76-S80 PolarHBondContact O-OG 3.2Å; A77-S80 PolarHBondContact O-OG 2.98Å; A77-S80 VanDerWaalsContact O-OG 3.13Å; S80-P84 VanDerWaalsContact O-CD 3.23Å; S80-P84 WeakPolarHBondContact O-CD 3.46Å
81	L	57.4	Low	55.4	Low	74 Å²	74	46.1 Å²	46.1	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-97.6	-15.6	-176	-69.2	162.9	0	0	0	113.7	W41 A77 L83 P84 G85	W41-L81 HydrophobicContact CZ3-CD2 4.2Å; A77-L81 VanDerWaalsContact O-CB 3.31Å; A77-L81 WeakPolarHBondContact O-CB 3.46Å; A77-L81 PolarHBondContact O-N 3.07Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 2.85Å; L81-P84 WeakPolarHBondContact O-CD 3.32Å; L81-G85 PolarHBondContact O-N 2.89Å
82	A	58.6	Low	55.1	Low	30 Å²	30	49.6 Å²	49.6	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-36.6	176.5	0	0	0	0	0	113.1	A78 L86	A78-A82 WeakPolarHBondContact O-CB 3.37Å; A78-A82 PolarHBondContact O-N 3.45Å; A78-A82 VanDerWaalsContact O-N 3.13Å; A82-L86 WeakPolarHBondContact O-CB 3.46Å; A82-L86 WeakPolarHBondContact O-CD1 3.26Å; A82-L86 WeakPolarHBondContact O-CG 3.27Å; A82-L86 PolarHBondContact O-N 3.03Å
83	L	54.4	Low	54.5	Low	69 Å²	69	52.9 Å²	52.9	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-71.3	-50.6	-179.4	-120	104.4	0	0	0	113.2	L81 G85 L86 A87	L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 2.85Å; L83-G85 VanDerWaalsContact C-N 3.29Å; L83-G85 PolarHBondContact O-N 3.1Å; L83-L86 PolarHBondContact O-N 3.34Å; L83-A87 PolarHBondContact O-N 3.37Å
84	P	57.6	Low	53.9	Low	2 Å²	2	50.1 Å²	50.1	1%	0.013	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-37.8	172.7	-19.1	29.5	0	0	0	112.2	V40 W41 S80 L81 A87 L88	V40-P84 HydrophobicContact CG1-CB 4.33Å; W41-P84 HydrophobicContact CD2-CB 3.93Å; W41-P84 HydrophobicContact CE3-CB 4.17Å; W41-P84 HydrophobicContact CG-CB 4.34Å; W41-P84 HydrophobicContact CZ2-CB 4.33Å; W41-P84 HydrophobicContact CZ3-CB 4.48Å; S80-P84 VanDerWaalsContact O-CD 3.23Å; S80-P84 WeakPolarHBondContact O-CD 3.46Å; L81-P84 WeakPolarHBondContact O-CD 3.32Å; P84-A87 PolarHBondContact O-N 2.91Å; P84-L88 VanDerWaalsContact O-CB 3.3Å; P84-L88 WeakPolarHBondContact O-CB 3.43Å; P84-L88 PolarHBondContact O-N 3.37Å
85	G	56.1	Low	53.1	Low	32 Å²	32	59 Å²	59	33%	0.33	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-45.4	174.9	0	0	0	0	0	112.5	L81 L83 F89	L81-G85 PolarHBondContact O-N 2.89Å; L83-G85 VanDerWaalsContact C-N 3.29Å; L83-G85 PolarHBondContact O-N 3.1Å; G85-F89 WeakPolarHBondContact O-CB 3.39Å; G85-F89 PolarHBondContact O-N 2.75Å
86	L	56.3	Low	52.6	Low	82 Å²	82	60.4 Å²	60.4	43%	0.429	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-32.8	176.7	-80.7	163.9	0	0	0	113.4	A82 L83 F89 R90	A82-L86 WeakPolarHBondContact O-CB 3.46Å; A82-L86 WeakPolarHBondContact O-CD1 3.26Å; A82-L86 WeakPolarHBondContact O-CG 3.27Å; A82-L86 PolarHBondContact O-N 3.03Å; L83-L86 PolarHBondContact O-N 3.34Å; L86-F89 WeakPolarHBondContact O-CB 3.37Å; L86-R90 PolarHBondContact O-N 2.86Å
87	A	53	Low	51.9	Low	21 Å²	21	66 Å²	66	17%	0.174	38%	0.377	C	S	.	.	H	α-helix	trans	-72.7	-43.2	176.7	0	0	0	0	0	112	V40 L83 P84 F89 R90 E91	V40-A87 HydrophobicContact CB-CB 4.45Å; V40-A87 HydrophobicContact CG1-CB 3.76Å; V40-A87 HydrophobicContact CG2-CB 4.46Å; L83-A87 PolarHBondContact O-N 3.37Å; P84-A87 PolarHBondContact O-N 2.91Å; A87-F89 VanDerWaalsContact C-N 3.29Å; A87-F89 PolarHBondContact O-N 3.3Å; A87-R90 PolarHBondContact O-N 3.18Å; A87-E91 PolarHBondContact O-N 2.84Å
88	L	49.1	Very low	50.7	Low	63 Å²	63	70.1 Å²	70.1	33%	0.33	40%	0.395	S	S	.	.	H	α-helix	trans	-61	-40.9	170.8	-167.9	88.5	0	0	0	110.8	L37 W41 P84 R90 E91 L92	L37-L88 HydrophobicContact CD1-CD1 4.48Å; L37-L88 HydrophobicContact CD2-CB 4.48Å; L37-L88 HydrophobicContact CD2-CD1 3.85Å; W41-L88 HydrophobicContact CZ2-CD2 4.4Å; P84-L88 VanDerWaalsContact O-CB 3.3Å; P84-L88 WeakPolarHBondContact O-CB 3.43Å; P84-L88 PolarHBondContact O-N 3.37Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.38Å; L88-E91 PolarHBondContact O-N 3.35Å; L88-L92 HydrophobicContact CD2-CD1 4.15Å; L88-L92 HydrophobicContact CG-CD1 3.98Å; L88-L92 WeakPolarHBondContact O-CB 3.47Å; L88-L92 WeakPolarHBondContact O-CD1 3.41Å; L88-L92 WeakPolarHBondContact O-CG 3.35Å; L88-L92 PolarHBondContact O-N 2.88Å
89	F	47.8	Very low	49.7	Very low	98 Å²	98	79.9 Å²	79.9	43%	0.43	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-38.5	176.7	-172.6	-106	0	0	0	112.7	G85 L86 A87 A93 P301	G85-F89 WeakPolarHBondContact O-CB 3.39Å; G85-F89 PolarHBondContact O-N 2.75Å; L86-F89 WeakPolarHBondContact O-CB 3.37Å; A87-F89 VanDerWaalsContact C-N 3.29Å; A87-F89 PolarHBondContact O-N 3.3Å; F89-A93 WeakPolarHBondContact O-CB 3.41Å; F89-A93 PolarHBondContact O-N 2.78Å; F89-P301 HydrophobicContact CE2-CB 3.57Å; F89-P301 HydrophobicContact CE2-CG 3.77Å; F89-P301 HydrophobicContact CZ-CB 3.97Å; F89-P301 HydrophobicContact CZ-CG 3.92Å
90	R	49.8	Very low	48.7	Very low	114 Å²	114	88.5 Å²	88.5	43%	0.43	47%	0.465	S	S	.	.	H	α-helix	trans	-77.1	-36.8	178.5	-169.4	175.4	173.7	178.4	-3.9	112.7	L86 A87 L88 A93 A94	L86-R90 PolarHBondContact O-N 2.86Å; A87-R90 PolarHBondContact O-N 3.18Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.38Å; R90-A93 PolarHBondContact O-N 3.19Å; R90-A94 VanDerWaalsContact O-CB 3.23Å; R90-A94 WeakPolarHBondContact O-CB 3.37Å; R90-A94 PolarHBondContact O-N 3.06Å
91	E	49.3	Very low	47.9	Very low	77 Å²	77	91.8 Å²	91.8	36%	0.36	50%	0.498	S	S	.	.	H	α-helix	trans	-65.2	-40.1	172.2	-94.7	-157.2	-164.7	0	0	111.9	L37 A87 L88 A93 A94	L37-E91 WeakPolarHBondContact CD1-OE2 3.28Å; L37-E91 VanDerWaalsContact CG-OE2 3.23Å; L37-E91 WeakPolarHBondContact CG-OE2 3.23Å; A87-E91 PolarHBondContact O-N 2.84Å; L88-E91 PolarHBondContact O-N 3.35Å; E91-A93 VanDerWaalsContact C-N 3.33Å; E91-A93 PolarHBondContact O-N 3.36Å; E91-A94 PolarHBondContact O-N 2.9Å
92	L	47.5	Very low	47.2	Very low	108 Å²	108	92.8 Å²	92.8	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-66.1	-34.4	172.9	-76.1	163.1	0	0	0	112.4	L88	L88-L92 HydrophobicContact CD2-CD1 4.15Å; L88-L92 HydrophobicContact CG-CD1 3.98Å; L88-L92 WeakPolarHBondContact O-CB 3.47Å; L88-L92 WeakPolarHBondContact O-CD1 3.41Å; L88-L92 WeakPolarHBondContact O-CG 3.35Å; L88-L92 PolarHBondContact O-N 2.88Å
93	A	42.7	Very low	46.5	Very low	79 Å²	79	96 Å²	96	65%	0.653	52%	0.524	S	S	*	.	H	α-helix	trans	-76.8	-20.1	175.6	0	0	0	0	0	114	F89 R90 E91	F89-A93 WeakPolarHBondContact O-CB 3.41Å; F89-A93 PolarHBondContact O-N 2.78Å; R90-A93 PolarHBondContact O-N 3.19Å; E91-A93 VanDerWaalsContact C-N 3.33Å; E91-A93 PolarHBondContact O-N 3.36Å
94	A	45.1	Very low	45.9	Very low	31 Å²	31	95.9 Å²	95.9	26%	0.256	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	7	-179.1	0	0	0	0	0	113.8	R90 E91 G96 T97 L98	R90-A94 VanDerWaalsContact O-CB 3.23Å; R90-A94 WeakPolarHBondContact O-CB 3.37Å; R90-A94 PolarHBondContact O-N 3.06Å; E91-A94 PolarHBondContact O-N 2.9Å; A94-G96 PolarHBondContact O-N 2.69Å; A94-T97 PolarHBondContact O-N 2.91Å; A94-L98 HydrophobicContact CB-CD1 4.19Å
95	W	41.2	Very low	45.4	Very low	230 Å²	230	97.5 Å²	97.5	87%	0.871	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	76.1	174.1	-147.5	-37	0	0	0	110.4
96	G	45.3	Very low	45	Very low	68 Å²	68	99.5 Å²	99.5	70%	0.701	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	170.4	-25.9	179.8	0	0	0	0	0	115.5	A94	A94-G96 PolarHBondContact O-N 2.69Å
97	T	45.6	Very low	44.5	Very low	124 Å²	124	100.7 Å²	100.7	76%	0.761	56%	0.56	S	S	*	*			trans	-154.3	80.9	-174.1	47.3	0	0	0	0	114.1	A94	A94-T97 PolarHBondContact O-N 2.91Å
98	L	35.2	Very low	44.2	Very low	115 Å²	115	108.6 Å²	108.6	60%	0.602	59%	0.586	S	S	*	*			trans	-139.1	120.2	161	-85.7	171.3	0	0	0	112.1	A94 D102	A94-L98 HydrophobicContact CB-CD1 4.19Å; L98-D102 HydrophobicContact CD2-CB 3.68Å
99	R	36.9	Very low	44.2	Very low	238 Å²	238	110.4 Å²	110.4	90%	0.898	59%	0.589	S	S	*	*			trans	-79.8	145	168.1	-160.6	173.6	-175	173.3	0.8	107.6	G101	R99-G101 PolarHBondContact O-N 2.94Å
100	E	36.8	Very low	44.1	Very low	203 Å²	203	108.5 Å²	108.5	95%	0.949	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	10.6	-167.6	-69.5	176	146	0	0	118.1
101	G	41.1	Very low	44.1	Very low	69 Å²	69	106.9 Å²	106.9	71%	0.711	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-7.6	-176.8	0	0	0	0	0	117.4	R99	R99-G101 PolarHBondContact O-N 2.94Å
102	D	41.8	Very low	44.2	Very low	96 Å²	96	109.7 Å²	109.7	51%	0.513	60%	0.597	S	S	.	*			trans	-101	5.3	-164.4	-130.7	9.3	0	0	0	115.4	L98 A104 G105	L98-D102 HydrophobicContact CD2-CB 3.68Å; D102-A104 PolarHBondContact O-N 2.73Å; D102-G105 PolarHBondContact O-N 3.01Å; D102-G105 VanDerWaalsContact O-N 3.08Å
103	S	44.6	Very low	44.4	Very low	96 Å²	96	108.9 Å²	108.9	67%	0.671	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-21.4	-178.7	53.1	0	0	0	0	113.8
104	A	41.8	Very low	44.7	Very low	67 Å²	67	110 Å²	110	55%	0.554	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-21.1	173.7	0	0	0	0	0	113.6	D102	D102-A104 PolarHBondContact O-N 2.73Å
105	G	46.7	Very low	44.9	Very low	37 Å²	37	110 Å²	110	38%	0.381	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.1	-24.3	-176.7	0	0	0	0	0	114.7	D102 W109	D102-G105 PolarHBondContact O-N 3.01Å; D102-G105 VanDerWaalsContact O-N 3.08Å; G105-W109 PolarHBondContact O-N 3.38Å
106	L	48.2	Very low	45.4	Very low	73 Å²	73	103.6 Å²	103.6	38%	0.382	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	-30.7	177.9	-91.4	153.5	0	0	0	112.9
107	L	44.7	Very low	45.9	Very low	108 Å²	108	102.8 Å²	102.8	57%	0.565	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-33.2	179.2	-82.7	154.6	0	0	0	112.8	W109	L107-W109 VanDerWaalsContact C-N 3.35Å
108	Y	47.7	Very low	46.3	Very low	186 Å²	186	102.4 Å²	102.4	73%	0.729	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-86.1	0.5	177.1	-87.5	-85.4	0	0	0	114.3	N110 S111	Y108-N110 PolarHBondContact O-N 3.37Å; Y108-S111 PolarHBondContact O-OG 3.31Å
109	W	48.9	Very low	47	Very low	102 Å²	102	97.7 Å²	97.7	39%	0.386	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-70.5	-23.9	174.7	-164.2	-97.5	0	0	0	112.7	G105 L107 S111 R112	G105-W109 PolarHBondContact O-N 3.38Å; L107-W109 VanDerWaalsContact C-N 3.35Å; W109-S111 PolarHBondContact O-N 3.22Å; W109-S111 VanDerWaalsContact O-N 3.1Å; W109-R112 PolarHBondContact O-N 3.45Å
110	N	46	Very low	47.7	Very low	58 Å²	58	88.6 Å²	88.6	31%	0.31	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-63.1	-15.8	179.4	-158.2	17.6	0	0	0	113.5	R21 Y108	R21-N110 PolarHBondContact NH2-O 2.84Å; Y108-N110 PolarHBondContact O-N 3.37Å
111	S	48.3	Very low	48.5	Very low	80 Å²	80	83.8 Å²	83.8	56%	0.559	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-100.8	-1.4	-179.7	45.6	0	0	0	0	115.3	Y108 W109	Y108-S111 PolarHBondContact O-OG 3.31Å; W109-S111 PolarHBondContact O-N 3.22Å; W109-S111 VanDerWaalsContact O-N 3.1Å
112	R	52.8	Low	48.9	Very low	135 Å²	135	82.8 Å²	82.8	51%	0.509	46%	0.462	S	S	.	.			trans	-84.2	131.5	178.5	-69.5	-162.8	-178.3	-169.4	2.6	112.6	W109 D114	W109-R112 PolarHBondContact O-N 3.45Å; R112-D114 VanDerWaalsContact C-N 3.27Å; R112-D114 PolarHBondContact O-N 2.79Å
113	P	51.5	Low	49.1	Very low	92 Å²	92	79 Å²	79	60%	0.597	44%	0.444	S	S	*	.	H	α-helix	trans	-69.9	-17.9	-178.5	26.3	-32.1	0	0	0	114.3	F116 A117	P113-F116 WeakPolarHBondContact O-CB 3.34Å; P113-F116 PolarHBondContact O-N 3.03Å; P113-A117 PolarHBondContact O-N 2.98Å
114	D	47.6	Very low	49.2	Very low	103 Å²	103	78.8 Å²	78.8	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-78.5	-37.1	-171.6	-37.6	-36.8	0	0	0	112.6	R112 F116 A117	R112-D114 VanDerWaalsContact C-N 3.27Å; R112-D114 PolarHBondContact O-N 2.79Å; D114-F116 PolarHBondContact O-N 3.27Å; D114-A117 PolarHBondContact O-N 3.18Å
115	A	51.3	Low	49.5	Very low	29 Å²	29	78.7 Å²	78.7	24%	0.24	43%	0.429	C	S	.	.	H	α-helix	trans	-69.6	-23.5	174.9	0	0	0	0	0	112.5	S119	A115-S119 PolarHBondContact O-N 3.39Å; A115-S119 PolarHBondContact O-OG 3.07Å
116	F	51.4	Low	49.4	Very low	96 Å²	96	79.7 Å²	79.7	42%	0.421	43%	0.433	S	S	.	.	H	α-helix	trans	-71.5	-43	175.3	165.6	-98.1	0	0	0	112	P113 D114 I118 S119 Y120	P113-F116 WeakPolarHBondContact O-CB 3.34Å; P113-F116 PolarHBondContact O-N 3.03Å; D114-F116 PolarHBondContact O-N 3.27Å; F116-I118 VanDerWaalsContact C-N 3.34Å; F116-I118 PolarHBondContact O-N 2.94Å; F116-S119 PolarHBondContact O-OG 2.88Å; F116-Y120 AromaticContact CD2-CD2 3.91Å; F116-Y120 HydrophobicContact CD2-CD2 3.91Å; F116-Y120 HydrophobicContact CD2-CE2 4.14Å; F116-Y120 AromaticContact CE2-CD2 3.71Å; F116-Y120 HydrophobicContact CE2-CD2 3.71Å; F116-Y120 AromaticContact CE2-CE2 3.77Å; F116-Y120 HydrophobicContact CE2-CE2 3.77Å; F116-Y120 HydrophobicContact CE2-CG 4.37Å; F116-Y120 HydrophobicContact CZ-CD2 4.46Å; F116-Y120 PolarHBondContact O-N 2.84Å
117	A	54.3	Low	49.2	Very low	51 Å²	51	77.1 Å²	77.1	42%	0.421	42%	0.423	S	S	.	.	H	α-helix	trans	-61.1	-43.5	177.5	0	0	0	0	0	111.5	P113 D114 V121	P113-A117 PolarHBondContact O-N 2.98Å; D114-A117 PolarHBondContact O-N 3.18Å; A117-V121 WeakPolarHBondContact O-CB 3.15Å; A117-V121 WeakPolarHBondContact O-CG2 3.4Å; A117-V121 PolarHBondContact O-N 3.22Å
118	I	55	Low	49.2	Very low	116 Å²	116	74.8 Å²	74.8	60%	0.595	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-40.9	-175.5	-62.1	168.6	0	0	0	112	F116 A122	F116-I118 VanDerWaalsContact C-N 3.34Å; F116-I118 PolarHBondContact O-N 2.94Å; I118-A122 VanDerWaalsContact O-CB 3.25Å; I118-A122 WeakPolarHBondContact O-CB 3.33Å; I118-A122 PolarHBondContact O-N 3.06Å; I118-A122 VanDerWaalsContact O-N 3.07Å
119	S	49	Very low	49.1	Very low	17 Å²	17	68.5 Å²	68.5	12%	0.119	40%	0.397	C	S	.	.	H	α-helix	trans	-71.7	-40.2	-178.3	50.4	0	0	0	0	112.9	A115 F116 A123	A115-S119 PolarHBondContact O-N 3.39Å; A115-S119 PolarHBondContact O-OG 3.07Å; F116-S119 PolarHBondContact O-OG 2.88Å; S119-A123 WeakPolarHBondContact O-CB 3.42Å; S119-A123 PolarHBondContact O-N 3.13Å
120	Y	53	Low	49	Very low	47 Å²	47	72.4 Å²	72.4	18%	0.184	41%	0.412	C	S	.	.	H	α-helix	trans	-74.3	-39.3	176.3	-95.5	-96.4	0	0	0	113.3	L13 L79 F116 A122 A123 L124	L13-Y120 HydrophobicContact CD1-CE1 4.21Å; L13-Y120 HydrophobicContact CD2-CE1 3.36Å; L13-Y120 WeakPolarHBondContact CD2-OH 3.27Å; L13-Y120 HydrophobicContact CG-CE1 4.38Å; L79-Y120 HydrophobicContact CD1-CE1 4.37Å; L79-Y120 HydrophobicContact CD2-CD1 4.15Å; L79-Y120 HydrophobicContact CD2-CD2 4.08Å; L79-Y120 HydrophobicContact CD2-CE1 3.57Å; L79-Y120 HydrophobicContact CD2-CE2 3.49Å; L79-Y120 VanDerWaalsContact CD2-CE2 3.49Å; L79-Y120 HydrophobicContact CD2-CG 4.38Å; L79-Y120 WeakPolarHBondContact CD2-OH 3.42Å; F116-Y120 AromaticContact CD2-CD2 3.91Å; F116-Y120 HydrophobicContact CD2-CD2 3.91Å; F116-Y120 HydrophobicContact CD2-CE2 4.14Å; F116-Y120 AromaticContact CE2-CD2 3.71Å; F116-Y120 HydrophobicContact CE2-CD2 3.71Å; F116-Y120 AromaticContact CE2-CE2 3.77Å; F116-Y120 HydrophobicContact CE2-CE2 3.77Å; F116-Y120 HydrophobicContact CE2-CG 4.37Å; F116-Y120 HydrophobicContact CZ-CD2 4.46Å; F116-Y120 PolarHBondContact O-N 2.84Å; Y120-A122 VanDerWaalsContact C-N 3.28Å; Y120-A122 PolarHBondContact O-N 3.21Å; Y120-A123 PolarHBondContact O-N 3Å; Y120-L124 PolarHBondContact O-N 2.81Å; Y120-L124 VanDerWaalsContact O-N 3.13Å
121	V	53	Low	49	Very low	102 Å²	102	75.1 Å²	75.1	62%	0.618	42%	0.422	S	S	*	.	H	α-helix	trans	-68.7	-27	177.2	173.3	0	0	0	0	111.7	A117 P125	A117-V121 WeakPolarHBondContact O-CB 3.15Å; A117-V121 WeakPolarHBondContact O-CG2 3.4Å; A117-V121 PolarHBondContact O-N 3.22Å; V121-P125 WeakPolarHBondContact O-CD 3.36Å; V121-P125 WeakPolarHBondContact O-CG 3.37Å
122	A	49.5	Very low	48.9	Very low	48 Å²	48	76.9 Å²	76.9	40%	0.397	42%	0.42	S	S	.	.	H	α-helix	trans	-82.7	-34.6	172	0	0	0	0	0	113.3	I118 Y120 P125 A126	I118-A122 VanDerWaalsContact O-CB 3.25Å; I118-A122 WeakPolarHBondContact O-CB 3.33Å; I118-A122 PolarHBondContact O-N 3.06Å; I118-A122 VanDerWaalsContact O-N 3.07Å; Y120-A122 VanDerWaalsContact C-N 3.28Å; Y120-A122 PolarHBondContact O-N 3.21Å; A122-P125 WeakPolarHBondContact O-CD 3.35Å; A122-A126 WeakPolarHBondContact O-CB 3.32Å; A122-A126 PolarHBondContact O-N 2.95Å
123	A	46.6	Very low	48.3	Very low	15 Å²	15	74.2 Å²	74.2	12%	0.124	42%	0.416	C	S	.	.	H	α-helix	trans	-71.2	-35.1	-178.6	0	0	0	0	0	113.2	A78 S119 Y120 A126 A127	A78-A123 HydrophobicContact CB-CB 4.31Å; S119-A123 WeakPolarHBondContact O-CB 3.42Å; S119-A123 PolarHBondContact O-N 3.13Å; Y120-A123 PolarHBondContact O-N 3Å; A123-A126 PolarHBondContact O-N 2.84Å; A123-A127 VanDerWaalsContact O-CB 3.25Å; A123-A127 WeakPolarHBondContact O-CB 3.09Å; A123-A127 PolarHBondContact O-N 3.42Å
124	L	46.4	Very low	47.7	Very low	93 Å²	93	71.4 Å²	71.4	49%	0.487	40%	0.404	S	S	.	.	H	α-helix	trans	-65.4	-47.6	180	-81.4	163.8	0	0	0	113.4	Y120 A128	Y120-L124 PolarHBondContact O-N 2.81Å; Y120-L124 VanDerWaalsContact O-N 3.13Å; L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.42Å
125	P	48.1	Very low	47.3	Very low	65 Å²	65	69.7 Å²	69.7	42%	0.422	40%	0.4	S	S	.	.	H	α-helix	trans	-64.4	-40.7	171.9	-21.5	32	0	0	0	112.7	V121 A122 A128 L129	V121-P125 WeakPolarHBondContact O-CD 3.36Å; V121-P125 WeakPolarHBondContact O-CG 3.37Å; A122-P125 WeakPolarHBondContact O-CD 3.35Å; P125-A128 PolarHBondContact O-N 3.11Å; P125-L129 WeakPolarHBondContact O-CB 3.5Å; P125-L129 WeakPolarHBondContact O-CD1 3.32Å; P125-L129 PolarHBondContact O-N 3.05Å
126	A	44.6	Very low	46.7	Very low	57 Å²	57	71.2 Å²	71.2	47%	0.471	40%	0.403	S	S	.	.	H	α-helix	trans	-64.3	-42.1	179	0	0	0	0	0	112	A122 A123 L129 W130	A122-A126 WeakPolarHBondContact O-CB 3.32Å; A122-A126 PolarHBondContact O-N 2.95Å; A123-A126 PolarHBondContact O-N 2.84Å; A126-L129 PolarHBondContact O-N 3.42Å; A126-W130 WeakPolarHBondContact O-CB 3.31Å; A126-W130 PolarHBondContact O-N 2.96Å
127	A	43.8	Very low	46.1	Very low	20 Å²	20	76.6 Å²	76.6	17%	0.165	42%	0.421	C	S	.	.	H	α-helix	trans	-67	-38.8	173.9	0	0	0	0	0	112	A123 W130 H131	A123-A127 VanDerWaalsContact O-CB 3.25Å; A123-A127 WeakPolarHBondContact O-CB 3.09Å; A123-A127 PolarHBondContact O-N 3.42Å; A127-W130 PolarHBondContact O-N 2.95Å; A127-H131 WeakPolarHBondContact O-CB 3.28Å; A127-H131 PolarHBondContact O-N 2.67Å
128	A	45.3	Very low	45.3	Very low	58 Å²	58	76.6 Å²	76.6	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-36.2	174.6	0	0	0	0	0	112.5	L124 P125 K132	L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.42Å; P125-A128 PolarHBondContact O-N 3.11Å; A128-K132 WeakPolarHBondContact O-CB 3.26Å; A128-K132 PolarHBondContact O-N 3.49Å
129	L	45.3	Very low	44.4	Very low	54 Å²	54	76.1 Å²	76.1	28%	0.283	43%	0.425	S	S	.	.	H	α-helix	trans	-66.9	-47.4	171.7	-109.7	97.4	0	0	0	111.6	P125 A126 H131 K132 L133 P312	P125-L129 WeakPolarHBondContact O-CB 3.5Å; P125-L129 WeakPolarHBondContact O-CD1 3.32Å; P125-L129 PolarHBondContact O-N 3.05Å; A126-L129 PolarHBondContact O-N 3.42Å; L129-H131 VanDerWaalsContact C-N 3.29Å; L129-H131 PolarHBondContact O-N 2.84Å; L129-K132 CarbonylContact O-C 3.58Å; L129-K132 PolarHBondContact O-N 3.22Å; L129-K132 VanDerWaalsContact O-N 3.13Å; L129-L133 HydrophobicContact CB-CD1 4.26Å; L129-L133 HydrophobicContact CD2-CD1 3.7Å; L129-L133 HydrophobicContact CG-CD1 4.13Å; L129-L133 WeakPolarHBondContact O-CB 3.29Å; L129-L133 VanDerWaalsContact O-CD1 3.25Å; L129-L133 WeakPolarHBondContact O-CD1 3.3Å; L129-L133 PolarHBondContact O-N 3.5Å; L129-P312 HydrophobicContact CD1-CB 3.39Å; L129-P312 HydrophobicContact CD1-CG 3.11Å; L129-P312 HydrophobicContact CD2-CB 3.85Å; L129-P312 HydrophobicContact CD2-CG 3.53Å; L129-P312 HydrophobicContact CG-CB 3.88Å; L129-P312 HydrophobicContact CG-CG 3.79Å
130	W	46	Very low	43.8	Very low	185 Å²	185	79.9 Å²	79.9	70%	0.701	45%	0.452	S	S	*	.	H	α-helix	trans	-63.7	-37.7	-179.6	-166.9	-91.8	0	0	0	111.5	A126 A127 G134	A126-W130 WeakPolarHBondContact O-CB 3.31Å; A126-W130 PolarHBondContact O-N 2.96Å; A127-W130 PolarHBondContact O-N 2.95Å; W130-G134 VanDerWaalsContact O-CA 3.28Å; W130-G134 WeakPolarHBondContact O-CA 3.44Å; W130-G134 PolarHBondContact O-N 2.77Å
131	H	46.5	Very low	43.1	Very low	114 Å²	114	81.4 Å²	81.4	53%	0.528	48%	0.482	S	S	.	.	H	α-helix	trans	-67.4	-38.1	173.2	-169.2	-74.2	0	0	0	112	A127 L129 S135	A127-H131 WeakPolarHBondContact O-CB 3.28Å; A127-H131 PolarHBondContact O-N 2.67Å; L129-H131 VanDerWaalsContact C-N 3.29Å; L129-H131 PolarHBondContact O-N 2.84Å; H131-S135 VanDerWaalsContact O-CB 3.3Å; H131-S135 WeakPolarHBondContact O-CB 3.34Å; H131-S135 PolarHBondContact O-N 3.19Å; H131-S135 PolarHBondContact O-OG 2.95Å
132	K	45.5	Very low	42.5	Very low	117 Å²	117	81.4 Å²	81.4	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-74.7	-42.2	177.3	-96	-172.6	174.1	179	0	113.5	A128 L129 S135 L136	A128-K132 WeakPolarHBondContact O-CB 3.26Å; A128-K132 PolarHBondContact O-N 3.49Å; L129-K132 CarbonylContact O-C 3.58Å; L129-K132 PolarHBondContact O-N 3.22Å; L129-K132 VanDerWaalsContact O-N 3.13Å; K132-S135 WeakPolarHBondContact CA-OG 3.22Å; K132-S135 PolarHBondContact O-N 2.78Å; K132-S135 PolarHBondContact O-OG 2.98Å; K132-L136 WeakPolarHBondContact O-CG 3.44Å; K132-L136 PolarHBondContact O-N 3.48Å
133	L	40.9	Very low	42.2	Very low	79 Å²	79	89.6 Å²	89.6	41%	0.414	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-42.9	171.3	-90.1	97	0	0	0	110.2	L129 S135 L136 W137	L129-L133 HydrophobicContact CB-CD1 4.26Å; L129-L133 HydrophobicContact CD2-CD1 3.7Å; L129-L133 HydrophobicContact CG-CD1 4.13Å; L129-L133 WeakPolarHBondContact O-CB 3.29Å; L129-L133 VanDerWaalsContact O-CD1 3.25Å; L129-L133 WeakPolarHBondContact O-CD1 3.3Å; L129-L133 PolarHBondContact O-N 3.5Å; L133-S135 VanDerWaalsContact C-N 3.28Å; L133-S135 PolarHBondContact O-N 3.3Å; L133-L136 CarbonylContact O-C 3.5Å; L133-L136 WeakPolarHBondContact O-CA 3.45Å; L133-L136 WeakPolarHBondContact O-CB 3.28Å; L133-L136 PolarHBondContact O-N 3.48Å; L133-W137 PolarHBondContact O-N 3.42Å
134	G	38.2	Very low	42.8	Very low	34 Å²	34	93.4 Å²	93.4	35%	0.351	52%	0.517	S	S	.	.	H	α-helix	trans	-58.2	-38.9	172.6	0	0	0	0	0	112.3	W130 L136 W137 A138	W130-G134 VanDerWaalsContact O-CA 3.28Å; W130-G134 WeakPolarHBondContact O-CA 3.44Å; W130-G134 PolarHBondContact O-N 2.77Å; G134-L136 VanDerWaalsContact C-N 3.33Å; G134-W137 CarbonylContact O-C 3.57Å; G134-W137 PolarHBondContact O-N 2.93Å; G134-A138 WeakPolarHBondContact O-CB 3.34Å; G134-A138 PolarHBondContact O-N 3.29Å
135	S	39.8	Very low	43.3	Very low	67 Å²	67	91 Å²	91	47%	0.469	51%	0.511	S	S	.	.	H	α-helix	trans	-73.9	-19.4	172.5	72.3	0	0	0	0	114.5	H131 K132 L133	H131-S135 VanDerWaalsContact O-CB 3.3Å; H131-S135 WeakPolarHBondContact O-CB 3.34Å; H131-S135 PolarHBondContact O-N 3.19Å; H131-S135 PolarHBondContact O-OG 2.95Å; K132-S135 WeakPolarHBondContact CA-OG 3.22Å; K132-S135 PolarHBondContact O-N 2.78Å; K132-S135 PolarHBondContact O-OG 2.98Å; L133-S135 VanDerWaalsContact C-N 3.28Å; L133-S135 PolarHBondContact O-N 3.3Å
136	L	38.7	Very low	44	Very low	60 Å²	60	90.1 Å²	90.1	31%	0.314	51%	0.513	S	S	.	.	H	α-helix	trans	-81	-21.6	169.2	-73.4	163.1	0	0	0	111.8	K132 L133 G134 Y441	K132-L136 WeakPolarHBondContact O-CG 3.44Å; K132-L136 PolarHBondContact O-N 3.48Å; L133-L136 CarbonylContact O-C 3.5Å; L133-L136 WeakPolarHBondContact O-CA 3.45Å; L133-L136 WeakPolarHBondContact O-CB 3.28Å; L133-L136 PolarHBondContact O-N 3.48Å; G134-L136 VanDerWaalsContact C-N 3.33Å; L136-Y441 VanDerWaalsContact O-CE2 3.24Å; L136-Y441 WeakPolarHBondContact O-CE2 3.14Å; L136-Y441 VanDerWaalsContact O-CZ 3.32Å; L136-Y441 PolarHBondContact O-OH 3.33Å
137	W	39	Very low	45.2	Very low	209 Å²	209	90.9 Å²	90.9	79%	0.792	51%	0.509	S	S	*	.	H	α-helix	trans	-97.8	-11.6	174.7	-77.2	60.5	0	0	0	112.8	L133 G134 P139	L133-W137 PolarHBondContact O-N 3.42Å; G134-W137 CarbonylContact O-C 3.57Å; G134-W137 PolarHBondContact O-N 2.93Å; W137-P139 VanDerWaalsContact O-CD 3.29Å; W137-P139 WeakPolarHBondContact O-CD 3.4Å
138	A	36.5	Very low	46.6	Very low	51 Å²	51	91.1 Å²	91.1	42%	0.421	51%	0.508	S	S	.	.	S	Bend	trans	-74.9	114	175	0	0	0	0	0	108.3	G134 S140	G134-A138 WeakPolarHBondContact O-CB 3.34Å; G134-A138 PolarHBondContact O-N 3.29Å; A138-S140 PolarHBondContact O-N 2.94Å
139	P	37	Very low	47.8	Very low	106 Å²	106	91 Å²	91	69%	0.688	50%	0.498	S	S	*	.			trans	-64.9	111.8	-177.9	24.9	-30.8	0	0	0	108.9	W137 G141	W137-P139 VanDerWaalsContact O-CD 3.29Å; W137-P139 WeakPolarHBondContact O-CD 3.4Å; P139-G141 PolarHBondContact O-N 2.95Å
140	S	35.8	Very low	49.2	Very low	97 Å²	97	92.2 Å²	92.2	68%	0.678	51%	0.51	S	S	*	.			trans	-74.6	96	173.1	59.7	0	0	0	0	109.4	A138 N142	A138-S140 PolarHBondContact O-N 2.94Å; S140-N142 PolarHBondContact O-N 3.2Å
141	G	38.9	Very low	50.8	Low	78 Å²	78	88.3 Å²	88.3	80%	0.804	50%	0.496	S	S	*	.	S	Bend	trans	82.5	4.4	137.7	0	0	0	0	0	120.3	P139	P139-G141 PolarHBondContact O-N 2.95Å
142	N	40.3	Very low	52.2	Low	103 Å²	103	83.1 Å²	83.1	55%	0.551	47%	0.472	S	S	*	.	S	Bend	trans	-127.2	143.2	167.6	-129.2	18	0	0	0	109.4	S140 D144 E452	S140-N142 PolarHBondContact O-N 3.2Å; N142-D144 PolarHBondContact O-N 3.02Å; N142-E452 PolarHBondContact ND2-OE1 3.32Å; N142-E452 PolarHBondContact ND2-OE2 3.49Å
143	R	43	Very low	53.6	Low	220 Å²	220	80.5 Å²	80.5	83%	0.83	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.3	114.6	176.5	-93.7	172.2	160	169.3	-6.4	110.5
144	D	58.2	Low	55.5	Low	95 Å²	95	78.3 Å²	78.3	51%	0.508	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	67.1	152.4	-50.9	-41.8	0	0	0	119.9	N142 G146 D147 M148	N142-D144 PolarHBondContact O-N 3.02Å; D144-G146 PolarHBondContact O-N 3.11Å; D144-D147 HydrophobicContact CB-CB 3.21Å; D144-D147 PolarHBondContact O-N 3.49Å; D144-M148 WeakPolarHBondContact O-CG 3.43Å; D144-M148 PolarHBondContact O-N 2.89Å
145	A	57	Low	57.5	Low	42 Å²	42	78.6 Å²	78.6	35%	0.347	45%	0.451	S	S	.	.	H	α-helix	trans	-52.7	-34.6	160.8	0	0	0	0	0	112.4	L149 V448	A145-L149 WeakPolarHBondContact O-CG 3.47Å; A145-L149 PolarHBondContact O-N 2.89Å; A145-L149 VanDerWaalsContact O-N 3.12Å; A145-V448 HydrophobicContact CB-CG1 3.81Å
146	G	63.5	Low	59.3	Low	46 Å²	46	75.8 Å²	75.8	47%	0.474	43%	0.431	S	S	.	.	H	α-helix	trans	-67.5	-42.6	172.8	0	0	0	0	0	113.4	D144 L149 C150	D144-G146 PolarHBondContact O-N 3.11Å; G146-L149 PolarHBondContact O-N 3.08Å; G146-C150 WeakPolarHBondContact O-CB 3.41Å; G146-C150 PolarHBondContact O-N 3.27Å; G146-C150 PolarHBondContact O-SG 2.97Å
147	D	70.8	Confident	61.2	Low	73 Å²	73	74 Å²	74	39%	0.39	43%	0.427	S	S	.	.	H	α-helix	trans	-69.6	-37.1	177.6	-168.3	40	0	0	0	111.2	D144 C150 R151	D144-D147 HydrophobicContact CB-CB 3.21Å; D144-D147 PolarHBondContact O-N 3.49Å; D147-C150 CarbonylContact O-C 3.59Å; D147-C150 PolarHBondContact O-N 3.03Å; D147-R151 VanDerWaalsContact O-CB 3.31Å; D147-R151 WeakPolarHBondContact O-CB 3.37Å; D147-R151 VanDerWaalsContact O-CG 3.25Å; D147-R151 WeakPolarHBondContact O-CG 3.15Å; D147-R151 PolarHBondContact O-N 2.95Å; D147-R151 IonicContact OD2-NE 3.69Å; D147-R151 PolarHBondContact OD2-NE 3.28Å
148	M	71.7	Confident	62.9	Low	26 Å²	26	70 Å²	70	13%	0.128	43%	0.428	C	S	.	.	H	α-helix	trans	-60.1	-48.3	173.2	-68.8	-176.2	-172.2	0	0	111.2	D144 C150 R151 M152 V448 E452	D144-M148 WeakPolarHBondContact O-CG 3.43Å; D144-M148 PolarHBondContact O-N 2.89Å; M148-C150 VanDerWaalsContact C-N 3.34Å; M148-C150 PolarHBondContact O-N 3.48Å; M148-R151 PolarHBondContact O-N 3.28Å; M148-M152 WeakPolarHBondContact O-CB 3.4Å; M148-M152 VanDerWaalsContact O-CG 3.26Å; M148-M152 WeakPolarHBondContact O-CG 3.26Å; M148-M152 PolarHBondContact O-N 2.67Å; M148-V448 HydrophobicContact CB-CG1 4.38Å; M148-V448 HydrophobicContact SD-CG1 3.65Å; M148-E452 HydrophobicContact CE-CB 3.78Å; M148-E452 HydrophobicContact CE-CG 3.67Å; M148-E452 HydrophobicContact SD-CB 4.17Å
149	L	71.4	Confident	65	Low	54 Å²	54	70.7 Å²	70.7	28%	0.283	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-41.1	173.8	-75.5	174.1	0	0	0	112.1	A145 G146 M152 L153 V448	A145-L149 WeakPolarHBondContact O-CG 3.47Å; A145-L149 PolarHBondContact O-N 2.89Å; A145-L149 VanDerWaalsContact O-N 3.12Å; G146-L149 PolarHBondContact O-N 3.08Å; L149-M152 PolarHBondContact O-N 3.48Å; L149-L153 WeakPolarHBondContact O-CB 3.42Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.44Å; L149-L153 PolarHBondContact O-N 2.79Å; L149-V448 HydrophobicContact CD2-CG2 4.37Å; L149-V448 HydrophobicContact CG-CG2 4.18Å
150	C	74.6	Confident	67	Low	80 Å²	80	70.1 Å²	70.1	54%	0.541	41%	0.408	S	S	.	.	H	α-helix	trans	-64.8	-40.9	176.5	-77	0	0	0	0	112.7	G146 D147 M148 L153 G154	G146-C150 WeakPolarHBondContact O-CB 3.41Å; G146-C150 PolarHBondContact O-N 3.27Å; G146-C150 PolarHBondContact O-SG 2.97Å; D147-C150 CarbonylContact O-C 3.59Å; D147-C150 PolarHBondContact O-N 3.03Å; M148-C150 VanDerWaalsContact C-N 3.34Å; M148-C150 PolarHBondContact O-N 3.48Å; C150-L153 CarbonylContact O-C 3.48Å; C150-L153 PolarHBondContact O-N 2.82Å; C150-G154 PolarHBondContact O-N 3Å
151	R	79.7	Confident	69.3	Low	104 Å²	104	75.6 Å²	75.6	39%	0.392	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-43	173.6	-77.2	172.2	162.2	-136.1	-6.2	111	D147 M148 G154 F155 F455 D459	D147-R151 VanDerWaalsContact O-CB 3.31Å; D147-R151 WeakPolarHBondContact O-CB 3.37Å; D147-R151 VanDerWaalsContact O-CG 3.25Å; D147-R151 WeakPolarHBondContact O-CG 3.15Å; D147-R151 PolarHBondContact O-N 2.95Å; D147-R151 IonicContact OD2-NE 3.69Å; D147-R151 PolarHBondContact OD2-NE 3.28Å; M148-R151 PolarHBondContact O-N 3.28Å; R151-G154 VanDerWaalsContact O-CA 3.25Å; R151-G154 WeakPolarHBondContact O-CA 3.38Å; R151-G154 PolarHBondContact O-N 3.23Å; R151-F155 WeakPolarHBondContact O-CD2 3.47Å; R151-F155 PolarHBondContact O-N 3.41Å; R151-F455 HydrophobicContact CB-CE1 4.11Å; R151-F455 HydrophobicContact CB-CZ 3.94Å; R151-D459 IonicContact CZ-OD2 2.85Å; R151-D459 IonicContact NH1-OD1 3.77Å; R151-D459 IonicContact NH1-OD2 3.47Å; R151-D459 PolarHBondContact NH1-OD2 3.29Å; R151-D459 IonicContact NH2-OD2 2.99Å
152	M	75.8	Confident	71.7	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.025	40%	0.395	C	S	.	.	H	α-helix	trans	-63.4	-47.4	175.4	-70	-162.6	88.1	0	0	112.2	M148 L149 G154 F155 M271 I275 F455	M148-M152 WeakPolarHBondContact O-CB 3.4Å; M148-M152 VanDerWaalsContact O-CG 3.26Å; M148-M152 WeakPolarHBondContact O-CG 3.26Å; M148-M152 PolarHBondContact O-N 2.67Å; L149-M152 PolarHBondContact O-N 3.48Å; M152-G154 PolarHBondContact O-N 3.31Å; M152-F155 WeakPolarHBondContact O-CB 3.27Å; M152-F155 PolarHBondContact O-N 3.24Å; M152-M271 HydrophobicContact CE-CE 3.23Å; M152-M271 HydrophobicContact CE-CG 3.96Å; M152-M271 HydrophobicContact CE-SD 3.43Å; M152-M271 WeakPolarHBondContact CE-SD 3.26Å; M152-M271 HydrophobicContact SD-SD 4.06Å; M152-I275 HydrophobicContact CE-CD1 3.65Å; M152-I275 HydrophobicContact SD-CD1 3.14Å; M152-I275 WeakPolarHBondContact SD-CD1 3.26Å; M152-F455 HydrophobicContact CG-CE2 3.51Å; M152-F455 HydrophobicContact CG-CZ 3.41Å; M152-F455 VanDerWaalsContact CG-CZ 3.41Å; M152-F455 HydrophobicContact SD-CE2 3.97Å; M152-F455 HydrophobicContact SD-CZ 4.39Å
153	L	74.9	Confident	73.8	Confident	61 Å²	61	74.1 Å²	74.1	32%	0.319	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-23.5	171.7	-70	171.2	0	0	0	112.1	L149 C150 F155 L156 K160 L163 L279	L149-L153 WeakPolarHBondContact O-CB 3.42Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.44Å; L149-L153 PolarHBondContact O-N 2.79Å; C150-L153 CarbonylContact O-C 3.48Å; C150-L153 PolarHBondContact O-N 2.82Å; L153-F155 VanDerWaalsContact C-N 3.29Å; L153-F155 PolarHBondContact O-N 3.31Å; L153-L156 HydrophobicContact CB-CD1 4.43Å; L153-L156 HydrophobicContact CD2-CD1 3.83Å; L153-L156 WeakPolarHBondContact O-CB 3.34Å; L153-L156 PolarHBondContact O-N 3.36Å; L153-K160 WeakPolarHBondContact O-CE 3.48Å; L153-L163 HydrophobicContact CD2-CD1 4.44Å; L153-L279 HydrophobicContact CD2-CD2 4.04Å
154	G	80.1	Confident	75.9	Confident	33 Å²	33	71.7 Å²	71.7	34%	0.34	37%	0.371	S	S	.	.	H	α-helix	trans	-57.4	-36.8	169.1	0	0	0	0	0	113.2	C150 R151 M152 L156 G157	C150-G154 PolarHBondContact O-N 3Å; R151-G154 VanDerWaalsContact O-CA 3.25Å; R151-G154 WeakPolarHBondContact O-CA 3.38Å; R151-G154 PolarHBondContact O-N 3.23Å; M152-G154 PolarHBondContact O-N 3.31Å; G154-L156 PolarHBondContact O-N 3.14Å; G154-G157 PolarHBondContact O-N 3.35Å
155	F	80.9	Confident	77.5	Confident	40 Å²	40	71.4 Å²	71.4	18%	0.175	37%	0.369	C	S	.	.	H	α-helix	trans	-67.1	-21.8	179	-71.2	-79.2	0	0	0	113.8	R151 M152 L153 G157 M232 R235 V236 E239 F455 L458	R151-F155 WeakPolarHBondContact O-CD2 3.47Å; R151-F155 PolarHBondContact O-N 3.41Å; M152-F155 WeakPolarHBondContact O-CB 3.27Å; M152-F155 PolarHBondContact O-N 3.24Å; L153-F155 VanDerWaalsContact C-N 3.29Å; L153-F155 PolarHBondContact O-N 3.31Å; F155-G157 PolarHBondContact O-N 3.12Å; F155-M232 HydrophobicContact CB-CG 4.07Å; F155-R235 WeakPolarHBondContact O-CD 3.29Å; F155-R235 PolarHBondContact O-NH1 2.8Å; F155-V236 HydrophobicContact CB-CG2 4.11Å; F155-V236 HydrophobicContact CD1-CG2 4.26Å; F155-V236 HydrophobicContact CD2-CG2 4.04Å; F155-V236 HydrophobicContact CG-CG2 3.88Å; F155-E239 HydrophobicContact CE1-CB 4.47Å; F155-E239 HydrophobicContact CE1-CG 4.31Å; F155-F455 AromaticContact CE2-CE1 3.91Å; F155-F455 HydrophobicContact CE2-CE1 3.91Å; F155-F455 HydrophobicContact CE2-CZ 4.16Å; F155-F455 HydrophobicContact CZ-CE1 4.47Å; F155-L458 HydrophobicContact CZ-CD1 4.13Å
156	L	77.9	Confident	79.1	Confident	9 Å²	9	69.6 Å²	69.6	5%	0.047	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.2	170.7	-76.6	96.5	0	0	0	112.8	L153 G154 K159 K160 L163 T228 M232	L153-L156 HydrophobicContact CB-CD1 4.43Å; L153-L156 HydrophobicContact CD2-CD1 3.83Å; L153-L156 WeakPolarHBondContact O-CB 3.34Å; L153-L156 PolarHBondContact O-N 3.36Å; G154-L156 PolarHBondContact O-N 3.14Å; L156-K159 WeakPolarHBondContact O-CB 3.42Å; L156-K159 PolarHBondContact O-N 2.85Å; L156-K159 VanDerWaalsContact O-N 3.14Å; L156-K160 HydrophobicContact CB-CG 4.11Å; L156-L163 HydrophobicContact CD2-CD1 3.54Å; L156-L163 HydrophobicContact CD2-CD2 4.27Å; L156-L163 HydrophobicContact CD2-CG 3.83Å; L156-T228 HydrophobicContact CD2-CG2 3.78Å; L156-M232 HydrophobicContact CD1-CG 4.23Å; L156-M232 HydrophobicContact CD1-SD 3.52Å; L156-M232 VanDerWaalsContact CD1-SD 3.52Å; L156-M232 HydrophobicContact CG-CG 4.44Å; L156-M232 HydrophobicContact CG-SD 4.26Å
157	G	78.9	Confident	80.3	Confident	23 Å²	23	71.1 Å²	71.1	24%	0.237	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	52.9	-130.3	175	0	0	0	0	0	113.5	G154 F155 K159 K160	G154-G157 PolarHBondContact O-N 3.35Å; F155-G157 PolarHBondContact O-N 3.12Å; G157-K159 PolarHBondContact O-N 2.87Å; G157-K160 VanDerWaalsContact O-CG 3.26Å; G157-K160 WeakPolarHBondContact O-CG 3.45Å; G157-K160 PolarHBondContact O-N 2.87Å
158	P	75.1	Confident	81.3	Confident	123 Å²	123	72.1 Å²	72.1	80%	0.799	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.3	-14	-177.5	29.5	-34.9	0	0	0	113.6	K160	P158-K160 PolarHBondContact O-N 3.49Å
159	K	80.3	Confident	82.2	Confident	66 Å²	66	72.5 Å²	72.5	29%	0.287	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-77	-1	179.5	-65	179.9	179.3	172.9	0	113.3	L156 G157 R161 R162 T228 H231	L156-K159 WeakPolarHBondContact O-CB 3.42Å; L156-K159 PolarHBondContact O-N 2.85Å; L156-K159 VanDerWaalsContact O-N 3.14Å; G157-K159 PolarHBondContact O-N 2.87Å; K159-R161 PolarHBondContact O-N 3.45Å; K159-R162 WeakPolarHBondContact O-CB 3.46Å; K159-R162 PolarHBondContact O-N 3.46Å; K159-T228 HydrophobicContact CB-CG2 4.39Å; K159-H231 PolarHBondContact NZ-CD2 3.39Å; K159-H231 PolarHBondContact NZ-CE1 3.03Å; K159-H231 VanDerWaalsContact NZ-CE1 3.28Å; K159-H231 PolarHBondContact NZ-ND1 3.36Å; K159-H231 PolarHBondContact NZ-NE2 3.15Å
160	K	79.1	Confident	83.1	Confident	95 Å²	95	70.6 Å²	70.6	41%	0.413	35%	0.351	S	S	.	.	H	α-helix	trans	-51.8	-29.4	173.2	-73.9	175.4	-179.6	-171.2	0	113.3	L153 L156 G157 P158 R162 L163	L153-K160 WeakPolarHBondContact O-CE 3.48Å; L156-K160 HydrophobicContact CB-CG 4.11Å; G157-K160 VanDerWaalsContact O-CG 3.26Å; G157-K160 WeakPolarHBondContact O-CG 3.45Å; G157-K160 PolarHBondContact O-N 2.87Å; P158-K160 PolarHBondContact O-N 3.49Å; K160-R162 PolarHBondContact O-N 2.94Å; K160-L163 WeakPolarHBondContact O-CB 3.49Å; K160-L163 PolarHBondContact O-N 3.24Å; K160-L163 VanDerWaalsContact O-N 3.12Å
161	R	84.2	Confident	83.8	Confident	212 Å²	212	70.2 Å²	70.2	80%	0.8	34%	0.343	S	S	*	.	H	α-helix	trans	-59.1	-31.3	174.1	-168.5	175.8	175	-171.7	-1.5	113.2	K159 L163 Y164 L165	K159-R161 PolarHBondContact O-N 3.45Å; R161-L163 VanDerWaalsContact C-N 3.34Å; R161-Y164 PolarHBondContact O-N 3.46Å; R161-L165 PolarHBondContact O-N 3.43Å
162	R	87.6	Confident	84.3	Confident	110 Å²	110	69.8 Å²	69.8	42%	0.415	35%	0.348	S	S	.	.	H	α-helix	trans	-69.4	-30.7	177.7	-62	-176.7	-179.9	-172.5	-3.6	112.4	K159 K160 Y164 L165 V166 I224	K159-R162 WeakPolarHBondContact O-CB 3.46Å; K159-R162 PolarHBondContact O-N 3.46Å; K160-R162 PolarHBondContact O-N 2.94Å; R162-Y164 VanDerWaalsContact C-N 3.35Å; R162-L165 WeakPolarHBondContact O-CB 3.2Å; R162-L165 PolarHBondContact O-N 3.49Å; R162-V166 WeakPolarHBondContact O-CG2 3.4Å; R162-V166 PolarHBondContact O-N 3.12Å; R162-I224 HydrophobicContact CB-CG2 4.36Å
163	L	85.6	Confident	85.1	Confident	39 Å²	39	69.6 Å²	69.6	20%	0.204	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-37.6	174.7	-73	-179	0	0	0	112.2	L153 L156 K160 R161 L165 V166 L167 Y225	L153-L163 HydrophobicContact CD2-CD1 4.44Å; L156-L163 HydrophobicContact CD2-CD1 3.54Å; L156-L163 HydrophobicContact CD2-CD2 4.27Å; L156-L163 HydrophobicContact CD2-CG 3.83Å; K160-L163 WeakPolarHBondContact O-CB 3.49Å; K160-L163 PolarHBondContact O-N 3.24Å; K160-L163 VanDerWaalsContact O-N 3.12Å; R161-L163 VanDerWaalsContact C-N 3.34Å; L163-L165 VanDerWaalsContact C-N 3.29Å; L163-L165 PolarHBondContact O-N 2.9Å; L163-V166 PolarHBondContact O-N 3.35Å; L163-L167 PolarHBondContact O-N 2.98Å; L163-Y225 HydrophobicContact CD2-CD2 4.26Å; L163-Y225 HydrophobicContact CD2-CE2 4.29Å
164	Y	87.6	Confident	85.7	Confident	170 Å²	170	66.7 Å²	66.7	67%	0.667	33%	0.332	S	S	*	.	H	α-helix	trans	-63.2	-38.6	173.4	-69.5	-72.5	0	0	0	111.7	R161 R162 L167 V168	R161-Y164 PolarHBondContact O-N 3.46Å; R162-Y164 VanDerWaalsContact C-N 3.35Å; Y164-L167 PolarHBondContact O-N 3.16Å; Y164-V168 WeakPolarHBondContact O-CG2 3.26Å; Y164-V168 PolarHBondContact O-N 3.49Å
165	L	90.6	Very high	86.1	Confident	88 Å²	88	69.1 Å²	69.1	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-64.9	-43	175.3	-175.1	122.4	0	0	0	111.7	R161 R162 L163 L167 V168 L169 I224	R161-L165 PolarHBondContact O-N 3.43Å; R162-L165 WeakPolarHBondContact O-CB 3.2Å; R162-L165 PolarHBondContact O-N 3.49Å; L163-L165 VanDerWaalsContact C-N 3.29Å; L163-L165 PolarHBondContact O-N 2.9Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 3.17Å; L165-V168 PolarHBondContact O-N 3.02Å; L165-L169 HydrophobicContact CD2-CD1 3.68Å; L165-L169 HydrophobicContact CG-CD1 4.16Å; L165-L169 WeakPolarHBondContact O-CB 3.02Å; L165-L169 WeakPolarHBondContact O-CG 3.08Å; L165-L169 PolarHBondContact O-N 3.24Å; L165-I224 HydrophobicContact CD2-CD1 3.44Å; L165-I224 VanDerWaalsContact CD2-CD1 3.44Å; L165-I224 HydrophobicContact CD2-CG2 4.25Å
166	V	90.9	Very high	86.4	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.03	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-47.7	172.2	168.8	0	0	0	0	110.7	R162 L163 V168 L169 L170 I224 Y225	R162-V166 WeakPolarHBondContact O-CG2 3.4Å; R162-V166 PolarHBondContact O-N 3.12Å; L163-V166 PolarHBondContact O-N 3.35Å; V166-V168 VanDerWaalsContact C-N 3.34Å; V166-V168 PolarHBondContact O-N 3.31Å; V166-L169 PolarHBondContact O-N 3.03Å; V166-L170 WeakPolarHBondContact O-CB 3.15Å; V166-L170 PolarHBondContact O-N 3.43Å; V166-I224 HydrophobicContact CG2-CB 4.15Å; V166-I224 HydrophobicContact CG2-CG2 3.76Å; V166-Y225 HydrophobicContact CG1-CD2 4.22Å
167	L	89	Confident	86.8	Confident	77 Å²	77	68.4 Å²	68.4	40%	0.403	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-43.1	179.2	-171.1	110.5	0	0	0	112.3	L163 Y164 L165 L170 I171 L283	L163-L167 PolarHBondContact O-N 2.98Å; Y164-L167 PolarHBondContact O-N 3.16Å; L165-L167 VanDerWaalsContact C-N 3.34Å; L165-L167 PolarHBondContact O-N 3.17Å; L167-L170 PolarHBondContact O-N 3Å; L167-I171 HydrophobicContact CD2-CD1 4.05Å; L167-I171 HydrophobicContact CG-CD1 4.22Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.08Å; L167-I171 PolarHBondContact O-N 2.7Å; L167-L283 HydrophobicContact CD1-CD2 4.06Å
168	V	90.7	Very high	87.1	Confident	94 Å²	94	67.4 Å²	67.4	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-65.8	-46.1	178.1	171.9	0	0	0	0	111.4	Y164 L165 V166 L170 I171 L172	Y164-V168 WeakPolarHBondContact O-CG2 3.26Å; Y164-V168 PolarHBondContact O-N 3.49Å; L165-V168 PolarHBondContact O-N 3.02Å; V166-V168 VanDerWaalsContact C-N 3.34Å; V166-V168 PolarHBondContact O-N 3.31Å; V168-L170 VanDerWaalsContact C-N 3.3Å; V168-L170 PolarHBondContact O-N 3.49Å; V168-I171 PolarHBondContact O-N 3.08Å; V168-L172 PolarHBondContact O-N 2.88Å; V168-L172 VanDerWaalsContact O-N 3.07Å
169	L	91.7	Very high	87.7	Confident	35 Å²	35	62 Å²	62	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-39.4	178.1	-71.6	171.5	0	0	0	111.7	L165 V166 L172 S173 L217 I224	L165-L169 HydrophobicContact CD2-CD1 3.68Å; L165-L169 HydrophobicContact CG-CD1 4.16Å; L165-L169 WeakPolarHBondContact O-CB 3.02Å; L165-L169 WeakPolarHBondContact O-CG 3.08Å; L165-L169 PolarHBondContact O-N 3.24Å; V166-L169 PolarHBondContact O-N 3.03Å; L169-L172 PolarHBondContact O-N 3.22Å; L169-S173 PolarHBondContact O-N 2.8Å; L169-L217 HydrophobicContact CD2-CD2 3.73Å; L169-I224 HydrophobicContact CD1-CD1 4.07Å
170	L	90.5	Very high	88.2	Confident	13 Å²	13	62 Å²	62	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-46.4	178.1	-171.6	151	0	0	0	111.8	V166 L167 V168 L172 S173 C174 L283 W284	V166-L170 WeakPolarHBondContact O-CB 3.15Å; V166-L170 PolarHBondContact O-N 3.43Å; L167-L170 PolarHBondContact O-N 3Å; V168-L170 VanDerWaalsContact C-N 3.3Å; V168-L170 PolarHBondContact O-N 3.49Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 3.33Å; L170-S173 PolarHBondContact O-N 2.99Å; L170-C174 WeakPolarHBondContact O-CB 3.26Å; L170-C174 PolarHBondContact O-N 2.95Å; L170-C174 PolarHBondContact O-SG 2.75Å; L170-L283 HydrophobicContact CD1-CB 4.45Å; L170-W284 HydrophobicContact CD1-CB 4.1Å; L170-W284 HydrophobicContact CD1-CG 4.45Å
171	I	88.8	Confident	88.8	Confident	73 Å²	73	57.6 Å²	57.6	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-40.8	175.7	-67.5	165.8	0	0	0	110.5	L167 V168 C174 L175	L167-I171 HydrophobicContact CD2-CD1 4.05Å; L167-I171 HydrophobicContact CG-CD1 4.22Å; L167-I171 VanDerWaalsContact O-CG1 3.3Å; L167-I171 WeakPolarHBondContact O-CG1 3.08Å; L167-I171 PolarHBondContact O-N 2.7Å; V168-I171 PolarHBondContact O-N 3.08Å; I171-C174 PolarHBondContact O-N 3.35Å; I171-L175 HydrophobicContact CG2-CD1 4.42Å; I171-L175 PolarHBondContact O-N 2.81Å
172	L	89.8	Confident	89	Confident	95 Å²	95	51.3 Å²	51.3	50%	0.497	25%	0.252	S	S	.	.	H	α-helix	trans	-66.6	-38.9	178.3	-170.3	65.7	0	0	0	112.4	V168 L169 L170 G176 L217	V168-L172 PolarHBondContact O-N 2.88Å; V168-L172 VanDerWaalsContact O-N 3.07Å; L169-L172 PolarHBondContact O-N 3.22Å; L170-L172 VanDerWaalsContact C-N 3.28Å; L170-L172 PolarHBondContact O-N 3.33Å; L172-G176 PolarHBondContact O-N 3.44Å; L172-L217 HydrophobicContact CB-CD1 4.23Å; L172-L217 HydrophobicContact CD2-CD1 3.68Å; L172-L217 HydrophobicContact CD2-CD2 4.23Å; L172-L217 HydrophobicContact CG-CD1 3.71Å
173	S	92.3	Very high	89.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-68.1	-43	175.2	111.8	0	0	0	0	111.3	L169 L170 L175 G176 E177 S214 E218	L169-S173 PolarHBondContact O-N 2.8Å; L170-S173 PolarHBondContact O-N 2.99Å; S173-L175 PolarHBondContact O-N 3.08Å; S173-G176 CarbonylContact O-C 3.15Å; S173-G176 WeakPolarHBondContact O-CA 3.29Å; S173-G176 PolarHBondContact O-N 3.08Å; S173-E177 PolarHBondContact O-N 2.91Å; S173-S214 WeakPolarHBondContact O-CB 3.25Å; S173-E218 WeakPolarHBondContact OG-CG 3.48Å; S173-E218 PolarHBondContact OG-OE1 3.18Å
174	C	89.2	Confident	89.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.3	-41	178.1	-75.4	0	0	0	0	111.3	L170 I171 G176 E177 M178 C291	L170-C174 WeakPolarHBondContact O-CB 3.26Å; L170-C174 PolarHBondContact O-N 2.95Å; L170-C174 PolarHBondContact O-SG 2.75Å; I171-C174 PolarHBondContact O-N 3.35Å; C174-G176 VanDerWaalsContact C-N 3.26Å; C174-G176 PolarHBondContact O-N 3.14Å; C174-E177 PolarHBondContact O-N 3.19Å; C174-M178 VanDerWaalsContact O-CG 3.23Å; C174-M178 WeakPolarHBondContact O-CG 3.39Å; C174-M178 PolarHBondContact O-N 3.04Å; C174-C291 HydrophobicContact CB-CB 4.39Å
175	L	86.6	Confident	89.4	Confident	83 Å²	83	39.3 Å²	39.3	44%	0.435	21%	0.209	S	C	.	.	H	α-helix	trans	-58.4	-37.7	174.4	-76.8	157.3	0	0	0	112.6	I171 S173 F295	I171-L175 HydrophobicContact CG2-CD1 4.42Å; I171-L175 PolarHBondContact O-N 2.81Å; S173-L175 PolarHBondContact O-N 3.08Å; L175-F295 HydrophobicContact CD2-CE2 3.98Å; L175-F295 HydrophobicContact CD2-CZ 4.05Å
176	G	87.5	Confident	89.2	Confident	6 Å²	6	41.6 Å²	41.6	6%	0.062	21%	0.211	C	C	.	.	H	α-helix	trans	-74.1	-38.9	176.2	0	0	0	0	0	113.5	L172 S173 C174 M178 A179	L172-G176 PolarHBondContact O-N 3.44Å; S173-G176 CarbonylContact O-C 3.15Å; S173-G176 WeakPolarHBondContact O-CA 3.29Å; S173-G176 PolarHBondContact O-N 3.08Å; C174-G176 VanDerWaalsContact C-N 3.26Å; C174-G176 PolarHBondContact O-N 3.14Å; G176-M178 VanDerWaalsContact C-N 3.28Å; G176-M178 PolarHBondContact O-N 2.97Å; G176-A179 WeakPolarHBondContact O-CB 3.08Å; G176-A179 PolarHBondContact O-N 3.27Å; G176-A179 VanDerWaalsContact O-N 3.11Å
177	E	86.2	Confident	89	Confident	29 Å²	29	42.8 Å²	42.8	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-38.4	173.1	-69.4	-170.2	111.7	0	0	111.8	S173 C174 A179 I180 E218 R288	S173-E177 PolarHBondContact O-N 2.91Å; C174-E177 PolarHBondContact O-N 3.19Å; E177-A179 PolarHBondContact O-N 2.98Å; E177-I180 PolarHBondContact O-N 3Å; E177-E218 WeakPolarHBondContact CG-OE1 3.49Å; E177-R288 VanDerWaalsContact CD-NH1 3.28Å; E177-R288 IonicContact OE1-CZ 3.39Å; E177-R288 IonicContact OE1-NH1 3.64Å; E177-R288 PolarHBondContact OE1-NH1 3.29Å; E177-R288 IonicContact OE1-NH2 2.64Å; E177-R288 IonicContact OE2-CZ 2.88Å; E177-R288 IonicContact OE2-NH1 2.79Å; E177-R288 PolarHBondContact OE2-NH1 3.29Å; E177-R288 IonicContact OE2-NH2 3.13Å
178	M	86.8	Confident	88.9	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.4	177.7	-66	-41.8	114.3	0	0	113.5	C174 G176 I180 P181 R288 L292 F295 Y426	C174-M178 VanDerWaalsContact O-CG 3.23Å; C174-M178 WeakPolarHBondContact O-CG 3.39Å; C174-M178 PolarHBondContact O-N 3.04Å; G176-M178 VanDerWaalsContact C-N 3.28Å; G176-M178 PolarHBondContact O-N 2.97Å; M178-I180 VanDerWaalsContact C-N 3.28Å; M178-I180 PolarHBondContact O-N 3.44Å; M178-P181 WeakPolarHBondContact O-CD 3.36Å; M178-R288 HydrophobicContact CE-CG 3.9Å; M178-L292 HydrophobicContact CE-CD2 4.18Å; M178-L292 HydrophobicContact CE-CG 4.11Å; M178-L292 HydrophobicContact SD-CD1 4.49Å; M178-L292 HydrophobicContact SD-CD2 3.18Å; M178-L292 WeakPolarHBondContact SD-CD2 3.49Å; M178-L292 HydrophobicContact SD-CG 3.56Å; M178-L292 VanDerWaalsContact SD-CG 3.56Å; M178-F295 HydrophobicContact CB-CD2 3.97Å; M178-F295 HydrophobicContact CB-CE2 3.82Å; M178-F295 HydrophobicContact CB-CZ 4.36Å; M178-F295 HydrophobicContact CG-CD2 3.95Å; M178-F295 HydrophobicContact CG-CE2 4.05Å; M178-Y426 HydrophobicContact CB-CE1 4.13Å; M178-Y426 PolarHBondContact O-OH 3.46Å; M178-Y426 HydrophobicContact SD-CD1 4.26Å; M178-Y426 HydrophobicContact SD-CE1 4.13Å
179	A	87.6	Confident	88.6	Confident	9 Å²	9	37.5 Å²	37.5	7%	0.074	19%	0.188	C	C	.	.	H	α-helix	trans	-65.4	-32.4	174.2	0	0	0	0	0	112.2	G176 E177 F182 F183 L210	G176-A179 WeakPolarHBondContact O-CB 3.08Å; G176-A179 PolarHBondContact O-N 3.27Å; G176-A179 VanDerWaalsContact O-N 3.11Å; E177-A179 PolarHBondContact O-N 2.98Å; A179-F182 PolarHBondContact O-N 2.99Å; A179-F183 HydrophobicContact CB-CD2 3.9Å; A179-F183 HydrophobicContact CB-CE2 3.9Å; A179-F183 WeakPolarHBondContact O-CD2 3.44Å; A179-F183 PolarHBondContact O-N 2.86Å; A179-L210 HydrophobicContact CB-CB 4.07Å; A179-L210 HydrophobicContact CB-CD1 4.04Å
180	I	89.9	Confident	88.1	Confident	68 Å²	68	38 Å²	38	35%	0.349	19%	0.187	S	C	.	.	H	α-helix	trans	-60	-55.1	-174.2	-60.7	171.2	0	0	0	111.3	E177 M178 F182 F183 T184 M207 T211	E177-I180 PolarHBondContact O-N 3Å; M178-I180 VanDerWaalsContact C-N 3.28Å; M178-I180 PolarHBondContact O-N 3.44Å; I180-F182 VanDerWaalsContact C-N 3.33Å; I180-F182 PolarHBondContact O-N 3.33Å; I180-F183 PolarHBondContact O-N 3.43Å; I180-T184 WeakPolarHBondContact O-CB 3.47Å; I180-T184 PolarHBondContact O-N 2.88Å; I180-T184 PolarHBondContact O-OG1 3.25Å; I180-M207 HydrophobicContact CB-CE 4.37Å; I180-M207 HydrophobicContact CG1-CE 4.15Å; I180-M207 HydrophobicContact CG2-CE 3.93Å; I180-T211 HydrophobicContact CD1-CG2 3.73Å; I180-T211 HydrophobicContact CG1-CG2 3.53Å
181	P	91.2	Very high	87.7	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-42.3	176.8	-26.7	37	0	0	0	113.3	M178 T184 G185 S422 L425 Y426	M178-P181 WeakPolarHBondContact O-CD 3.36Å; P181-T184 PolarHBondContact O-N 3.03Å; P181-G185 PolarHBondContact O-N 3.45Å; P181-S422 PolarHBondContact O-OG 2.87Å; P181-L425 HydrophobicContact CB-CB 3.78Å; P181-L425 HydrophobicContact CB-CD1 4.22Å; P181-L425 HydrophobicContact CG-CB 4.12Å; P181-Y426 HydrophobicContact CB-CD1 3.7Å; P181-Y426 HydrophobicContact CB-CD2 4.38Å; P181-Y426 HydrophobicContact CB-CE1 3.48Å; P181-Y426 VanDerWaalsContact CB-CE1 3.48Å; P181-Y426 HydrophobicContact CB-CE2 4.19Å; P181-Y426 HydrophobicContact CB-CG 4.15Å; P181-Y426 HydrophobicContact CG-CD1 3.71Å; P181-Y426 HydrophobicContact CG-CE1 3.6Å
182	F	89.9	Confident	87.2	Confident	81 Å²	81	44.7 Å²	44.7	36%	0.355	22%	0.222	S	C	.	.	H	α-helix	trans	-59.7	-51.5	-179.9	-179	-100.5	0	0	0	112.8	A179 I180 T184 G185 R186 Y426	A179-F182 PolarHBondContact O-N 2.99Å; I180-F182 VanDerWaalsContact C-N 3.33Å; I180-F182 PolarHBondContact O-N 3.33Å; F182-T184 VanDerWaalsContact C-N 3.32Å; F182-T184 PolarHBondContact O-N 3.41Å; F182-G185 PolarHBondContact O-N 2.84Å; F182-R186 HydrophobicContact CE1-CG 4.27Å; F182-R186 HydrophobicContact CZ-CG 4.4Å; F182-R186 PolarHBondContact O-N 2.84Å; F182-Y426 WeakPolarHBondContact CB-OH 3.14Å
183	F	89.9	Confident	86.5	Confident	22 Å²	22	47 Å²	47	10%	0.096	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-33.6	178.8	-74.8	-67.4	0	0	0	111.7	A179 I180 G185 R186 I187 N203 L206 M207 L210	A179-F183 HydrophobicContact CB-CD2 3.9Å; A179-F183 HydrophobicContact CB-CE2 3.9Å; A179-F183 WeakPolarHBondContact O-CD2 3.44Å; A179-F183 PolarHBondContact O-N 2.86Å; I180-F183 PolarHBondContact O-N 3.43Å; F183-G185 PolarHBondContact O-N 2.87Å; F183-R186 PolarHBondContact O-N 3.41Å; F183-I187 WeakPolarHBondContact O-CB 3.42Å; F183-I187 VanDerWaalsContact O-CG1 3.26Å; F183-I187 WeakPolarHBondContact O-CG1 3.45Å; F183-I187 PolarHBondContact O-N 3.12Å; F183-N203 HydrophobicContact CD1-CB 4.14Å; F183-N203 HydrophobicContact CE1-CB 4.5Å; F183-L206 HydrophobicContact CE1-CB 4.22Å; F183-L206 HydrophobicContact CZ-CB 3.87Å; F183-M207 HydrophobicContact CB-CB 4.14Å; F183-M207 HydrophobicContact CB-CG 4.29Å; F183-M207 HydrophobicContact CB-SD 4.06Å; F183-M207 HydrophobicContact CD2-CB 3.83Å; F183-M207 HydrophobicContact CD2-CG 4.3Å; F183-M207 HydrophobicContact CE2-CB 4.48Å; F183-M207 HydrophobicContact CG-CB 4.01Å; F183-L210 HydrophobicContact CE2-CD1 3.68Å; F183-L210 HydrophobicContact CZ-CD1 4.18Å
184	T	89.9	Confident	85.1	Confident	45 Å²	45	51.5 Å²	51.5	28%	0.276	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-44.3	173.4	-53.9	0	0	0	0	111.5	I180 P181 F182 I187 T188 V421 L425	I180-T184 WeakPolarHBondContact O-CB 3.47Å; I180-T184 PolarHBondContact O-N 2.88Å; I180-T184 PolarHBondContact O-OG1 3.25Å; P181-T184 PolarHBondContact O-N 3.03Å; F182-T184 VanDerWaalsContact C-N 3.32Å; F182-T184 PolarHBondContact O-N 3.41Å; T184-I187 PolarHBondContact O-N 2.97Å; T184-T188 PolarHBondContact O-N 3.43Å; T184-T188 PolarHBondContact O-OG1 3.24Å; T184-V421 HydrophobicContact CG2-CG1 4.18Å; T184-L425 HydrophobicContact CG2-CD1 3.89Å
185	G	87.9	Confident	84	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-44.4	174.9	0	0	0	0	0	113	P181 F182 F183 I187 T188 D189 G418 S422	P181-G185 PolarHBondContact O-N 3.45Å; F182-G185 PolarHBondContact O-N 2.84Å; F183-G185 PolarHBondContact O-N 2.87Å; G185-I187 VanDerWaalsContact C-N 3.33Å; G185-I187 PolarHBondContact O-N 3.15Å; G185-T188 WeakPolarHBondContact O-CB 3.41Å; G185-T188 PolarHBondContact O-N 3.45Å; G185-T188 VanDerWaalsContact O-N 3.1Å; G185-D189 PolarHBondContact O-N 3.36Å; G185-G418 WeakPolarHBondContact CA-O 3.44Å; G185-G418 WeakPolarHBondContact O-CA 3.3Å; G185-S422 VanDerWaalsContact CA-OG 3.31Å; G185-S422 WeakPolarHBondContact CA-OG 3.14Å
186	R	86.3	Confident	83.3	Confident	136 Å²	136	60.3 Å²	60.3	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-41.5	175.6	-87	-78.4	173.1	98.5	-3.7	112.9	F182 F183 T188 W190	F182-R186 HydrophobicContact CE1-CG 4.27Å; F182-R186 HydrophobicContact CZ-CG 4.4Å; F182-R186 PolarHBondContact O-N 2.84Å; F183-R186 PolarHBondContact O-N 3.41Å; R186-T188 VanDerWaalsContact C-N 3.34Å; R186-W190 VanDerWaalsContact O-CB 3.28Å; R186-W190 WeakPolarHBondContact O-CB 3.49Å; R186-W190 PolarHBondContact O-N 3.45Å
187	I	87.2	Confident	82.6	Confident	29 Å²	29	64.9 Å²	64.9	15%	0.149	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-39.4	175	-71.3	165.2	0	0	0	110.6	F183 T184 G185 W190 I191 F200 I204	F183-I187 WeakPolarHBondContact O-CB 3.42Å; F183-I187 VanDerWaalsContact O-CG1 3.26Å; F183-I187 WeakPolarHBondContact O-CG1 3.45Å; F183-I187 PolarHBondContact O-N 3.12Å; T184-I187 PolarHBondContact O-N 2.97Å; G185-I187 VanDerWaalsContact C-N 3.33Å; G185-I187 PolarHBondContact O-N 3.15Å; I187-W190 PolarHBondContact O-N 2.91Å; I187-I191 HydrophobicContact CG2-CD1 3.85Å; I187-I191 HydrophobicContact CG2-CG1 4.34Å; I187-I191 VanDerWaalsContact O-CG1 3.32Å; I187-I191 WeakPolarHBondContact O-CG1 3.42Å; I187-I191 PolarHBondContact O-N 3.37Å; I187-F200 HydrophobicContact CG1-CE2 4.48Å; I187-F200 HydrophobicContact CG2-CD2 4.46Å; I187-F200 HydrophobicContact CG2-CE2 3.92Å; I187-I204 HydrophobicContact CD1-CG1 4.23Å
188	T	86.4	Confident	82.1	Confident	38 Å²	38	68 Å²	68	23%	0.233	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-48.3	177.2	-52.5	0	0	0	0	111.6	T184 G185 R186 W190 I191 L192 V421	T184-T188 PolarHBondContact O-N 3.43Å; T184-T188 PolarHBondContact O-OG1 3.24Å; G185-T188 WeakPolarHBondContact O-CB 3.41Å; G185-T188 PolarHBondContact O-N 3.45Å; G185-T188 VanDerWaalsContact O-N 3.1Å; R186-T188 VanDerWaalsContact C-N 3.34Å; T188-W190 VanDerWaalsContact C-N 3.3Å; T188-W190 PolarHBondContact O-N 3.4Å; T188-I191 PolarHBondContact O-N 3.34Å; T188-L192 HydrophobicContact CG2-CD1 4.12Å; T188-L192 WeakPolarHBondContact O-CD1 3.46Å; T188-L192 WeakPolarHBondContact O-CG 3.34Å; T188-L192 PolarHBondContact O-N 2.93Å; T188-V421 HydrophobicContact CG2-CG2 4.18Å
189	D	84.3	Confident	81.7	Confident	23 Å²	23	69.7 Å²	69.7	12%	0.123	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-38.4	176	-80.1	-23.1	0	0	0	111.6	G185 L192 Q193 S416 S417 G418	G185-D189 PolarHBondContact O-N 3.36Å; D189-L192 PolarHBondContact O-N 3.03Å; D189-Q193 WeakPolarHBondContact O-CB 3.39Å; D189-Q193 PolarHBondContact O-N 3.26Å; D189-S416 VanDerWaalsContact OD2-CB 3.3Å; D189-S416 WeakPolarHBondContact OD2-CB 3.33Å; D189-S416 PolarHBondContact OD2-OG 3.19Å; D189-S417 PolarHBondContact OD1-OG 2.63Å; D189-G418 VanDerWaalsContact CG-CA 3.47Å; D189-G418 VanDerWaalsContact CG-N 3.29Å; D189-G418 WeakPolarHBondContact OD1-CA 3.42Å; D189-G418 PolarHBondContact OD1-N 2.85Å; D189-G418 WeakPolarHBondContact OD2-CA 3.33Å; D189-G418 PolarHBondContact OD2-N 2.92Å
190	W	82.3	Confident	81.4	Confident	45 Å²	45	72.3 Å²	72.3	17%	0.17	37%	0.366	C	S	.	.	H	α-helix	trans	-62.6	-47.5	176.3	-178.5	83.4	0	0	0	112.3	R186 I187 T188 L192 Q193 D194 T196 F200	R186-W190 VanDerWaalsContact O-CB 3.28Å; R186-W190 WeakPolarHBondContact O-CB 3.49Å; R186-W190 PolarHBondContact O-N 3.45Å; I187-W190 PolarHBondContact O-N 2.91Å; T188-W190 VanDerWaalsContact C-N 3.3Å; T188-W190 PolarHBondContact O-N 3.4Å; W190-L192 PolarHBondContact O-N 3.41Å; W190-Q193 PolarHBondContact O-N 3.38Å; W190-D194 HydrophobicContact CG-CB 4.45Å; W190-D194 WeakPolarHBondContact CZ2-O 3.45Å; W190-D194 PolarHBondContact NE1-O 3.25Å; W190-D194 CarbonylContact O-C 3.49Å; W190-D194 PolarHBondContact O-N 3.16Å; W190-T196 VanDerWaalsContact CZ2-C 3.47Å; W190-T196 WeakPolarHBondContact CZ2-O 3.47Å; W190-T196 PolarHBondContact NE1-O 3.39Å; W190-F200 HydrophobicContact CD2-CB 4.23Å; W190-F200 HydrophobicContact CD2-CD2 4.2Å; W190-F200 HydrophobicContact CE3-CB 4.25Å; W190-F200 AromaticContact CE3-CD2 3.54Å; W190-F200 HydrophobicContact CE3-CD2 3.54Å; W190-F200 HydrophobicContact CE3-CE2 4.24Å; W190-F200 HydrophobicContact CE3-CG 4.23Å; W190-F200 HydrophobicContact CH2-CB 3.8Å; W190-F200 HydrophobicContact CH2-CD2 4.08Å; W190-F200 HydrophobicContact CH2-CG 4.01Å; W190-F200 HydrophobicContact CZ2-CB 3.75Å; W190-F200 HydrophobicContact CZ2-CG 4.44Å; W190-F200 HydrophobicContact CZ3-CB 4.05Å; W190-F200 AromaticContact CZ3-CD2 3.47Å; W190-F200 HydrophobicContact CZ3-CD2 3.47Å; W190-F200 VanDerWaalsContact CZ3-CD2 3.47Å; W190-F200 HydrophobicContact CZ3-CE2 4.04Å; W190-F200 AromaticContact CZ3-CG 3.88Å; W190-F200 HydrophobicContact CZ3-CG 3.88Å
191	I	82.3	Confident	81.1	Confident	113 Å²	113	72.2 Å²	72.2	58%	0.579	37%	0.368	S	S	*	.	H	α-helix	trans	-57.3	-35.1	176.7	-70.2	167.5	0	0	0	111.5	I187 T188	I187-I191 HydrophobicContact CG2-CD1 3.85Å; I187-I191 HydrophobicContact CG2-CG1 4.34Å; I187-I191 VanDerWaalsContact O-CG1 3.32Å; I187-I191 WeakPolarHBondContact O-CG1 3.42Å; I187-I191 PolarHBondContact O-N 3.37Å; T188-I191 PolarHBondContact O-N 3.34Å
192	L	77.8	Confident	80.8	Confident	113 Å²	113	79.3 Å²	79.3	59%	0.592	40%	0.395	S	S	*	.	H	α-helix	trans	-82.5	-27.9	-177.3	-69.2	166.9	0	0	0	113.6	T188 D189 W190 S417	T188-L192 HydrophobicContact CG2-CD1 4.12Å; T188-L192 WeakPolarHBondContact O-CD1 3.46Å; T188-L192 WeakPolarHBondContact O-CG 3.34Å; T188-L192 PolarHBondContact O-N 2.93Å; D189-L192 PolarHBondContact O-N 3.03Å; W190-L192 PolarHBondContact O-N 3.41Å; L192-S417 VanDerWaalsContact CD1-OG 3.24Å; L192-S417 WeakPolarHBondContact CD1-OG 3.25Å
193	Q	74.3	Confident	80.6	Confident	144 Å²	144	76.5 Å²	76.5	67%	0.673	38%	0.384	S	S	*	.	H	α-helix	trans	-121.9	-42.5	-170.2	-63.3	-176.1	-3.2	0	0	115.1	D189 W190	D189-Q193 WeakPolarHBondContact O-CB 3.39Å; D189-Q193 PolarHBondContact O-N 3.26Å; W190-Q193 PolarHBondContact O-N 3.38Å
194	D	64	Low	80.5	Confident	95 Å²	95	78.5 Å²	78.5	51%	0.508	40%	0.395	S	S	.	.			trans	-122.1	112.8	-167.8	-80.8	-31.5	0	0	0	111.4	W190 T196	W190-D194 HydrophobicContact CG-CB 4.45Å; W190-D194 WeakPolarHBondContact CZ2-O 3.45Å; W190-D194 PolarHBondContact NE1-O 3.25Å; W190-D194 CarbonylContact O-C 3.49Å; W190-D194 PolarHBondContact O-N 3.16Å; D194-T196 VanDerWaalsContact C-N 3.31Å; D194-T196 PolarHBondContact O-N 3.32Å
195	K	66.1	Low	80.5	Confident	200 Å²	200	84.8 Å²	84.8	87%	0.87	41%	0.414	S	S	*	.			trans	-88.5	28.6	-179.1	-63.7	-175.8	-179.8	179	0	114.5
196	T	72.5	Confident	80.6	Confident	68 Å²	68	88.5 Å²	88.5	42%	0.417	43%	0.433	S	S	.	.			trans	-94.9	110.3	-173.3	61.7	0	0	0	0	114.1	W190 D194 P198 S199	W190-T196 VanDerWaalsContact CZ2-C 3.47Å; W190-T196 WeakPolarHBondContact CZ2-O 3.47Å; W190-T196 PolarHBondContact NE1-O 3.39Å; D194-T196 VanDerWaalsContact C-N 3.31Å; D194-T196 PolarHBondContact O-N 3.32Å; T196-P198 VanDerWaalsContact C-CD 3.42Å; T196-S199 PolarHBondContact O-N 3.32Å
197	V	72.1	Confident	80.8	Confident	103 Å²	103	84.3 Å²	84.3	62%	0.624	42%	0.42	S	S	*	.	H	α-helix	trans	-51.3	-41.6	-176.5	-175.1	0	0	0	0	116.4	S199 F200 T201	V197-S199 PolarHBondContact O-N 3.14Å; V197-F200 PolarHBondContact O-N 2.96Å; V197-T201 PolarHBondContact O-N 3.2Å
198	P	76.5	Confident	80.9	Confident	93 Å²	93	85.2 Å²	85.2	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-72	-26.8	-172.3	24.4	-32.5	0	0	0	114.9	T196 T201 R202	T196-P198 VanDerWaalsContact C-CD 3.42Å; P198-T201 PolarHBondContact O-OG1 3.3Å; P198-T201 VanDerWaalsContact O-OG1 3.11Å; P198-R202 PolarHBondContact O-N 3.34Å
199	S	76.7	Confident	81.2	Confident	38 Å²	38	87.7 Å²	87.7	27%	0.266	44%	0.439	S	S	.	.	H	α-helix	trans	-72.7	-32.5	176.4	-67.1	0	0	0	0	112.1	T196 V197 N203	T196-S199 PolarHBondContact O-N 3.32Å; V197-S199 PolarHBondContact O-N 3.14Å; S199-N203 VanDerWaalsContact O-CG 3.29Å; S199-N203 PolarHBondContact O-N 3.17Å; S199-N203 VanDerWaalsContact O-N 3.17Å; S199-N203 PolarHBondContact O-ND2 2.88Å
200	F	81.3	Confident	81.5	Confident	64 Å²	64	89.9 Å²	89.9	28%	0.281	45%	0.451	S	S	.	.	H	α-helix	trans	-68.2	-49.2	177.8	179.1	-102.3	0	0	0	111.7	I187 W190 V197 R202 N203 I204	I187-F200 HydrophobicContact CG1-CE2 4.48Å; I187-F200 HydrophobicContact CG2-CD2 4.46Å; I187-F200 HydrophobicContact CG2-CE2 3.92Å; W190-F200 HydrophobicContact CD2-CB 4.23Å; W190-F200 HydrophobicContact CD2-CD2 4.2Å; W190-F200 HydrophobicContact CE3-CB 4.25Å; W190-F200 AromaticContact CE3-CD2 3.54Å; W190-F200 HydrophobicContact CE3-CD2 3.54Å; W190-F200 HydrophobicContact CE3-CE2 4.24Å; W190-F200 HydrophobicContact CE3-CG 4.23Å; W190-F200 HydrophobicContact CH2-CB 3.8Å; W190-F200 HydrophobicContact CH2-CD2 4.08Å; W190-F200 HydrophobicContact CH2-CG 4.01Å; W190-F200 HydrophobicContact CZ2-CB 3.75Å; W190-F200 HydrophobicContact CZ2-CG 4.44Å; W190-F200 HydrophobicContact CZ3-CB 4.05Å; W190-F200 AromaticContact CZ3-CD2 3.47Å; W190-F200 HydrophobicContact CZ3-CD2 3.47Å; W190-F200 VanDerWaalsContact CZ3-CD2 3.47Å; W190-F200 HydrophobicContact CZ3-CE2 4.04Å; W190-F200 AromaticContact CZ3-CG 3.88Å; W190-F200 HydrophobicContact CZ3-CG 3.88Å; V197-F200 PolarHBondContact O-N 2.96Å; F200-R202 VanDerWaalsContact C-N 3.33Å; F200-R202 PolarHBondContact O-N 3.2Å; F200-N203 PolarHBondContact O-N 3Å; F200-I204 HydrophobicContact CD1-CD1 3.85Å; F200-I204 HydrophobicContact CD2-CD1 4.41Å; F200-I204 HydrophobicContact CE1-CD1 3.29Å; F200-I204 HydrophobicContact CE2-CD1 3.92Å; F200-I204 HydrophobicContact CG-CD1 4.39Å; F200-I204 HydrophobicContact CZ-CD1 3.35Å; F200-I204 HydrophobicContact CZ-CG1 4.46Å; F200-I204 PolarHBondContact O-N 3.39Å
201	T	84.1	Confident	81.9	Confident	65 Å²	65	89.2 Å²	89.2	40%	0.399	45%	0.452	S	S	.	.	H	α-helix	trans	-62.1	-39.8	178.5	54	0	0	0	0	111.8	V197 P198 I204 W205	V197-T201 PolarHBondContact O-N 3.2Å; P198-T201 PolarHBondContact O-OG1 3.3Å; P198-T201 VanDerWaalsContact O-OG1 3.11Å; T201-I204 PolarHBondContact O-N 2.95Å; T201-W205 WeakPolarHBondContact O-CB 3.37Å; T201-W205 VanDerWaalsContact O-CD1 3.28Å; T201-W205 PolarHBondContact O-N 2.93Å
202	R	85.8	Confident	82.4	Confident	151 Å²	151	89.2 Å²	89.2	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-61.4	-45.1	175	-176	178.5	64.7	-164.7	-3.9	112.6	P198 F200 W205 L206	P198-R202 PolarHBondContact O-N 3.34Å; F200-R202 VanDerWaalsContact C-N 3.33Å; F200-R202 PolarHBondContact O-N 3.2Å; R202-W205 PolarHBondContact O-N 3.4Å; R202-L206 HydrophobicContact CG-CD1 4.15Å; R202-L206 WeakPolarHBondContact O-CB 3.22Å; R202-L206 WeakPolarHBondContact O-CG 3.41Å; R202-L206 PolarHBondContact O-N 3.27Å
203	N	86.3	Confident	83.2	Confident	21 Å²	21	87.2 Å²	87.2	11%	0.112	44%	0.444	C	S	.	.	H	α-helix	trans	-65.7	-39.4	179.8	-73.3	-22.9	0	0	0	111.9	F183 S199 F200 M207	F183-N203 HydrophobicContact CD1-CB 4.14Å; F183-N203 HydrophobicContact CE1-CB 4.5Å; S199-N203 VanDerWaalsContact O-CG 3.29Å; S199-N203 PolarHBondContact O-N 3.17Å; S199-N203 VanDerWaalsContact O-N 3.17Å; S199-N203 PolarHBondContact O-ND2 2.88Å; F200-N203 PolarHBondContact O-N 3Å; N203-M207 WeakPolarHBondContact O-CB 3.22Å; N203-M207 PolarHBondContact O-N 3.16Å
204	I	87.6	Confident	84.1	Confident	64 Å²	64	80.6 Å²	80.6	33%	0.328	41%	0.414	S	S	.	.	H	α-helix	trans	-65	-46.1	174.5	-70.2	179.1	0	0	0	110.9	I187 F200 T201 L206 M207 S208	I187-I204 HydrophobicContact CD1-CG1 4.23Å; F200-I204 HydrophobicContact CD1-CD1 3.85Å; F200-I204 HydrophobicContact CD2-CD1 4.41Å; F200-I204 HydrophobicContact CE1-CD1 3.29Å; F200-I204 HydrophobicContact CE2-CD1 3.92Å; F200-I204 HydrophobicContact CG-CD1 4.39Å; F200-I204 HydrophobicContact CZ-CD1 3.35Å; F200-I204 HydrophobicContact CZ-CG1 4.46Å; F200-I204 PolarHBondContact O-N 3.39Å; T201-I204 PolarHBondContact O-N 2.95Å; I204-L206 PolarHBondContact O-N 3Å; I204-M207 WeakPolarHBondContact O-CB 3.28Å; I204-M207 PolarHBondContact O-N 2.74Å; I204-S208 PolarHBondContact O-N 2.83Å; I204-S208 PolarHBondContact O-OG 2.8Å; I204-S208 VanDerWaalsContact O-OG 3.11Å
205	W	90	Very high	85.4	Confident	178 Å²	178	79.9 Å²	79.9	67%	0.674	41%	0.413	S	S	*	.	H	α-helix	trans	-59.3	-44.5	177.4	-93.3	106.5	0	0	0	112.5	T201 R202 S208 I209	T201-W205 WeakPolarHBondContact O-CB 3.37Å; T201-W205 VanDerWaalsContact O-CD1 3.28Å; T201-W205 PolarHBondContact O-N 2.93Å; R202-W205 PolarHBondContact O-N 3.4Å; W205-S208 PolarHBondContact O-N 3.23Å; W205-I209 HydrophobicContact CE3-CD1 4.28Å; W205-I209 HydrophobicContact CE3-CG1 4.44Å; W205-I209 VanDerWaalsContact O-CG1 3.29Å; W205-I209 WeakPolarHBondContact O-CG1 3.44Å; W205-I209 PolarHBondContact O-N 3.14Å
206	L	89.4	Confident	86.8	Confident	77 Å²	77	73.1 Å²	73.1	40%	0.403	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-44.7	176.1	-72.6	172.7	0	0	0	111.7	F183 R202 I204 I209 L210	F183-L206 HydrophobicContact CE1-CB 4.22Å; F183-L206 HydrophobicContact CZ-CB 3.87Å; R202-L206 HydrophobicContact CG-CD1 4.15Å; R202-L206 WeakPolarHBondContact O-CB 3.22Å; R202-L206 WeakPolarHBondContact O-CG 3.41Å; R202-L206 PolarHBondContact O-N 3.27Å; I204-L206 PolarHBondContact O-N 3Å; L206-I209 PolarHBondContact O-N 2.96Å; L206-L210 WeakPolarHBondContact O-CB 3.29Å; L206-L210 WeakPolarHBondContact O-CD1 3.35Å; L206-L210 WeakPolarHBondContact O-CG 3.45Å; L206-L210 PolarHBondContact O-N 3.09Å
207	M	89.1	Confident	87.8	Confident	48 Å²	48	71.5 Å²	71.5	24%	0.236	38%	0.383	C	S	.	.	H	α-helix	trans	-57.4	-49.6	174.6	178.6	-179.4	162.3	0	0	111	I180 F183 N203 I204 I209 L210 T211	I180-M207 HydrophobicContact CB-CE 4.37Å; I180-M207 HydrophobicContact CG1-CE 4.15Å; I180-M207 HydrophobicContact CG2-CE 3.93Å; F183-M207 HydrophobicContact CB-CB 4.14Å; F183-M207 HydrophobicContact CB-CG 4.29Å; F183-M207 HydrophobicContact CB-SD 4.06Å; F183-M207 HydrophobicContact CD2-CB 3.83Å; F183-M207 HydrophobicContact CD2-CG 4.3Å; F183-M207 HydrophobicContact CE2-CB 4.48Å; F183-M207 HydrophobicContact CG-CB 4.01Å; N203-M207 WeakPolarHBondContact O-CB 3.22Å; N203-M207 PolarHBondContact O-N 3.16Å; I204-M207 WeakPolarHBondContact O-CB 3.28Å; I204-M207 PolarHBondContact O-N 2.74Å; M207-I209 PolarHBondContact O-N 3.5Å; M207-L210 PolarHBondContact O-N 3.15Å; M207-T211 VanDerWaalsContact O-CG2 3.31Å; M207-T211 WeakPolarHBondContact O-CG2 3.31Å; M207-T211 PolarHBondContact O-N 3.09Å; M207-T211 PolarHBondContact O-OG1 3.43Å; M207-T211 VanDerWaalsContact O-OG1 3.1Å
208	S	89.9	Confident	88.7	Confident	48 Å²	48	68.4 Å²	68.4	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-47.8	179.1	-61.2	0	0	0	0	112.1	I204 W205 L210 T211 I212	I204-S208 PolarHBondContact O-N 2.83Å; I204-S208 PolarHBondContact O-OG 2.8Å; I204-S208 VanDerWaalsContact O-OG 3.11Å; W205-S208 PolarHBondContact O-N 3.23Å; S208-L210 PolarHBondContact O-N 3.28Å; S208-T211 WeakPolarHBondContact CA-OG1 3.28Å; S208-T211 PolarHBondContact O-N 3.45Å; S208-T211 PolarHBondContact O-OG1 3.28Å; S208-I212 VanDerWaalsContact O-CG1 3.29Å; S208-I212 WeakPolarHBondContact O-CG1 3.28Å; S208-I212 PolarHBondContact O-N 3.36Å
209	I	92.7	Very high	89.5	Confident	90 Å²	90	72.1 Å²	72.1	46%	0.462	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-44.3	179.2	-67.8	165.9	0	0	0	111.2	W205 L206 M207 I212 T213	W205-I209 HydrophobicContact CE3-CD1 4.28Å; W205-I209 HydrophobicContact CE3-CG1 4.44Å; W205-I209 VanDerWaalsContact O-CG1 3.29Å; W205-I209 WeakPolarHBondContact O-CG1 3.44Å; W205-I209 PolarHBondContact O-N 3.14Å; L206-I209 PolarHBondContact O-N 2.96Å; M207-I209 PolarHBondContact O-N 3.5Å; I209-I212 PolarHBondContact O-N 2.84Å; I209-T213 WeakPolarHBondContact O-CB 3.47Å; I209-T213 PolarHBondContact O-N 3.01Å; I209-T213 PolarHBondContact O-OG1 3.36Å
210	L	91.8	Very high	90.4	Very high	69 Å²	69	72.2 Å²	72.2	36%	0.361	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-39.3	177.9	-80.2	157.1	0	0	0	112.3	A179 F183 L206 M207 S208 T213 S214	A179-L210 HydrophobicContact CB-CB 4.07Å; A179-L210 HydrophobicContact CB-CD1 4.04Å; F183-L210 HydrophobicContact CE2-CD1 3.68Å; F183-L210 HydrophobicContact CZ-CD1 4.18Å; L206-L210 WeakPolarHBondContact O-CB 3.29Å; L206-L210 WeakPolarHBondContact O-CD1 3.35Å; L206-L210 WeakPolarHBondContact O-CG 3.45Å; L206-L210 PolarHBondContact O-N 3.09Å; M207-L210 PolarHBondContact O-N 3.15Å; S208-L210 PolarHBondContact O-N 3.28Å; L210-T213 PolarHBondContact O-N 3.1Å; L210-S214 WeakPolarHBondContact O-CB 3.47Å; L210-S214 PolarHBondContact O-N 2.79Å; L210-S214 PolarHBondContact O-OG 3.45Å
211	T	90.1	Very high	90.9	Very high	32 Å²	32	69.3 Å²	69.3	20%	0.196	36%	0.36	C	S	.	.	H	α-helix	trans	-69.1	-39.1	176.4	55.6	0	0	0	0	113.3	I180 M207 S208 T213 S214 T215	I180-T211 HydrophobicContact CD1-CG2 3.73Å; I180-T211 HydrophobicContact CG1-CG2 3.53Å; M207-T211 VanDerWaalsContact O-CG2 3.31Å; M207-T211 WeakPolarHBondContact O-CG2 3.31Å; M207-T211 PolarHBondContact O-N 3.09Å; M207-T211 PolarHBondContact O-OG1 3.43Å; M207-T211 VanDerWaalsContact O-OG1 3.1Å; S208-T211 WeakPolarHBondContact CA-OG1 3.28Å; S208-T211 PolarHBondContact O-N 3.45Å; S208-T211 PolarHBondContact O-OG1 3.28Å; T211-T213 VanDerWaalsContact C-N 3.35Å; T211-S214 VanDerWaalsContact CA-OG 3.29Å; T211-S214 WeakPolarHBondContact CA-OG 3.48Å; T211-S214 PolarHBondContact O-OG 2.94Å; T211-T215 WeakPolarHBondContact O-CG2 3.43Å; T211-T215 PolarHBondContact O-N 3.31Å; T211-T215 PolarHBondContact O-OG1 3.33Å
212	I	93.4	Very high	91.3	Very high	112 Å²	112	69.9 Å²	69.9	57%	0.574	36%	0.36	S	S	*	.	H	α-helix	trans	-68.8	-39.5	176.3	-66.3	166.9	0	0	0	110	S208 I209 T215 A216	S208-I212 VanDerWaalsContact O-CG1 3.29Å; S208-I212 WeakPolarHBondContact O-CG1 3.28Å; S208-I212 PolarHBondContact O-N 3.36Å; I209-I212 PolarHBondContact O-N 2.84Å; I212-T215 WeakPolarHBondContact CA-OG1 3.44Å; I212-T215 PolarHBondContact O-OG1 3.03Å; I212-A216 WeakPolarHBondContact O-CB 3.18Å; I212-A216 PolarHBondContact O-N 2.9Å
213	T	93.4	Very high	91.6	Very high	71 Å²	71	64.1 Å²	64.1	44%	0.436	35%	0.348	S	S	.	.	H	α-helix	trans	-67.9	-42.2	178.7	-53.2	0	0	0	0	111.3	I209 L210 T211 A216 L217	I209-T213 WeakPolarHBondContact O-CB 3.47Å; I209-T213 PolarHBondContact O-N 3.01Å; I209-T213 PolarHBondContact O-OG1 3.36Å; L210-T213 PolarHBondContact O-N 3.1Å; T211-T213 VanDerWaalsContact C-N 3.35Å; T213-A216 PolarHBondContact O-N 3.32Å; T213-L217 HydrophobicContact CG2-CD1 4.13Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.43Å; T213-L217 PolarHBondContact O-N 3.23Å
214	S	92.8	Very high	91.9	Very high	5 Å²	5	65.6 Å²	65.6	4%	0.035	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-46.2	176.8	41.4	0	0	0	0	112.3	S173 L210 T211 A216 L217 E218	S173-S214 WeakPolarHBondContact O-CB 3.25Å; L210-S214 WeakPolarHBondContact O-CB 3.47Å; L210-S214 PolarHBondContact O-N 2.79Å; L210-S214 PolarHBondContact O-OG 3.45Å; T211-S214 VanDerWaalsContact CA-OG 3.29Å; T211-S214 WeakPolarHBondContact CA-OG 3.48Å; T211-S214 PolarHBondContact O-OG 2.94Å; S214-A216 VanDerWaalsContact C-N 3.3Å; S214-A216 PolarHBondContact O-N 2.98Å; S214-L217 PolarHBondContact O-N 3.22Å; S214-L217 VanDerWaalsContact O-N 3.14Å; S214-E218 WeakPolarHBondContact O-CG 3.27Å; S214-E218 PolarHBondContact O-N 2.7Å
215	T	92	Very high	92.2	Very high	80 Å²	80	62.7 Å²	62.7	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-36.2	177.2	50.2	0	0	0	0	112.5	T211 I212 E218 F219	T211-T215 WeakPolarHBondContact O-CG2 3.43Å; T211-T215 PolarHBondContact O-N 3.31Å; T211-T215 PolarHBondContact O-OG1 3.33Å; I212-T215 WeakPolarHBondContact CA-OG1 3.44Å; I212-T215 PolarHBondContact O-OG1 3.03Å; T215-E218 PolarHBondContact O-N 2.79Å; T215-F219 WeakPolarHBondContact O-CB 3.32Å; T215-F219 PolarHBondContact O-N 3.34Å
216	A	94.6	Very high	92.3	Very high	58 Å²	58	58.7 Å²	58.7	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-39.5	173.4	0	0	0	0	0	112.7	I212 T213 S214 A220	I212-A216 WeakPolarHBondContact O-CB 3.18Å; I212-A216 PolarHBondContact O-N 2.9Å; T213-A216 PolarHBondContact O-N 3.32Å; S214-A216 VanDerWaalsContact C-N 3.3Å; S214-A216 PolarHBondContact O-N 2.98Å; A216-A220 WeakPolarHBondContact O-CB 3.16Å; A216-A220 PolarHBondContact O-N 3.39Å
217	L	93.8	Very high	92.3	Very high	34 Å²	34	59.8 Å²	59.8	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-38.9	175.5	-71.4	168.5	0	0	0	111.9	L169 L172 T213 S214 A220 S221	L169-L217 HydrophobicContact CD2-CD2 3.73Å; L172-L217 HydrophobicContact CB-CD1 4.23Å; L172-L217 HydrophobicContact CD2-CD1 3.68Å; L172-L217 HydrophobicContact CD2-CD2 4.23Å; L172-L217 HydrophobicContact CG-CD1 3.71Å; T213-L217 HydrophobicContact CG2-CD1 4.13Å; T213-L217 VanDerWaalsContact O-CG 3.23Å; T213-L217 WeakPolarHBondContact O-CG 3.43Å; T213-L217 PolarHBondContact O-N 3.23Å; S214-L217 PolarHBondContact O-N 3.22Å; S214-L217 VanDerWaalsContact O-N 3.14Å; L217-A220 PolarHBondContact O-N 3.32Å; L217-S221 VanDerWaalsContact O-CB 3.23Å; L217-S221 WeakPolarHBondContact O-CB 3.25Å; L217-S221 PolarHBondContact O-N 3.37Å
218	E	91.7	Very high	92.4	Very high	38 Å²	38	57.7 Å²	57.7	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-61.1	-51.1	173.5	-78.4	161.5	-159.2	0	0	111	S173 E177 S214 T215 A220 S221 D222	S173-E218 WeakPolarHBondContact OG-CG 3.48Å; S173-E218 PolarHBondContact OG-OE1 3.18Å; E177-E218 WeakPolarHBondContact CG-OE1 3.49Å; S214-E218 WeakPolarHBondContact O-CG 3.27Å; S214-E218 PolarHBondContact O-N 2.7Å; T215-E218 PolarHBondContact O-N 2.79Å; E218-A220 VanDerWaalsContact C-N 3.28Å; E218-A220 PolarHBondContact O-N 3.14Å; E218-S221 WeakPolarHBondContact O-CB 3.35Å; E218-S221 PolarHBondContact O-N 3.1Å; E218-S221 VanDerWaalsContact O-N 3.1Å; E218-D222 WeakPolarHBondContact O-CB 3.33Å; E218-D222 PolarHBondContact O-N 3.48Å
219	F	94.1	Very high	92.4	Very high	171 Å²	171	55.9 Å²	55.9	75%	0.75	31%	0.314	S	S	*	.	H	α-helix	trans	-57	-43.3	177.5	-179.2	-99.3	0	0	0	112	T215 G223	T215-F219 WeakPolarHBondContact O-CB 3.32Å; T215-F219 PolarHBondContact O-N 3.34Å; F219-G223 PolarHBondContact O-N 3.22Å
220	A	93.9	Very high	92.3	Very high	40 Å²	40	53.8 Å²	53.8	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-43.5	175.8	0	0	0	0	0	112.3	A216 L217 E218 G223 I224	A216-A220 WeakPolarHBondContact O-CB 3.16Å; A216-A220 PolarHBondContact O-N 3.39Å; L217-A220 PolarHBondContact O-N 3.32Å; E218-A220 VanDerWaalsContact C-N 3.28Å; E218-A220 PolarHBondContact O-N 3.14Å; A220-G223 PolarHBondContact O-N 3.45Å; A220-I224 WeakPolarHBondContact O-CB 3.33Å; A220-I224 WeakPolarHBondContact O-CD1 3.37Å; A220-I224 WeakPolarHBondContact O-CG1 3.21Å; A220-I224 PolarHBondContact O-N 2.97Å
221	S	92.8	Very high	92.1	Very high	3 Å²	3	55 Å²	55	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-49.7	178	-179.8	0	0	0	0	111.5	L217 E218 G223 I224 Y225	L217-S221 VanDerWaalsContact O-CB 3.23Å; L217-S221 WeakPolarHBondContact O-CB 3.25Å; L217-S221 PolarHBondContact O-N 3.37Å; E218-S221 WeakPolarHBondContact O-CB 3.35Å; E218-S221 PolarHBondContact O-N 3.1Å; E218-S221 VanDerWaalsContact O-N 3.1Å; S221-G223 PolarHBondContact O-N 3.18Å; S221-I224 PolarHBondContact O-N 3.17Å; S221-Y225 WeakPolarHBondContact O-CB 3.45Å; S221-Y225 PolarHBondContact O-N 3.1Å
222	D	92	Very high	92	Very high	77 Å²	77	53.7 Å²	53.7	41%	0.412	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-40.7	178.7	-78.3	-2.6	0	0	0	111.6	E218 Y225 N226	E218-D222 WeakPolarHBondContact O-CB 3.33Å; E218-D222 PolarHBondContact O-N 3.48Å; D222-Y225 PolarHBondContact O-N 3.4Å; D222-N226 WeakPolarHBondContact O-CB 3.32Å; D222-N226 PolarHBondContact O-N 3.14Å; D222-N226 PolarHBondContact O-ND2 3.04Å
223	G	92.6	Very high	91.7	Very high	31 Å²	31	51.6 Å²	51.6	32%	0.32	30%	0.297	S	S	.	.	H	α-helix	trans	-59.7	-47.5	174.1	0	0	0	0	0	112	F219 A220 S221 I227	F219-G223 PolarHBondContact O-N 3.22Å; A220-G223 PolarHBondContact O-N 3.45Å; S221-G223 PolarHBondContact O-N 3.18Å; G223-I227 WeakPolarHBondContact O-CB 3.34Å; G223-I227 WeakPolarHBondContact O-CD1 3.09Å; G223-I227 WeakPolarHBondContact O-CG1 3.17Å; G223-I227 PolarHBondContact O-N 3.19Å
224	I	92.8	Very high	91.5	Very high	51 Å²	51	50.1 Å²	50.1	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-38.9	178.8	-66.1	168.7	0	0	0	111.2	R162 L165 V166 L169 A220 S221 T228	R162-I224 HydrophobicContact CB-CG2 4.36Å; L165-I224 HydrophobicContact CD2-CD1 3.44Å; L165-I224 VanDerWaalsContact CD2-CD1 3.44Å; L165-I224 HydrophobicContact CD2-CG2 4.25Å; V166-I224 HydrophobicContact CG2-CB 4.15Å; V166-I224 HydrophobicContact CG2-CG2 3.76Å; L169-I224 HydrophobicContact CD1-CD1 4.07Å; A220-I224 WeakPolarHBondContact O-CB 3.33Å; A220-I224 WeakPolarHBondContact O-CD1 3.37Å; A220-I224 WeakPolarHBondContact O-CG1 3.21Å; A220-I224 PolarHBondContact O-N 2.97Å; S221-I224 PolarHBondContact O-N 3.17Å; I224-T228 VanDerWaalsContact O-CB 3.32Å; I224-T228 WeakPolarHBondContact O-CB 3.43Å; I224-T228 PolarHBondContact O-N 3.42Å; I224-T228 PolarHBondContact O-OG1 2.98Å
225	Y	92.9	Very high	91.3	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-55.5	176.4	-178	-95.4	0	0	0	111.1	L163 V166 S221 D222 I227 T228 M229 S276 S280 L283	L163-Y225 HydrophobicContact CD2-CD2 4.26Å; L163-Y225 HydrophobicContact CD2-CE2 4.29Å; V166-Y225 HydrophobicContact CG1-CD2 4.22Å; S221-Y225 WeakPolarHBondContact O-CB 3.45Å; S221-Y225 PolarHBondContact O-N 3.1Å; D222-Y225 PolarHBondContact O-N 3.4Å; Y225-I227 PolarHBondContact O-N 2.83Å; Y225-T228 WeakPolarHBondContact O-CA 3.32Å; Y225-T228 WeakPolarHBondContact O-CB 3.4Å; Y225-T228 PolarHBondContact O-N 3.35Å; Y225-M229 HydrophobicContact CE1-CB 4.48Å; Y225-M229 WeakPolarHBondContact O-CB 3.42Å; Y225-M229 PolarHBondContact O-N 2.99Å; Y225-S276 PolarHBondContact OH-O 2.93Å; Y225-S280 VanDerWaalsContact CE1-CB 3.47Å; Y225-S280 PolarHBondContact OH-N 3.14Å; Y225-L283 HydrophobicContact CE2-CD1 4.45Å
226	N	91.6	Very high	91.2	Very high	94 Å²	94	50.9 Å²	50.9	50%	0.503	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-41.3	-178.3	-76	-54.6	0	0	0	112.4	D222 T228 M229 G230	D222-N226 WeakPolarHBondContact O-CB 3.32Å; D222-N226 PolarHBondContact O-N 3.14Å; D222-N226 PolarHBondContact O-ND2 3.04Å; N226-T228 VanDerWaalsContact C-N 3.3Å; N226-T228 PolarHBondContact O-N 3.05Å; N226-M229 PolarHBondContact O-N 3.07Å; N226-G230 PolarHBondContact O-N 2.99Å
227	I	91.3	Very high	90.9	Very high	99 Å²	99	50 Å²	50	51%	0.508	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-38	174.1	-69	166.8	0	0	0	111.3	G223 Y225 H231	G223-I227 WeakPolarHBondContact O-CB 3.34Å; G223-I227 WeakPolarHBondContact O-CD1 3.09Å; G223-I227 WeakPolarHBondContact O-CG1 3.17Å; G223-I227 PolarHBondContact O-N 3.19Å; Y225-I227 PolarHBondContact O-N 2.83Å; I227-H231 PolarHBondContact O-N 3.48Å; I227-H231 PolarHBondContact O-ND1 3.15Å
228	T	91.1	Very high	90.8	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-70	-41	178.8	-58.8	0	0	0	0	110.8	L156 K159 I224 Y225 N226 H231 M232	L156-T228 HydrophobicContact CD2-CG2 3.78Å; K159-T228 HydrophobicContact CB-CG2 4.39Å; I224-T228 VanDerWaalsContact O-CB 3.32Å; I224-T228 WeakPolarHBondContact O-CB 3.43Å; I224-T228 PolarHBondContact O-N 3.42Å; I224-T228 PolarHBondContact O-OG1 2.98Å; Y225-T228 WeakPolarHBondContact O-CA 3.32Å; Y225-T228 WeakPolarHBondContact O-CB 3.4Å; Y225-T228 PolarHBondContact O-N 3.35Å; N226-T228 VanDerWaalsContact C-N 3.3Å; N226-T228 PolarHBondContact O-N 3.05Å; T228-H231 PolarHBondContact O-N 3.36Å; T228-M232 PolarHBondContact O-N 2.91Å
229	M	89.4	Confident	90.7	Very high	11 Å²	11	56.1 Å²	56.1	5%	0.054	30%	0.297	C	S	.	.	H	α-helix	trans	-73.8	-35.4	-178.8	-149.1	52	163.4	0	0	112.7	Y225 N226 H231 M232 H233 I275 S276 L279	Y225-M229 HydrophobicContact CE1-CB 4.48Å; Y225-M229 WeakPolarHBondContact O-CB 3.42Å; Y225-M229 PolarHBondContact O-N 2.99Å; N226-M229 PolarHBondContact O-N 3.07Å; M229-H231 VanDerWaalsContact C-N 3.3Å; M229-H231 PolarHBondContact O-N 3.48Å; M229-M232 HydrophobicContact CE-CE 3.26Å; M229-M232 HydrophobicContact CE-SD 3.88Å; M229-M232 HydrophobicContact CG-CE 4.44Å; M229-M232 WeakPolarHBondContact O-CA 3.49Å; M229-M232 WeakPolarHBondContact O-CB 3.45Å; M229-M232 PolarHBondContact O-N 3.32Å; M229-M232 HydrophobicContact SD-CB 4.21Å; M229-M232 HydrophobicContact SD-CE 3.44Å; M229-M232 WeakPolarHBondContact SD-CE 3.44Å; M229-M232 HydrophobicContact SD-SD 3.65Å; M229-M232 VanDerWaalsContact SD-SD 3.65Å; M229-H233 PolarHBondContact O-N 3.22Å; M229-I275 HydrophobicContact CE-CG2 4.32Å; M229-S276 VanDerWaalsContact CG-CB 3.45Å; M229-S276 WeakPolarHBondContact CG-OG 3.36Å; M229-L279 HydrophobicContact CE-CD2 4.44Å
230	G	89.5	Confident	90.5	Very high	46 Å²	46	48 Å²	48	47%	0.474	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-36.7	172	0	0	0	0	0	113.1	N226 H233 G234	N226-G230 PolarHBondContact O-N 2.99Å; G230-H233 PolarHBondContact O-N 3.42Å; G230-G234 PolarHBondContact O-N 2.7Å; G230-G234 VanDerWaalsContact O-N 3.1Å
231	H	87.9	Confident	90.4	Very high	93 Å²	93	51.7 Å²	51.7	43%	0.431	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-36	171.7	-70.5	126.2	0	0	0	113	K159 I227 T228 M229 R235	K159-H231 PolarHBondContact NZ-CD2 3.39Å; K159-H231 PolarHBondContact NZ-CE1 3.03Å; K159-H231 VanDerWaalsContact NZ-CE1 3.28Å; K159-H231 PolarHBondContact NZ-ND1 3.36Å; K159-H231 PolarHBondContact NZ-NE2 3.15Å; I227-H231 PolarHBondContact O-N 3.48Å; I227-H231 PolarHBondContact O-ND1 3.15Å; T228-H231 PolarHBondContact O-N 3.36Å; M229-H231 VanDerWaalsContact C-N 3.3Å; M229-H231 PolarHBondContact O-N 3.48Å; H231-R235 WeakPolarHBondContact O-CB 3.33Å; H231-R235 PolarHBondContact O-N 3.11Å; H231-R235 VanDerWaalsContact O-N 3.14Å
232	M	87.7	Confident	90.3	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-47.4	175.4	-171.1	-166	76.4	0	0	110.1	F155 L156 T228 M229 G234 R235 V236	F155-M232 HydrophobicContact CB-CG 4.07Å; L156-M232 HydrophobicContact CD1-CG 4.23Å; L156-M232 HydrophobicContact CD1-SD 3.52Å; L156-M232 VanDerWaalsContact CD1-SD 3.52Å; L156-M232 HydrophobicContact CG-CG 4.44Å; L156-M232 HydrophobicContact CG-SD 4.26Å; T228-M232 PolarHBondContact O-N 2.91Å; M229-M232 HydrophobicContact CE-CE 3.26Å; M229-M232 HydrophobicContact CE-SD 3.88Å; M229-M232 HydrophobicContact CG-CE 4.44Å; M229-M232 WeakPolarHBondContact O-CA 3.49Å; M229-M232 WeakPolarHBondContact O-CB 3.45Å; M229-M232 PolarHBondContact O-N 3.32Å; M229-M232 HydrophobicContact SD-CB 4.21Å; M229-M232 HydrophobicContact SD-CE 3.44Å; M229-M232 WeakPolarHBondContact SD-CE 3.44Å; M229-M232 HydrophobicContact SD-SD 3.65Å; M229-M232 VanDerWaalsContact SD-SD 3.65Å; M232-G234 PolarHBondContact O-N 3.29Å; M232-R235 PolarHBondContact O-N 3.49Å; M232-R235 VanDerWaalsContact O-N 3.13Å; M232-V236 HydrophobicContact CG-CG2 4.36Å; M232-V236 WeakPolarHBondContact O-CG2 3.34Å; M232-V236 PolarHBondContact O-N 3.09Å
233	H	88.9	Confident	90.2	Very high	68 Å²	68	54.7 Å²	54.7	32%	0.315	28%	0.28	S	S	.	.	H	α-helix	trans	-53.4	-52.8	177.3	-175.5	110.4	0	0	0	111.4	M229 G230 R235 V236 H237 C272	M229-H233 PolarHBondContact O-N 3.22Å; G230-H233 PolarHBondContact O-N 3.42Å; H233-R235 VanDerWaalsContact C-N 3.31Å; H233-R235 PolarHBondContact O-N 3.08Å; H233-V236 PolarHBondContact O-N 3.4Å; H233-H237 AromaticContact CD2-CD2 3.4Å; H233-H237 PolarHBondContact CD2-CD2 3.3Å; H233-H237 AromaticContact CD2-NE2 3.9Å; H233-H237 AromaticContact CE1-CD2 3.88Å; H233-H237 AromaticContact CE1-NE2 3.6Å; H233-H237 AromaticContact NE2-CD2 3.24Å; H233-H237 PolarHBondContact NE2-CD2 3.22Å; H233-H237 AromaticContact NE2-NE2 3.23Å; H233-H237 PolarHBondContact NE2-NE2 2.99Å; H233-H237 PolarHBondContact O-CD2 3.42Å; H233-H237 PolarHBondContact O-N 2.95Å; H233-C272 HydrophobicContact CB-CB 4.45Å; H233-C272 WeakPolarHBondContact ND1-CB 3.28Å
234	G	88.3	Confident	90.1	Very high	41 Å²	41	53.7 Å²	53.7	42%	0.423	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-35.6	178.3	0	0	0	0	0	113.8	G230 M232 R238	G230-G234 PolarHBondContact O-N 2.7Å; G230-G234 VanDerWaalsContact O-N 3.1Å; M232-G234 PolarHBondContact O-N 3.29Å; G234-R238 WeakPolarHBondContact O-CB 3.17Å; G234-R238 PolarHBondContact O-N 3.1Å; G234-R238 VanDerWaalsContact O-N 3.12Å
235	R	89.6	Confident	89.9	Confident	98 Å²	98	56.4 Å²	56.4	37%	0.37	28%	0.281	S	S	.	.	H	α-helix	trans	-68.9	-44.9	176.8	-170.4	-179.7	-176.3	178.1	2.6	111.7	F155 H231 M232 H233 R238 E239	F155-R235 WeakPolarHBondContact O-CD 3.29Å; F155-R235 PolarHBondContact O-NH1 2.8Å; H231-R235 WeakPolarHBondContact O-CB 3.33Å; H231-R235 PolarHBondContact O-N 3.11Å; H231-R235 VanDerWaalsContact O-N 3.14Å; M232-R235 PolarHBondContact O-N 3.49Å; M232-R235 VanDerWaalsContact O-N 3.13Å; H233-R235 VanDerWaalsContact C-N 3.31Å; H233-R235 PolarHBondContact O-N 3.08Å; R235-R238 PolarHBondContact O-N 2.91Å; R235-E239 HydrophobicContact CG-CG 4.49Å; R235-E239 WeakPolarHBondContact O-CG 3.42Å; R235-E239 PolarHBondContact O-N 2.9Å
236	V	88.8	Confident	89.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-50.5	178.4	172.5	0	0	0	0	110	F155 M232 H233 R238 E239 V240 T268 M271	F155-V236 HydrophobicContact CB-CG2 4.11Å; F155-V236 HydrophobicContact CD1-CG2 4.26Å; F155-V236 HydrophobicContact CD2-CG2 4.04Å; F155-V236 HydrophobicContact CG-CG2 3.88Å; M232-V236 HydrophobicContact CG-CG2 4.36Å; M232-V236 WeakPolarHBondContact O-CG2 3.34Å; M232-V236 PolarHBondContact O-N 3.09Å; H233-V236 PolarHBondContact O-N 3.4Å; V236-R238 VanDerWaalsContact C-N 3.27Å; V236-R238 PolarHBondContact O-N 2.91Å; V236-E239 PolarHBondContact O-N 3.22Å; V236-V240 HydrophobicContact CG1-CG2 4.06Å; V236-V240 WeakPolarHBondContact O-CB 3.33Å; V236-V240 VanDerWaalsContact O-CG2 3.27Å; V236-V240 WeakPolarHBondContact O-CG2 3.33Å; V236-V240 PolarHBondContact O-N 2.96Å; V236-T268 HydrophobicContact CG1-CG2 3.83Å; V236-M271 HydrophobicContact CG1-CE 3.98Å
237	H	89.3	Confident	89.5	Confident	40 Å²	40	58.4 Å²	58.4	19%	0.185	28%	0.283	C	S	.	.	H	α-helix	trans	-55.3	-43	176.6	-90.1	-81.9	0	0	0	112.6	H233 F241 V264 T265 A269	H233-H237 AromaticContact CD2-CD2 3.4Å; H233-H237 PolarHBondContact CD2-CD2 3.3Å; H233-H237 AromaticContact CD2-NE2 3.9Å; H233-H237 AromaticContact CE1-CD2 3.88Å; H233-H237 AromaticContact CE1-NE2 3.6Å; H233-H237 AromaticContact NE2-CD2 3.24Å; H233-H237 PolarHBondContact NE2-CD2 3.22Å; H233-H237 AromaticContact NE2-NE2 3.23Å; H233-H237 PolarHBondContact NE2-NE2 2.99Å; H233-H237 PolarHBondContact O-CD2 3.42Å; H233-H237 PolarHBondContact O-N 2.95Å; H237-F241 WeakPolarHBondContact O-CB 3.44Å; H237-F241 PolarHBondContact O-N 3.07Å; H237-V264 PolarHBondContact CE1-O 3.29Å; H237-V264 VanDerWaalsContact CE1-O 3.3Å; H237-V264 PolarHBondContact ND1-O 3.08Å; H237-T265 PolarHBondContact CE1-O 2.95Å; H237-A269 PolarHBondContact NE2-N 2.98Å
238	R	90.3	Very high	89.3	Confident	153 Å²	153	55.7 Å²	55.7	58%	0.577	27%	0.268	S	S	*	.	H	α-helix	trans	-64.9	-45.7	178.9	-172.1	-173.7	67.9	173.4	4.7	112.6	G234 R235 V236 R242	G234-R238 WeakPolarHBondContact O-CB 3.17Å; G234-R238 PolarHBondContact O-N 3.1Å; G234-R238 VanDerWaalsContact O-N 3.12Å; R235-R238 PolarHBondContact O-N 2.91Å; V236-R238 VanDerWaalsContact C-N 3.27Å; V236-R238 PolarHBondContact O-N 2.91Å; R238-R242 WeakPolarHBondContact O-CB 3.34Å; R238-R242 PolarHBondContact O-N 2.85Å
239	E	89.8	Confident	89.1	Confident	47 Å²	47	57.6 Å²	57.6	22%	0.22	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-39.1	179.6	-62.2	-54.7	149.1	0	0	111.6	F155 R235 V236 R242 A243 L458	F155-E239 HydrophobicContact CE1-CB 4.47Å; F155-E239 HydrophobicContact CE1-CG 4.31Å; R235-E239 HydrophobicContact CG-CG 4.49Å; R235-E239 WeakPolarHBondContact O-CG 3.42Å; R235-E239 PolarHBondContact O-N 2.9Å; V236-E239 PolarHBondContact O-N 3.22Å; E239-R242 PolarHBondContact O-N 2.72Å; E239-A243 WeakPolarHBondContact O-CB 3.45Å; E239-A243 PolarHBondContact O-N 2.93Å; E239-L458 HydrophobicContact CB-CD2 4.18Å
240	V	90.9	Very high	88.9	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-50.4	175.5	172.4	0	0	0	0	110.4	V236 R242 A243 V244 V264 T268 I454 L458	V236-V240 HydrophobicContact CG1-CG2 4.06Å; V236-V240 WeakPolarHBondContact O-CB 3.33Å; V236-V240 VanDerWaalsContact O-CG2 3.27Å; V236-V240 WeakPolarHBondContact O-CG2 3.33Å; V236-V240 PolarHBondContact O-N 2.96Å; V240-R242 VanDerWaalsContact C-N 3.29Å; V240-R242 PolarHBondContact O-N 3.38Å; V240-A243 PolarHBondContact O-N 3.43Å; V240-A243 VanDerWaalsContact O-N 3.15Å; V240-V244 WeakPolarHBondContact O-CG2 3.38Å; V240-V244 PolarHBondContact O-N 3.04Å; V240-V264 HydrophobicContact CG1-CG1 4.22Å; V240-V264 HydrophobicContact CG1-CG2 4.12Å; V240-T268 HydrophobicContact CG2-CG2 4.35Å; V240-I454 HydrophobicContact CG2-CG2 3.65Å; V240-L458 HydrophobicContact CB-CD2 4.47Å; V240-L458 HydrophobicContact CG2-CD1 3.89Å; V240-L458 HydrophobicContact CG2-CD2 3.92Å; V240-L458 HydrophobicContact CG2-CG 3.92Å
241	F	91.3	Very high	88.8	Confident	117 Å²	117	55.4 Å²	55.4	51%	0.513	26%	0.258	S	S	.	.	H	α-helix	trans	-59.7	-41.5	177.5	-175.3	-109.6	0	0	0	111.7	H237 V244 L245 V264	H237-F241 WeakPolarHBondContact O-CB 3.44Å; H237-F241 PolarHBondContact O-N 3.07Å; F241-V244 PolarHBondContact O-N 2.99Å; F241-L245 HydrophobicContact CD1-CD1 3.87Å; F241-L245 HydrophobicContact CD1-CG 4.49Å; F241-L245 HydrophobicContact CE1-CD1 3.41Å; F241-L245 VanDerWaalsContact CE1-CD1 3.41Å; F241-L245 HydrophobicContact CE1-CG 4.21Å; F241-L245 HydrophobicContact CZ-CD1 3.81Å; F241-L245 HydrophobicContact CZ-CD2 4.43Å; F241-L245 HydrophobicContact CZ-CG 4.24Å; F241-L245 WeakPolarHBondContact O-CG 3.29Å; F241-L245 PolarHBondContact O-N 2.85Å; F241-V264 HydrophobicContact CB-CG1 4.3Å; F241-V264 HydrophobicContact CD2-CG1 4.15Å
242	R	90.6	Very high	88.8	Confident	123 Å²	123	55.1 Å²	55.1	46%	0.464	26%	0.255	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.6	-173.3	-176.6	-171.7	-177.2	5.8	112.7	R238 E239 V240 R246	R238-R242 WeakPolarHBondContact O-CB 3.34Å; R238-R242 PolarHBondContact O-N 2.85Å; E239-R242 PolarHBondContact O-N 2.72Å; V240-R242 VanDerWaalsContact C-N 3.29Å; V240-R242 PolarHBondContact O-N 3.38Å; R242-R246 VanDerWaalsContact NH2-NH2 3.12Å; R242-R246 WeakPolarHBondContact O-CG 3.45Å; R242-R246 PolarHBondContact O-N 3.49Å
243	A	89.7	Confident	88.6	Confident	20 Å²	20	58.8 Å²	58.8	17%	0.165	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-45.5	177.5	0	0	0	0	0	110.9	E239 V240 L245 R246 Q247 L458	E239-A243 WeakPolarHBondContact O-CB 3.45Å; E239-A243 PolarHBondContact O-N 2.93Å; V240-A243 PolarHBondContact O-N 3.43Å; V240-A243 VanDerWaalsContact O-N 3.15Å; A243-L245 PolarHBondContact O-N 3.04Å; A243-R246 PolarHBondContact O-N 3.47Å; A243-R246 VanDerWaalsContact O-N 3.1Å; A243-Q247 PolarHBondContact O-N 3.3Å; A243-L458 HydrophobicContact CB-CD2 3.99Å
244	V	90.4	Very high	88.3	Confident	9 Å²	9	61.4 Å²	61.4	6%	0.055	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-45.7	175.6	175.4	0	0	0	0	111.6	V240 F241 R246 Q247 F252 I260 V264 Y457	V240-V244 WeakPolarHBondContact O-CG2 3.38Å; V240-V244 PolarHBondContact O-N 3.04Å; F241-V244 PolarHBondContact O-N 2.99Å; V244-R246 PolarHBondContact O-N 2.86Å; V244-Q247 WeakPolarHBondContact O-CB 3.23Å; V244-Q247 PolarHBondContact O-N 2.92Å; V244-Q247 VanDerWaalsContact O-N 3.08Å; V244-F252 HydrophobicContact CG1-CE1 3.95Å; V244-F252 HydrophobicContact CG1-CZ 3.93Å; V244-F252 WeakPolarHBondContact O-CZ 3.45Å; V244-I260 HydrophobicContact CG1-CG2 3.59Å; V244-V264 HydrophobicContact CB-CG2 4.47Å; V244-V264 HydrophobicContact CG2-CG2 3.63Å; V244-Y457 HydrophobicContact CG2-CD1 3.94Å
245	L	88.5	Confident	88.1	Confident	108 Å²	108	61.1 Å²	61.1	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-65.1	-19.8	178.3	-72	-179.4	0	0	0	114.3	F241 A243 Q247	F241-L245 HydrophobicContact CD1-CD1 3.87Å; F241-L245 HydrophobicContact CD1-CG 4.49Å; F241-L245 HydrophobicContact CE1-CD1 3.41Å; F241-L245 VanDerWaalsContact CE1-CD1 3.41Å; F241-L245 HydrophobicContact CE1-CG 4.21Å; F241-L245 HydrophobicContact CZ-CD1 3.81Å; F241-L245 HydrophobicContact CZ-CD2 4.43Å; F241-L245 HydrophobicContact CZ-CG 4.24Å; F241-L245 WeakPolarHBondContact O-CG 3.29Å; F241-L245 PolarHBondContact O-N 2.85Å; A243-L245 PolarHBondContact O-N 3.04Å; L245-Q247 VanDerWaalsContact C-N 3.34Å
246	R	87.6	Confident	87.8	Confident	125 Å²	125	60.8 Å²	60.8	47%	0.472	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.7	176	-76.6	174.8	167.6	-168.9	-8.5	113.1	R242 A243 V244 L466	R242-R246 VanDerWaalsContact NH2-NH2 3.12Å; R242-R246 WeakPolarHBondContact O-CG 3.45Å; R242-R246 PolarHBondContact O-N 3.49Å; A243-R246 PolarHBondContact O-N 3.47Å; A243-R246 VanDerWaalsContact O-N 3.1Å; V244-R246 PolarHBondContact O-N 2.86Å; R246-L466 HydrophobicContact CB-CD1 3.87Å; R246-L466 HydrophobicContact CG-CD1 4.13Å; R246-L466 WeakPolarHBondContact O-CD1 3.22Å
247	Q	88.3	Confident	87.6	Confident	15 Å²	15	64.1 Å²	64.1	7%	0.07	31%	0.313	C	S	.	.	S	Bend	trans	-76.1	150.6	-178.8	-156.9	59.5	33.6	0	0	111.6	A243 V244 L245 F251 F252 R460	A243-Q247 PolarHBondContact O-N 3.3Å; V244-Q247 WeakPolarHBondContact O-CB 3.23Å; V244-Q247 PolarHBondContact O-N 2.92Å; V244-Q247 VanDerWaalsContact O-N 3.08Å; L245-Q247 VanDerWaalsContact C-N 3.34Å; Q247-F251 HydrophobicContact CB-CB 4.17Å; Q247-F251 HydrophobicContact CB-CD1 4.1Å; Q247-F251 HydrophobicContact CB-CG 4.16Å; Q247-F251 HydrophobicContact CG-CB 3.34Å; Q247-F251 HydrophobicContact CG-CD1 3.81Å; Q247-F251 HydrophobicContact CG-CD2 3.86Å; Q247-F251 HydrophobicContact CG-CG 3.38Å; Q247-F252 HydrophobicContact CB-CE2 4.37Å; Q247-R460 VanDerWaalsContact CD-NE 3.3Å
248	E	87.1	Confident	87.3	Confident	42 Å²	42	64.9 Å²	64.9	20%	0.196	33%	0.331	C	S	.	.			trans	-58	150	175.1	64	-83.6	159.6	0	0	113	G250 F251 R460 P462 C463	E248-G250 PolarHBondContact O-N 3Å; E248-G250 VanDerWaalsContact O-N 3.14Å; E248-F251 HydrophobicContact CG-CB 4.45Å; E248-F251 WeakPolarHBondContact O-CB 3.42Å; E248-F251 PolarHBondContact O-N 3.19Å; E248-R460 IonicContact OE1-CZ 3.16Å; E248-R460 IonicContact OE1-NE 3.02Å; E248-R460 IonicContact OE1-NH2 3.49Å; E248-R460 PolarHBondContact OE1-NH2 3.36Å; E248-P462 VanDerWaalsContact OE2-CA 3.26Å; E248-P462 WeakPolarHBondContact OE2-CA 3.44Å; E248-C463 PolarHBondContact OE2-N 3.08Å
249	T	87.3	Confident	86.9	Confident	45 Å²	45	59.3 Å²	59.3	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-53.6	-33.8	174.3	50.3	0	0	0	0	113	F251 F252 L253 L530 Y531	T249-F251 PolarHBondContact O-N 3.22Å; T249-F252 PolarHBondContact O-N 3.27Å; T249-L253 PolarHBondContact O-N 2.92Å; T249-L530 HydrophobicContact CG2-CB 4.24Å; T249-L530 HydrophobicContact CG2-CD2 4.15Å; T249-L530 PolarHBondContact OG1-O 3.38Å; T249-Y531 VanDerWaalsContact OG1-CE1 3.26Å; T249-Y531 WeakPolarHBondContact OG1-CE1 3.26Å
250	G	85	Confident	86.8	Confident	4 Å²	4	57.5 Å²	57.5	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-23.8	175	0	0	0	0	0	114.3	E248 K254	E248-G250 PolarHBondContact O-N 3Å; E248-G250 VanDerWaalsContact O-N 3.14Å; G250-K254 PolarHBondContact O-N 3.05Å
251	F	86.8	Confident	86.7	Confident	7 Å²	7	61.4 Å²	61.4	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-68	-42.6	172.3	175.9	-97.7	0	0	0	112	Q247 E248 T249 L253 K254 N255 I260 Y457	Q247-F251 HydrophobicContact CB-CB 4.17Å; Q247-F251 HydrophobicContact CB-CD1 4.1Å; Q247-F251 HydrophobicContact CB-CG 4.16Å; Q247-F251 HydrophobicContact CG-CB 3.34Å; Q247-F251 HydrophobicContact CG-CD1 3.81Å; Q247-F251 HydrophobicContact CG-CD2 3.86Å; Q247-F251 HydrophobicContact CG-CG 3.38Å; E248-F251 HydrophobicContact CG-CB 4.45Å; E248-F251 WeakPolarHBondContact O-CB 3.42Å; E248-F251 PolarHBondContact O-N 3.19Å; T249-F251 PolarHBondContact O-N 3.22Å; F251-L253 VanDerWaalsContact C-N 3.3Å; F251-L253 PolarHBondContact O-N 2.82Å; F251-K254 PolarHBondContact O-N 2.88Å; F251-N255 WeakPolarHBondContact CD2-ND2 3.44Å; F251-N255 HydrophobicContact CE1-CB 4.41Å; F251-N255 WeakPolarHBondContact CE2-ND2 3.2Å; F251-N255 HydrophobicContact CZ-CB 4.28Å; F251-N255 WeakPolarHBondContact CZ-ND2 3.24Å; F251-N255 PolarHBondContact O-N 3.03Å; F251-N255 PolarHBondContact O-ND2 3.18Å; F251-I260 HydrophobicContact CD1-CD1 4.29Å; F251-I260 HydrophobicContact CE1-CD1 3.76Å; F251-I260 HydrophobicContact CE1-CG1 4.19Å; F251-Y457 AromaticContact CE1-CE1 3.91Å; F251-Y457 HydrophobicContact CE1-CE1 3.91Å; F251-Y457 HydrophobicContact CE2-CE1 4.26Å; F251-Y457 HydrophobicContact CZ-CD1 4.01Å; F251-Y457 AromaticContact CZ-CE1 3.3Å; F251-Y457 HydrophobicContact CZ-CE1 3.3Å
252	F	88.2	Confident	86.4	Confident	86 Å²	86	57.8 Å²	57.8	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-72.5	-22.8	178.6	-63	-85	0	0	0	112.8	V244 Q247 T249 I260	V244-F252 HydrophobicContact CG1-CE1 3.95Å; V244-F252 HydrophobicContact CG1-CZ 3.93Å; V244-F252 WeakPolarHBondContact O-CZ 3.45Å; Q247-F252 HydrophobicContact CB-CE2 4.37Å; T249-F252 PolarHBondContact O-N 3.27Å; F252-I260 HydrophobicContact CD1-CD1 3.43Å; F252-I260 VanDerWaalsContact CD1-CD1 3.43Å; F252-I260 HydrophobicContact CE1-CD1 3.8Å; F252-I260 HydrophobicContact CG-CD1 4.37Å
253	L	83.9	Confident	86.1	Confident	83 Å²	83	55.9 Å²	55.9	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-70.8	-34.4	169.2	-75.3	179.6	0	0	0	112.9	T249 F251 Y488 Y531	T249-L253 PolarHBondContact O-N 2.92Å; F251-L253 VanDerWaalsContact C-N 3.3Å; F251-L253 PolarHBondContact O-N 2.82Å; L253-Y488 HydrophobicContact CD1-CD1 4.02Å; L253-Y531 HydrophobicContact CD1-CE1 3.93Å; L253-Y531 WeakPolarHBondContact CD1-OH 3.38Å
254	K	83.5	Confident	86	Confident	122 Å²	122	55.6 Å²	55.6	53%	0.53	31%	0.309	S	S	.	.	H	α-helix	trans	-82.2	-28.5	-179.6	-70.4	-177.4	-178.8	-173.7	0	112.6	G250 F251 P489	G250-K254 PolarHBondContact O-N 3.05Å; F251-K254 PolarHBondContact O-N 2.88Å; K254-P489 WeakPolarHBondContact CE-O 3.4Å; K254-P489 PolarHBondContact NZ-O 3.29Å
255	N	83.9	Confident	85.9	Confident	36 Å²	36	58.4 Å²	58.4	19%	0.193	33%	0.327	C	S	.	.	S	Bend	trans	-118.7	115.7	-174.5	-60.6	-83.3	0	0	0	109.3	F251 I260	F251-N255 WeakPolarHBondContact CD2-ND2 3.44Å; F251-N255 HydrophobicContact CE1-CB 4.41Å; F251-N255 WeakPolarHBondContact CE2-ND2 3.2Å; F251-N255 HydrophobicContact CZ-CB 4.28Å; F251-N255 WeakPolarHBondContact CZ-ND2 3.24Å; F251-N255 PolarHBondContact O-N 3.03Å; F251-N255 PolarHBondContact O-ND2 3.18Å; N255-I260 HydrophobicContact CB-CD1 3.93Å; N255-I260 HydrophobicContact CB-CG1 3.93Å; N255-I260 WeakPolarHBondContact O-CD1 3.37Å
256	P	82.9	Confident	85.8	Confident	91 Å²	91	58.6 Å²	58.6	59%	0.591	32%	0.324	S	S	*	.			trans	-62.5	143.7	-178.6	24.8	-32	0	0	0	110.9	G258 S259 I260	P256-G258 VanDerWaalsContact C-N 3.27Å; P256-G258 PolarHBondContact O-N 2.87Å; P256-S259 WeakPolarHBondContact CD-OG 3.06Å; P256-S259 WeakPolarHBondContact CG-OG 3.19Å; P256-S259 WeakPolarHBondContact O-CB 3.48Å; P256-S259 PolarHBondContact O-N 2.85Å; P256-S259 PolarHBondContact O-OG 3.28Å; P256-I260 PolarHBondContact O-N 2.86Å
257	A	83.3	Confident	85.7	Confident	72 Å²	72	55.5 Å²	55.5	60%	0.595	32%	0.317	S	S	*	.	H	α-helix	trans	-53.2	-42.2	-175.2	0	0	0	0	0	112.8	S259 I260 T261	A257-S259 VanDerWaalsContact C-N 3.29Å; A257-S259 PolarHBondContact O-N 3.03Å; A257-I260 PolarHBondContact O-N 3.42Å; A257-I260 VanDerWaalsContact O-N 3.11Å; A257-T261 PolarHBondContact O-N 3.31Å; A257-T261 PolarHBondContact O-OG1 3.44Å; A257-T261 VanDerWaalsContact O-OG1 3.04Å
258	G	83.6	Confident	85.6	Confident	56 Å²	56	54.8 Å²	54.8	58%	0.577	31%	0.314	S	S	*	.	H	α-helix	trans	-59.5	-36.6	177.4	0	0	0	0	0	113.8	P256 T261 S262	P256-G258 VanDerWaalsContact C-N 3.27Å; P256-G258 PolarHBondContact O-N 2.87Å; G258-T261 PolarHBondContact O-N 3.17Å; G258-S262 PolarHBondContact O-N 3.41Å
259	S	83.4	Confident	85.7	Confident	35 Å²	35	54 Å²	54	25%	0.245	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-36.6	176.1	73	0	0	0	0	112.4	P256 A257 R263	P256-S259 WeakPolarHBondContact CD-OG 3.06Å; P256-S259 WeakPolarHBondContact CG-OG 3.19Å; P256-S259 WeakPolarHBondContact O-CB 3.48Å; P256-S259 PolarHBondContact O-N 2.85Å; P256-S259 PolarHBondContact O-OG 3.28Å; A257-S259 VanDerWaalsContact C-N 3.29Å; A257-S259 PolarHBondContact O-N 3.03Å; S259-R263 WeakPolarHBondContact O-CB 3.26Å; S259-R263 WeakPolarHBondContact O-CD 3.41Å; S259-R263 WeakPolarHBondContact O-CG 3.31Å; S259-R263 PolarHBondContact O-N 3.26Å; S259-R263 VanDerWaalsContact O-N 3.11Å
260	I	87.7	Confident	85.6	Confident	10 Å²	10	55.9 Å²	55.9	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-44.2	176.3	-60.9	171.4	0	0	0	109.4	V244 F251 F252 N255 P256 A257 R263 V264	V244-I260 HydrophobicContact CG1-CG2 3.59Å; F251-I260 HydrophobicContact CD1-CD1 4.29Å; F251-I260 HydrophobicContact CE1-CD1 3.76Å; F251-I260 HydrophobicContact CE1-CG1 4.19Å; F252-I260 HydrophobicContact CD1-CD1 3.43Å; F252-I260 VanDerWaalsContact CD1-CD1 3.43Å; F252-I260 HydrophobicContact CE1-CD1 3.8Å; F252-I260 HydrophobicContact CG-CD1 4.37Å; N255-I260 HydrophobicContact CB-CD1 3.93Å; N255-I260 HydrophobicContact CB-CG1 3.93Å; N255-I260 WeakPolarHBondContact O-CD1 3.37Å; P256-I260 PolarHBondContact O-N 2.86Å; A257-I260 PolarHBondContact O-N 3.42Å; A257-I260 VanDerWaalsContact O-N 3.11Å; I260-R263 PolarHBondContact O-N 2.87Å; I260-V264 HydrophobicContact CG2-CG2 4.14Å; I260-V264 WeakPolarHBondContact O-CB 3.25Å; I260-V264 VanDerWaalsContact O-CG2 3.25Å; I260-V264 WeakPolarHBondContact O-CG2 3.34Å; I260-V264 PolarHBondContact O-N 3.02Å
261	T	87.7	Confident	85.7	Confident	83 Å²	83	55.9 Å²	55.9	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-58.6	-55.8	178	-57	0	0	0	0	110.9	A257 G258 R263 V264 T265	A257-T261 PolarHBondContact O-N 3.31Å; A257-T261 PolarHBondContact O-OG1 3.44Å; A257-T261 VanDerWaalsContact O-OG1 3.04Å; G258-T261 PolarHBondContact O-N 3.17Å; T261-R263 VanDerWaalsContact C-N 3.27Å; T261-R263 PolarHBondContact O-N 2.83Å; T261-V264 PolarHBondContact O-N 3.46Å; T261-V264 VanDerWaalsContact O-N 3.11Å; T261-T265 HydrophobicContact CG2-CG2 4.38Å; T261-T265 PolarHBondContact O-N 2.84Å; T261-T265 PolarHBondContact O-OG1 2.75Å
262	S	85.9	Confident	85.6	Confident	41 Å²	41	55.7 Å²	55.7	29%	0.287	32%	0.321	S	S	.	.	H	α-helix	trans	-57	-39.3	178.4	170.7	0	0	0	0	111.9	G258 E266 D267	G258-S262 PolarHBondContact O-N 3.41Å; S262-E266 WeakPolarHBondContact O-CA 3.25Å; S262-E266 WeakPolarHBondContact O-CB 3.38Å; S262-E266 PolarHBondContact O-N 3.34Å; S262-E266 PolarHBondContact OG-OE2 3.21Å; S262-D267 PolarHBondContact O-N 2.91Å
263	R	83.4	Confident	85.6	Confident	84 Å²	84	56.8 Å²	56.8	32%	0.317	33%	0.328	S	S	.	.	I	π-helix	trans	-65.8	-42.6	175.8	-74.1	173.9	-177.1	-152.4	1.3	113.4	S259 I260 T261 D267 T268 Y457	S259-R263 WeakPolarHBondContact O-CB 3.26Å; S259-R263 WeakPolarHBondContact O-CD 3.41Å; S259-R263 WeakPolarHBondContact O-CG 3.31Å; S259-R263 PolarHBondContact O-N 3.26Å; S259-R263 VanDerWaalsContact O-N 3.11Å; I260-R263 PolarHBondContact O-N 2.87Å; T261-R263 VanDerWaalsContact C-N 3.27Å; T261-R263 PolarHBondContact O-N 2.83Å; R263-D267 WeakPolarHBondContact CG-OD2 3.28Å; R263-D267 WeakPolarHBondContact O-CB 3.48Å; R263-T268 PolarHBondContact O-N 2.88Å; R263-T268 PolarHBondContact O-OG1 3.27Å; R263-Y457 WeakPolarHBondContact CD-OH 3.41Å; R263-Y457 PolarHBondContact NH1-OH 3.19Å
264	V	87.7	Confident	85.7	Confident	14 Å²	14	55.3 Å²	55.3	9%	0.085	33%	0.325	C	S	.	.	I	π-helix	trans	-76.4	-29.7	-178.3	174.8	0	0	0	0	112	H237 V240 F241 V244 I260 T261 T268	H237-V264 PolarHBondContact CE1-O 3.29Å; H237-V264 VanDerWaalsContact CE1-O 3.3Å; H237-V264 PolarHBondContact ND1-O 3.08Å; V240-V264 HydrophobicContact CG1-CG1 4.22Å; V240-V264 HydrophobicContact CG1-CG2 4.12Å; F241-V264 HydrophobicContact CB-CG1 4.3Å; F241-V264 HydrophobicContact CD2-CG1 4.15Å; V244-V264 HydrophobicContact CB-CG2 4.47Å; V244-V264 HydrophobicContact CG2-CG2 3.63Å; I260-V264 HydrophobicContact CG2-CG2 4.14Å; I260-V264 WeakPolarHBondContact O-CB 3.25Å; I260-V264 VanDerWaalsContact O-CG2 3.25Å; I260-V264 WeakPolarHBondContact O-CG2 3.34Å; I260-V264 PolarHBondContact O-N 3.02Å; T261-V264 PolarHBondContact O-N 3.46Å; T261-V264 VanDerWaalsContact O-N 3.11Å; V264-T268 VanDerWaalsContact O-CB 3.28Å; V264-T268 WeakPolarHBondContact O-CB 3.39Å; V264-T268 PolarHBondContact O-OG1 3.31Å
265	T	87.7	Confident	85.7	Confident	68 Å²	68	49.8 Å²	49.8	42%	0.417	30%	0.301	S	S	.	.	I	π-helix	trans	-95.9	-70.7	179.5	59.4	0	0	0	0	111.6	H237 T261 A269	H237-T265 PolarHBondContact CE1-O 2.95Å; T261-T265 HydrophobicContact CG2-CG2 4.38Å; T261-T265 PolarHBondContact O-N 2.84Å; T261-T265 PolarHBondContact O-OG1 2.75Å; T265-A269 WeakPolarHBondContact O-CB 3.4Å; T265-A269 PolarHBondContact O-N 3.03Å
266	E	87.2	Confident	85.8	Confident	111 Å²	111	48.7 Å²	48.7	52%	0.519	30%	0.296	S	S	.	.	I	π-helix	trans	-70	-53	-171.1	-61.3	172	164.8	0	0	111.8	S262 T268 A269 N270	S262-E266 WeakPolarHBondContact O-CA 3.25Å; S262-E266 WeakPolarHBondContact O-CB 3.38Å; S262-E266 PolarHBondContact O-N 3.34Å; S262-E266 PolarHBondContact OG-OE2 3.21Å; E266-T268 VanDerWaalsContact C-N 3.3Å; E266-T268 PolarHBondContact O-N 3.01Å; E266-A269 PolarHBondContact O-N 2.97Å; E266-N270 WeakPolarHBondContact O-CB 3.44Å; E266-N270 PolarHBondContact O-N 3.25Å; E266-N270 PolarHBondContact O-ND2 3.43Å; E266-N270 VanDerWaalsContact O-ND2 3.16Å
267	D	84.9	Confident	86	Confident	60 Å²	60	48 Å²	48	32%	0.321	29%	0.287	S	S	.	.	I	π-helix	trans	-64.4	-38.8	-177.3	-72.2	-20	0	0	0	111.1	S262 R263 M271 I454	S262-D267 PolarHBondContact O-N 2.91Å; R263-D267 WeakPolarHBondContact CG-OD2 3.28Å; R263-D267 WeakPolarHBondContact O-CB 3.48Å; D267-M271 WeakPolarHBondContact O-CB 3.35Å; D267-M271 PolarHBondContact O-N 3.01Å; D267-I454 HydrophobicContact CB-CD1 4.36Å
268	T	87.3	Confident	86.2	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68	-41.2	178	-57.2	0	0	0	0	111.9	V236 V240 R263 V264 E266 M271 C272	V236-T268 HydrophobicContact CG1-CG2 3.83Å; V240-T268 HydrophobicContact CG2-CG2 4.35Å; R263-T268 PolarHBondContact O-N 2.88Å; R263-T268 PolarHBondContact O-OG1 3.27Å; V264-T268 VanDerWaalsContact O-CB 3.28Å; V264-T268 WeakPolarHBondContact O-CB 3.39Å; V264-T268 PolarHBondContact O-OG1 3.31Å; E266-T268 VanDerWaalsContact C-N 3.3Å; E266-T268 PolarHBondContact O-N 3.01Å; T268-M271 HydrophobicContact CG2-CE 4.47Å; T268-C272 WeakPolarHBondContact O-CB 3.43Å; T268-C272 PolarHBondContact O-N 3.21Å; T268-C272 PolarHBondContact O-SG 2.9Å
269	A	88.1	Confident	86.3	Confident	25 Å²	25	44 Å²	44	21%	0.207	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-50.7	175.5	0	0	0	0	0	111.2	H237 T265 E266 M271 C272 E273	H237-A269 PolarHBondContact NE2-N 2.98Å; T265-A269 WeakPolarHBondContact O-CB 3.4Å; T265-A269 PolarHBondContact O-N 3.03Å; E266-A269 PolarHBondContact O-N 2.97Å; A269-M271 VanDerWaalsContact C-N 3.28Å; A269-M271 PolarHBondContact O-N 3.22Å; A269-C272 PolarHBondContact O-N 3.28Å; A269-C272 VanDerWaalsContact O-N 3.09Å; A269-E273 WeakPolarHBondContact O-CB 3.27Å; A269-E273 PolarHBondContact O-N 2.99Å
270	N	86.2	Confident	86.6	Confident	85 Å²	85	43.7 Å²	43.7	46%	0.455	24%	0.241	S	C	.	.	H	α-helix	trans	-57.5	-40.9	178.2	-72.4	-25.7	0	0	0	111.6	E266 S274	E266-N270 WeakPolarHBondContact O-CB 3.44Å; E266-N270 PolarHBondContact O-N 3.25Å; E266-N270 PolarHBondContact O-ND2 3.43Å; E266-N270 VanDerWaalsContact O-ND2 3.16Å; N270-S274 WeakPolarHBondContact O-CB 3.22Å; N270-S274 PolarHBondContact O-N 3.22Å; N270-S274 PolarHBondContact O-OG 3.36Å
271	M	85.8	Confident	86.7	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-51.1	174.4	178.2	-163.8	65	0	0	110.9	M152 V236 D267 T268 A269 E273 S274 I275 S451 I454	M152-M271 HydrophobicContact CE-CE 3.23Å; M152-M271 HydrophobicContact CE-CG 3.96Å; M152-M271 HydrophobicContact CE-SD 3.43Å; M152-M271 WeakPolarHBondContact CE-SD 3.26Å; M152-M271 HydrophobicContact SD-SD 4.06Å; V236-M271 HydrophobicContact CG1-CE 3.98Å; D267-M271 WeakPolarHBondContact O-CB 3.35Å; D267-M271 PolarHBondContact O-N 3.01Å; T268-M271 HydrophobicContact CG2-CE 4.47Å; A269-M271 VanDerWaalsContact C-N 3.28Å; A269-M271 PolarHBondContact O-N 3.22Å; M271-E273 PolarHBondContact O-N 3.27Å; M271-S274 PolarHBondContact O-N 3.29Å; M271-I275 HydrophobicContact CG-CD1 3.81Å; M271-I275 WeakPolarHBondContact O-CB 3.49Å; M271-I275 VanDerWaalsContact O-CG1 3.24Å; M271-I275 WeakPolarHBondContact O-CG1 3Å; M271-I275 PolarHBondContact O-N 3.44Å; M271-S451 WeakPolarHBondContact SD-CA 3.42Å; M271-S451 WeakPolarHBondContact SD-CB 3.49Å; M271-I454 HydrophobicContact CB-CD1 3.82Å; M271-I454 HydrophobicContact CE-CD1 3.76Å; M271-I454 HydrophobicContact CE-CG2 4.19Å; M271-I454 HydrophobicContact CG-CD1 4.18Å; M271-I454 HydrophobicContact SD-CB 4.25Å; M271-I454 HydrophobicContact SD-CD1 3.43Å; M271-I454 WeakPolarHBondContact SD-CD1 3.33Å; M271-I454 HydrophobicContact SD-CG1 4.43Å; M271-I454 HydrophobicContact SD-CG2 4.49Å
272	C	85.6	Confident	86.7	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.02	25%	0.245	C	C	.	.	H	α-helix	trans	-64.1	-41.6	-177.4	-70.4	0	0	0	0	112.1	H233 T268 A269 S276	H233-C272 HydrophobicContact CB-CB 4.45Å; H233-C272 WeakPolarHBondContact ND1-CB 3.28Å; T268-C272 WeakPolarHBondContact O-CB 3.43Å; T268-C272 PolarHBondContact O-N 3.21Å; T268-C272 PolarHBondContact O-SG 2.9Å; A269-C272 PolarHBondContact O-N 3.28Å; A269-C272 VanDerWaalsContact O-N 3.09Å; C272-S276 WeakPolarHBondContact O-CB 3.46Å; C272-S276 PolarHBondContact O-N 3.14Å
273	E	87	Confident	86.8	Confident	110 Å²	110	45.2 Å²	45.2	51%	0.514	24%	0.242	S	C	.	.	H	α-helix	trans	-66.2	-50.9	176.4	-173.5	173.8	-164.2	0	0	111	A269 M271 I275 S276 D277	A269-E273 WeakPolarHBondContact O-CB 3.27Å; A269-E273 PolarHBondContact O-N 2.99Å; M271-E273 PolarHBondContact O-N 3.27Å; E273-I275 PolarHBondContact O-N 3.32Å; E273-S276 WeakPolarHBondContact O-CB 3.35Å; E273-S276 PolarHBondContact O-N 3.12Å; E273-S276 VanDerWaalsContact O-N 3.1Å; E273-D277 PolarHBondContact O-N 3.47Å
274	S	86	Confident	87.1	Confident	52 Å²	52	44.1 Å²	44.1	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-56.4	-41.4	178.1	-63.8	0	0	0	0	111.8	N270 M271 T278	N270-S274 WeakPolarHBondContact O-CB 3.22Å; N270-S274 PolarHBondContact O-N 3.22Å; N270-S274 PolarHBondContact O-OG 3.36Å; M271-S274 PolarHBondContact O-N 3.29Å; S274-T278 WeakPolarHBondContact O-CB 3.4Å; S274-T278 PolarHBondContact O-N 3.32Å; S274-T278 PolarHBondContact O-OG1 2.89Å
275	I	83.6	Confident	87.2	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-74.2	-40.5	179.6	-67.1	174.9	0	0	0	111.1	M152 M229 M271 E273 L279 M444 A447	M152-I275 HydrophobicContact CE-CD1 3.65Å; M152-I275 HydrophobicContact SD-CD1 3.14Å; M152-I275 WeakPolarHBondContact SD-CD1 3.26Å; M229-I275 HydrophobicContact CE-CG2 4.32Å; M271-I275 HydrophobicContact CG-CD1 3.81Å; M271-I275 WeakPolarHBondContact O-CB 3.49Å; M271-I275 VanDerWaalsContact O-CG1 3.24Å; M271-I275 WeakPolarHBondContact O-CG1 3Å; M271-I275 PolarHBondContact O-N 3.44Å; E273-I275 PolarHBondContact O-N 3.32Å; I275-L279 WeakPolarHBondContact O-CB 3.5Å; I275-L279 PolarHBondContact O-N 3.13Å; I275-M444 HydrophobicContact CG1-CE 4.3Å; I275-A447 HydrophobicContact CD1-CB 4.34Å; I275-A447 HydrophobicContact CG1-CB 3.72Å
276	S	87.2	Confident	87.3	Confident	13 Å²	13	46 Å²	46	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-54	-53.9	172.9	175.9	0	0	0	0	111.9	Y225 M229 C272 E273 S280	Y225-S276 PolarHBondContact OH-O 2.93Å; M229-S276 VanDerWaalsContact CG-CB 3.45Å; M229-S276 WeakPolarHBondContact CG-OG 3.36Å; C272-S276 WeakPolarHBondContact O-CB 3.46Å; C272-S276 PolarHBondContact O-N 3.14Å; E273-S276 WeakPolarHBondContact O-CB 3.35Å; E273-S276 PolarHBondContact O-N 3.12Å; E273-S276 VanDerWaalsContact O-N 3.1Å; S276-S280 WeakPolarHBondContact O-CB 3.47Å; S276-S280 PolarHBondContact O-N 2.75Å
277	D	87.8	Confident	87.3	Confident	75 Å²	75	41.3 Å²	41.3	40%	0.401	22%	0.222	S	C	.	.	H	α-helix	trans	-70.5	-45.1	-173.8	-67.1	-8.6	0	0	0	110.5	E273 L279 S280 L281	E273-D277 PolarHBondContact O-N 3.47Å; D277-L279 PolarHBondContact O-N 3.03Å; D277-S280 WeakPolarHBondContact O-CB 3.36Å; D277-S280 PolarHBondContact O-N 3.07Å; D277-L281 WeakPolarHBondContact O-CB 3.48Å; D277-L281 WeakPolarHBondContact O-CG 3.36Å; D277-L281 PolarHBondContact O-N 3.28Å
278	T	86.9	Confident	87.5	Confident	10 Å²	10	40 Å²	40	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-68.7	-36.3	-177.9	-49.6	0	0	0	0	111.7	S274 L282 L440 M444	S274-T278 WeakPolarHBondContact O-CB 3.4Å; S274-T278 PolarHBondContact O-N 3.32Å; S274-T278 PolarHBondContact O-OG1 2.89Å; T278-L282 WeakPolarHBondContact O-CB 3.34Å; T278-L282 PolarHBondContact O-N 3.14Å; T278-L440 HydrophobicContact CG2-CB 3.89Å; T278-L440 HydrophobicContact CG2-CD2 3.89Å; T278-L440 HydrophobicContact CG2-CG 4.35Å; T278-M444 HydrophobicContact CG2-CB 4.46Å; T278-M444 HydrophobicContact CG2-CE 3.42Å; T278-M444 VanDerWaalsContact CG2-CE 3.42Å; T278-M444 HydrophobicContact CG2-CG 3.38Å; T278-M444 HydrophobicContact CG2-SD 3.51Å; T278-M444 VanDerWaalsContact CG2-SD 3.51Å
279	L	85.8	Confident	87.5	Confident	34 Å²	34	40.4 Å²	40.4	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-40.2	173.9	-178.4	67	0	0	0	111.5	L153 M229 I275 D277 L282 L283	L153-L279 HydrophobicContact CD2-CD2 4.04Å; M229-L279 HydrophobicContact CE-CD2 4.44Å; I275-L279 WeakPolarHBondContact O-CB 3.5Å; I275-L279 PolarHBondContact O-N 3.13Å; D277-L279 PolarHBondContact O-N 3.03Å; L279-L282 PolarHBondContact O-N 3.16Å; L279-L283 HydrophobicContact CD1-CD1 4.44Å; L279-L283 HydrophobicContact CD1-CG 4.46Å; L279-L283 HydrophobicContact CG-CD1 4.19Å; L279-L283 WeakPolarHBondContact O-CG 3.48Å; L279-L283 PolarHBondContact O-N 3.02Å
280	S	88.9	Confident	87.5	Confident	30 Å²	30	44.2 Å²	44.2	21%	0.21	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-53.6	176.3	-170.7	0	0	0	0	110.8	Y225 S276 D277 L282 L283 W284	Y225-S280 VanDerWaalsContact CE1-CB 3.47Å; Y225-S280 PolarHBondContact OH-N 3.14Å; S276-S280 WeakPolarHBondContact O-CB 3.47Å; S276-S280 PolarHBondContact O-N 2.75Å; D277-S280 WeakPolarHBondContact O-CB 3.36Å; D277-S280 PolarHBondContact O-N 3.07Å; S280-L282 VanDerWaalsContact C-N 3.28Å; S280-L282 PolarHBondContact O-N 3.24Å; S280-L283 PolarHBondContact O-N 3.39Å; S280-W284 WeakPolarHBondContact O-CB 3.27Å; S280-W284 PolarHBondContact O-N 3.06Å
281	L	90.1	Very high	87.7	Confident	67 Å²	67	41.1 Å²	41.1	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-60.7	-39.5	178.1	-66.3	168.1	0	0	0	111	D277 W284 Y285 L440	D277-L281 WeakPolarHBondContact O-CB 3.48Å; D277-L281 WeakPolarHBondContact O-CG 3.36Å; D277-L281 PolarHBondContact O-N 3.28Å; L281-W284 PolarHBondContact O-N 3.45Å; L281-Y285 HydrophobicContact CB-CD2 4.24Å; L281-Y285 HydrophobicContact CD2-CD2 4.31Å; L281-Y285 HydrophobicContact CD2-CE2 3.78Å; L281-Y285 WeakPolarHBondContact O-CB 3.49Å; L281-Y285 VanDerWaalsContact O-CD2 3.26Å; L281-Y285 WeakPolarHBondContact O-CD2 3.3Å; L281-Y285 PolarHBondContact O-N 3.26Å; L281-L440 HydrophobicContact CB-CD1 3.75Å; L281-L440 HydrophobicContact CB-CD2 3.71Å; L281-L440 HydrophobicContact CB-CG 4.39Å; L281-L440 HydrophobicContact CD1-CD2 3.73Å; L281-L440 HydrophobicContact CG-CD2 4.38Å
282	L	88.1	Confident	87.9	Confident	55 Å²	55	40.9 Å²	40.9	29%	0.288	22%	0.217	S	C	.	.	H	α-helix	trans	-63.1	-49.1	177.4	-176.6	146.8	0	0	0	111	T278 L279 S280 W284 L286 L437 L440	T278-L282 WeakPolarHBondContact O-CB 3.34Å; T278-L282 PolarHBondContact O-N 3.14Å; L279-L282 PolarHBondContact O-N 3.16Å; S280-L282 VanDerWaalsContact C-N 3.28Å; S280-L282 PolarHBondContact O-N 3.24Å; L282-W284 VanDerWaalsContact C-N 3.33Å; L282-W284 PolarHBondContact O-N 3.4Å; L282-L286 HydrophobicContact CD2-CD2 4.45Å; L282-L286 WeakPolarHBondContact O-CB 3.32Å; L282-L286 PolarHBondContact O-N 3.38Å; L282-L437 HydrophobicContact CG-CD1 4.22Å; L282-L440 HydrophobicContact CB-CD1 4.01Å
283	L	87.3	Confident	88	Confident	44 Å²	44	43.6 Å²	43.6	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-43.6	178.2	-72.2	169.9	0	0	0	111.4	L167 L170 Y225 L279 S280 G287	L167-L283 HydrophobicContact CD1-CD2 4.06Å; L170-L283 HydrophobicContact CD1-CB 4.45Å; Y225-L283 HydrophobicContact CE2-CD1 4.45Å; L279-L283 HydrophobicContact CD1-CD1 4.44Å; L279-L283 HydrophobicContact CD1-CG 4.46Å; L279-L283 HydrophobicContact CG-CD1 4.19Å; L279-L283 WeakPolarHBondContact O-CG 3.48Å; L279-L283 PolarHBondContact O-N 3.02Å; S280-L283 PolarHBondContact O-N 3.39Å; L283-G287 PolarHBondContact O-N 3.44Å
284	W	90.3	Very high	88.1	Confident	60 Å²	60	42.8 Å²	42.8	23%	0.227	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-56	-179.1	-167.7	66.1	0	0	0	112.9	L170 S280 L281 L282 L286 G287 R288	L170-W284 HydrophobicContact CD1-CB 4.1Å; L170-W284 HydrophobicContact CD1-CG 4.45Å; S280-W284 WeakPolarHBondContact O-CB 3.27Å; S280-W284 PolarHBondContact O-N 3.06Å; L281-W284 PolarHBondContact O-N 3.45Å; L282-W284 VanDerWaalsContact C-N 3.33Å; L282-W284 PolarHBondContact O-N 3.4Å; W284-L286 PolarHBondContact O-N 3.43Å; W284-G287 PolarHBondContact O-N 3.31Å; W284-R288 VanDerWaalsContact CZ2-NH1 3.31Å; W284-R288 VanDerWaalsContact O-CB 3.26Å; W284-R288 WeakPolarHBondContact O-CB 3.37Å; W284-R288 PolarHBondContact O-N 2.99Å
285	Y	90.4	Very high	88.1	Confident	47 Å²	47	42.2 Å²	42.2	18%	0.184	22%	0.224	C	C	.	.	H	α-helix	trans	-71.5	-29	-177.9	-74.8	-70.8	0	0	0	113.1	L281 A289 A433 V436	L281-Y285 HydrophobicContact CB-CD2 4.24Å; L281-Y285 HydrophobicContact CD2-CD2 4.31Å; L281-Y285 HydrophobicContact CD2-CE2 3.78Å; L281-Y285 WeakPolarHBondContact O-CB 3.49Å; L281-Y285 VanDerWaalsContact O-CD2 3.26Å; L281-Y285 WeakPolarHBondContact O-CD2 3.3Å; L281-Y285 PolarHBondContact O-N 3.26Å; Y285-A289 WeakPolarHBondContact O-CB 3.37Å; Y285-A289 PolarHBondContact O-N 3.17Å; Y285-A433 HydrophobicContact CD1-CB 3.85Å; Y285-V436 HydrophobicContact CD1-CB 4.38Å; Y285-V436 HydrophobicContact CD2-CB 4.07Å; Y285-V436 HydrophobicContact CD2-CG1 3.53Å; Y285-V436 HydrophobicContact CE1-CB 4.25Å; Y285-V436 HydrophobicContact CE1-CG2 4.23Å; Y285-V436 HydrophobicContact CE2-CB 3.97Å; Y285-V436 HydrophobicContact CE2-CG1 3.36Å; Y285-V436 HydrophobicContact CE2-CG2 4.3Å; Y285-V436 HydrophobicContact CG-CB 4.27Å; Y285-V436 HydrophobicContact CG-CG1 4.21Å
286	L	88.3	Confident	88.3	Confident	75 Å²	75	42.1 Å²	42.1	39%	0.393	22%	0.223	S	C	.	.	H	α-helix	trans	-67.8	-48	172.6	-173.8	70.6	0	0	0	110.9	L282 W284 R288 A289 L290 L437	L282-L286 HydrophobicContact CD2-CD2 4.45Å; L282-L286 WeakPolarHBondContact O-CB 3.32Å; L282-L286 PolarHBondContact O-N 3.38Å; W284-L286 PolarHBondContact O-N 3.43Å; L286-R288 PolarHBondContact O-N 3.28Å; L286-A289 PolarHBondContact O-N 3Å; L286-L290 HydrophobicContact CG-CD1 4.33Å; L286-L290 VanDerWaalsContact O-CG 3.29Å; L286-L290 WeakPolarHBondContact O-CG 3.35Å; L286-L290 PolarHBondContact O-N 3.49Å; L286-L437 HydrophobicContact CB-CD1 4.49Å; L286-L437 HydrophobicContact CD1-CD2 4.01Å
287	G	87.8	Confident	88.2	Confident	12 Å²	12	46 Å²	46	12%	0.124	24%	0.239	C	C	.	.	H	α-helix	trans	-58	-48.8	175.3	0	0	0	0	0	111.5	L283 W284 A289 L290 C291	L283-G287 PolarHBondContact O-N 3.44Å; W284-G287 PolarHBondContact O-N 3.31Å; G287-A289 PolarHBondContact O-N 3.18Å; G287-L290 PolarHBondContact O-N 2.88Å; G287-C291 PolarHBondContact O-N 3.4Å; G287-C291 PolarHBondContact O-SG 3.2Å; G287-C291 VanDerWaalsContact O-SG 3.39Å
288	R	89.3	Confident	88.1	Confident	32 Å²	32	52.6 Å²	52.6	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-45.1	177.4	-168.9	178.7	-178	125.7	10.1	112.5	E177 M178 W284 L286 L290 C291 L292	E177-R288 VanDerWaalsContact CD-NH1 3.28Å; E177-R288 IonicContact OE1-CZ 3.39Å; E177-R288 IonicContact OE1-NH1 3.64Å; E177-R288 PolarHBondContact OE1-NH1 3.29Å; E177-R288 IonicContact OE1-NH2 2.64Å; E177-R288 IonicContact OE2-CZ 2.88Å; E177-R288 IonicContact OE2-NH1 2.79Å; E177-R288 PolarHBondContact OE2-NH1 3.29Å; E177-R288 IonicContact OE2-NH2 3.13Å; M178-R288 HydrophobicContact CE-CG 3.9Å; W284-R288 VanDerWaalsContact CZ2-NH1 3.31Å; W284-R288 VanDerWaalsContact O-CB 3.26Å; W284-R288 WeakPolarHBondContact O-CB 3.37Å; W284-R288 PolarHBondContact O-N 2.99Å; L286-R288 PolarHBondContact O-N 3.28Å; R288-L290 PolarHBondContact O-N 3.4Å; R288-C291 PolarHBondContact O-N 3.22Å; R288-L292 HydrophobicContact CG-CD1 3.87Å; R288-L292 HydrophobicContact CG-CG 4.46Å; R288-L292 VanDerWaalsContact O-CB 3.28Å; R288-L292 WeakPolarHBondContact O-CB 3.46Å; R288-L292 WeakPolarHBondContact O-CD1 3.39Å; R288-L292 VanDerWaalsContact O-CG 3.28Å; R288-L292 WeakPolarHBondContact O-CG 3.29Å; R288-L292 PolarHBondContact O-N 2.74Å
289	A	88	Confident	87.8	Confident	10 Å²	10	54 Å²	54	8%	0.083	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-40.3	178.8	0	0	0	0	0	112.1	Y285 L286 G287 L293 F430 A433	Y285-A289 WeakPolarHBondContact O-CB 3.37Å; Y285-A289 PolarHBondContact O-N 3.17Å; L286-A289 PolarHBondContact O-N 3Å; G287-A289 PolarHBondContact O-N 3.18Å; A289-L293 VanDerWaalsContact O-CB 3.26Å; A289-L293 WeakPolarHBondContact O-CB 3.31Å; A289-L293 PolarHBondContact O-N 3.47Å; A289-F430 HydrophobicContact CB-CD2 4.47Å; A289-F430 HydrophobicContact CB-CE2 4.27Å; A289-A433 HydrophobicContact CB-CB 4.41Å
290	L	88.3	Confident	87.6	Confident	104 Å²	104	52.9 Å²	52.9	55%	0.545	27%	0.269	S	S	.	.	H	α-helix	trans	-65.5	-46.7	175.9	-69.9	172.2	0	0	0	111.6	L286 G287 R288 L293 V294	L286-L290 HydrophobicContact CG-CD1 4.33Å; L286-L290 VanDerWaalsContact O-CG 3.29Å; L286-L290 WeakPolarHBondContact O-CG 3.35Å; L286-L290 PolarHBondContact O-N 3.49Å; G287-L290 PolarHBondContact O-N 2.88Å; R288-L290 PolarHBondContact O-N 3.4Å; L290-L293 PolarHBondContact O-N 3.02Å; L290-V294 WeakPolarHBondContact O-CG2 3.48Å; L290-V294 PolarHBondContact O-N 3.49Å; L290-V294 VanDerWaalsContact O-N 3.14Å
291	C	88.9	Confident	87.3	Confident	20 Å²	20	54 Å²	54	14%	0.135	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-48.9	175.6	-71.2	0	0	0	0	111.6	C174 G287 R288 L293 V294 F295	C174-C291 HydrophobicContact CB-CB 4.39Å; G287-C291 PolarHBondContact O-N 3.4Å; G287-C291 PolarHBondContact O-SG 3.2Å; G287-C291 VanDerWaalsContact O-SG 3.39Å; R288-C291 PolarHBondContact O-N 3.22Å; C291-L293 VanDerWaalsContact C-N 3.31Å; C291-L293 PolarHBondContact O-N 3.19Å; C291-V294 PolarHBondContact O-N 3.13Å; C291-F295 VanDerWaalsContact O-CD2 3.27Å; C291-F295 WeakPolarHBondContact O-CD2 3.49Å; C291-F295 PolarHBondContact O-N 3.12Å; C291-F295 VanDerWaalsContact O-N 3.08Å
292	L	89.9	Confident	87	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56.8	-45	177.3	-82.1	165.7	0	0	0	111.9	M178 R288 V294 F295 M296 Y426 Q429 F430 A433	M178-L292 HydrophobicContact CE-CD2 4.18Å; M178-L292 HydrophobicContact CE-CG 4.11Å; M178-L292 HydrophobicContact SD-CD1 4.49Å; M178-L292 HydrophobicContact SD-CD2 3.18Å; M178-L292 WeakPolarHBondContact SD-CD2 3.49Å; M178-L292 HydrophobicContact SD-CG 3.56Å; M178-L292 VanDerWaalsContact SD-CG 3.56Å; R288-L292 HydrophobicContact CG-CD1 3.87Å; R288-L292 HydrophobicContact CG-CG 4.46Å; R288-L292 VanDerWaalsContact O-CB 3.28Å; R288-L292 WeakPolarHBondContact O-CB 3.46Å; R288-L292 WeakPolarHBondContact O-CD1 3.39Å; R288-L292 VanDerWaalsContact O-CG 3.28Å; R288-L292 WeakPolarHBondContact O-CG 3.29Å; R288-L292 PolarHBondContact O-N 2.74Å; L292-V294 VanDerWaalsContact C-N 3.33Å; L292-V294 PolarHBondContact O-N 3.44Å; L292-F295 PolarHBondContact O-N 2.95Å; L292-M296 WeakPolarHBondContact O-CB 3.3Å; L292-M296 VanDerWaalsContact O-CG 3.22Å; L292-M296 WeakPolarHBondContact O-CG 3.45Å; L292-M296 PolarHBondContact O-N 3.31Å; L292-Y426 HydrophobicContact CD2-CD1 3.64Å; L292-Y426 HydrophobicContact CD2-CG 4.33Å; L292-Q429 HydrophobicContact CD1-CB 3.95Å; L292-Q429 HydrophobicContact CD2-CB 4.11Å; L292-F430 HydrophobicContact CB-CB 4.35Å; L292-F430 HydrophobicContact CB-CD2 4.08Å; L292-F430 HydrophobicContact CD1-CB 4.24Å; L292-A433 HydrophobicContact CD1-CB 4.49Å
293	L	88.1	Confident	86.6	Confident	59 Å²	59	54 Å²	54	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-59.5	-44.9	178.8	-175.5	147	0	0	0	111	A289 L290 C291 F295 M296 F297 F430	A289-L293 VanDerWaalsContact O-CB 3.26Å; A289-L293 WeakPolarHBondContact O-CB 3.31Å; A289-L293 PolarHBondContact O-N 3.47Å; L290-L293 PolarHBondContact O-N 3.02Å; C291-L293 VanDerWaalsContact C-N 3.31Å; C291-L293 PolarHBondContact O-N 3.19Å; L293-F295 PolarHBondContact O-N 3.43Å; L293-M296 PolarHBondContact O-N 2.97Å; L293-F297 HydrophobicContact CD1-CE2 4.49Å; L293-F297 HydrophobicContact CD2-CD2 3.55Å; L293-F297 HydrophobicContact CD2-CE2 3.55Å; L293-F297 HydrophobicContact CG-CD2 3.95Å; L293-F297 HydrophobicContact CG-CE2 3.83Å; L293-F297 VanDerWaalsContact O-CD2 3.24Å; L293-F297 WeakPolarHBondContact O-CD2 3.38Å; L293-F297 PolarHBondContact O-N 3.24Å; L293-F430 HydrophobicContact CB-CE2 4.18Å; L293-F430 HydrophobicContact CD1-CE2 4.31Å; L293-F430 HydrophobicContact CD1-CZ 4.32Å
294	V	88.6	Confident	86.5	Confident	93 Å²	93	52.1 Å²	52.1	56%	0.564	26%	0.259	S	S	*	.	H	α-helix	trans	-58.9	-47.9	175.7	173.4	0	0	0	0	111.6	L290 C291 L292 M296 F297 W298	L290-V294 WeakPolarHBondContact O-CG2 3.48Å; L290-V294 PolarHBondContact O-N 3.49Å; L290-V294 VanDerWaalsContact O-N 3.14Å; C291-V294 PolarHBondContact O-N 3.13Å; L292-V294 VanDerWaalsContact C-N 3.33Å; L292-V294 PolarHBondContact O-N 3.44Å; V294-M296 PolarHBondContact O-N 3.31Å; V294-F297 PolarHBondContact O-N 3.41Å; V294-W298 PolarHBondContact O-N 3.43Å
295	F	87.5	Confident	86.2	Confident	41 Å²	41	53.7 Å²	53.7	18%	0.18	27%	0.271	C	S	.	.	H	α-helix	trans	-65.7	-38.1	178.8	-81.8	-75.6	0	0	0	113.2	L175 M178 C291 L292 L293 F297 W298 G299 Y426	L175-F295 HydrophobicContact CD2-CE2 3.98Å; L175-F295 HydrophobicContact CD2-CZ 4.05Å; M178-F295 HydrophobicContact CB-CD2 3.97Å; M178-F295 HydrophobicContact CB-CE2 3.82Å; M178-F295 HydrophobicContact CB-CZ 4.36Å; M178-F295 HydrophobicContact CG-CD2 3.95Å; M178-F295 HydrophobicContact CG-CE2 4.05Å; C291-F295 VanDerWaalsContact O-CD2 3.27Å; C291-F295 WeakPolarHBondContact O-CD2 3.49Å; C291-F295 PolarHBondContact O-N 3.12Å; C291-F295 VanDerWaalsContact O-N 3.08Å; L292-F295 PolarHBondContact O-N 2.95Å; L293-F295 PolarHBondContact O-N 3.43Å; F295-F297 VanDerWaalsContact C-N 3.34Å; F295-W298 HydrophobicContact CD1-CE3 4.4Å; F295-W298 HydrophobicContact CE1-CE3 4.42Å; F295-W298 HydrophobicContact CE1-CZ3 4.5Å; F295-W298 PolarHBondContact O-N 3.17Å; F295-G299 PolarHBondContact O-N 3.28Å; F295-Y426 HydrophobicContact CB-CE1 4.29Å; F295-Y426 HydrophobicContact CB-CE2 4.15Å
296	M	86.5	Confident	85.9	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-40.2	176.4	-67	177.1	67.3	0	0	111.2	L292 L293 V294 W298 G299 S300 T304 T307 F423 Y426 Q427 F430	L292-M296 WeakPolarHBondContact O-CB 3.3Å; L292-M296 VanDerWaalsContact O-CG 3.22Å; L292-M296 WeakPolarHBondContact O-CG 3.45Å; L292-M296 PolarHBondContact O-N 3.31Å; L293-M296 PolarHBondContact O-N 2.97Å; V294-M296 PolarHBondContact O-N 3.31Å; M296-W298 VanDerWaalsContact C-N 3.29Å; M296-W298 PolarHBondContact O-N 3.03Å; M296-G299 PolarHBondContact O-N 3.36Å; M296-S300 PolarHBondContact O-N 3.19Å; M296-S300 VanDerWaalsContact O-N 3.08Å; M296-T304 HydrophobicContact CB-CG2 3.26Å; M296-T304 HydrophobicContact CE-CG2 4.25Å; M296-T304 VanDerWaalsContact O-CG2 3.28Å; M296-T304 WeakPolarHBondContact O-CG2 3.39Å; M296-T307 HydrophobicContact CE-CG2 4.13Å; M296-F423 HydrophobicContact CB-CE2 4.24Å; M296-F423 HydrophobicContact CE-CE1 4.36Å; M296-F423 HydrophobicContact CE-CE2 3.8Å; M296-F423 HydrophobicContact CE-CZ 3.6Å; M296-Y426 HydrophobicContact CG-CG 4.38Å; M296-Q427 HydrophobicContact CE-CB 3.8Å; M296-Q427 HydrophobicContact CE-CG 4.15Å; M296-F430 HydrophobicContact SD-CB 3.83Å; M296-F430 HydrophobicContact SD-CD1 4.42Å; M296-F430 HydrophobicContact SD-CG 4.05Å
297	F	85.1	Confident	85.6	Confident	94 Å²	94	49.2 Å²	49.2	41%	0.412	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-36.8	175.7	-91.7	-72.5	0	0	0	111.8	L293 V294 F295 P301 T304	L293-F297 HydrophobicContact CD1-CE2 4.49Å; L293-F297 HydrophobicContact CD2-CD2 3.55Å; L293-F297 HydrophobicContact CD2-CE2 3.55Å; L293-F297 HydrophobicContact CG-CD2 3.95Å; L293-F297 HydrophobicContact CG-CE2 3.83Å; L293-F297 VanDerWaalsContact O-CD2 3.24Å; L293-F297 WeakPolarHBondContact O-CD2 3.38Å; L293-F297 PolarHBondContact O-N 3.24Å; V294-F297 PolarHBondContact O-N 3.41Å; F295-F297 VanDerWaalsContact C-N 3.34Å; F297-P301 HydrophobicContact CD1-CB 4.49Å; F297-T304 HydrophobicContact CD1-CG2 4.49Å; F297-T304 HydrophobicContact CD2-CG2 4.39Å; F297-T304 HydrophobicContact CG-CG2 4.27Å
298	W	85.6	Confident	85.4	Confident	215 Å²	215	52.5 Å²	52.5	81%	0.814	27%	0.266	S	S	*	.	H	α-helix	trans	-68.4	-36.7	175.9	-161.3	1.9	0	0	0	112.6	V294 F295 M296	V294-W298 PolarHBondContact O-N 3.43Å; F295-W298 HydrophobicContact CD1-CE3 4.4Å; F295-W298 HydrophobicContact CE1-CE3 4.42Å; F295-W298 HydrophobicContact CE1-CZ3 4.5Å; F295-W298 PolarHBondContact O-N 3.17Å; M296-W298 VanDerWaalsContact C-N 3.29Å; M296-W298 PolarHBondContact O-N 3.03Å
299	G	80.8	Confident	85.1	Confident	40 Å²	40	55.7 Å²	55.7	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-70.8	-55.2	178.9	0	0	0	0	0	113.8	F295 M296	F295-G299 PolarHBondContact O-N 3.28Å; M296-G299 PolarHBondContact O-N 3.36Å
300	S	82.9	Confident	84.7	Confident	9 Å²	9	57.7 Å²	57.7	6%	0.063	29%	0.294	C	S	.	.			trans	-155.4	114.1	174.1	-179.1	0	0	0	0	111	M296 Y302 L303 T304	M296-S300 PolarHBondContact O-N 3.19Å; M296-S300 VanDerWaalsContact O-N 3.08Å; S300-Y302 VanDerWaalsContact C-N 3.26Å; S300-Y302 PolarHBondContact O-N 3.15Å; S300-L303 PolarHBondContact O-N 3.4Å; S300-L303 PolarHBondContact OG-N 3Å; S300-T304 PolarHBondContact O-N 3.4Å; S300-T304 VanDerWaalsContact O-N 3.15Å; S300-T304 PolarHBondContact O-OG1 2.99Å
301	P	82.6	Confident	84.3	Confident	53 Å²	53	53.9 Å²	53.9	34%	0.344	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-25.1	178.4	26.9	-34	0	0	0	113	F89 F297 T304 L305	F89-P301 HydrophobicContact CE2-CB 3.57Å; F89-P301 HydrophobicContact CE2-CG 3.77Å; F89-P301 HydrophobicContact CZ-CB 3.97Å; F89-P301 HydrophobicContact CZ-CG 3.92Å; F297-P301 HydrophobicContact CD1-CB 4.49Å; P301-T304 WeakPolarHBondContact CA-OG1 3.4Å; P301-T304 PolarHBondContact O-OG1 3.05Å; P301-L305 PolarHBondContact O-N 3.03Å
302	Y	82.1	Confident	83.8	Confident	121 Å²	121	54 Å²	54	48%	0.475	27%	0.274	S	S	.	.	H	α-helix	trans	-71	-48.8	177.6	178.9	-99.1	0	0	0	111.1	S300 T304 L305 V306 L409	S300-Y302 VanDerWaalsContact C-N 3.26Å; S300-Y302 PolarHBondContact O-N 3.15Å; Y302-T304 VanDerWaalsContact C-N 3.33Å; Y302-T304 PolarHBondContact O-N 3.03Å; Y302-L305 PolarHBondContact O-N 2.74Å; Y302-V306 HydrophobicContact CE1-CG2 4.24Å; Y302-V306 WeakPolarHBondContact O-CG2 3.21Å; Y302-V306 PolarHBondContact O-N 3.48Å; Y302-L409 HydrophobicContact CD1-CD1 3.96Å; Y302-L409 HydrophobicContact CD1-CD2 3.8Å; Y302-L409 HydrophobicContact CE1-CD1 3.79Å; Y302-L409 HydrophobicContact CE1-CD2 4.47Å
303	L	80.5	Confident	83.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-68	-33.2	-179.8	-64.5	173.7	0	0	0	111.8	S300 V306 T307 L409 L420 F423	S300-L303 PolarHBondContact O-N 3.4Å; S300-L303 PolarHBondContact OG-N 3Å; L303-V306 PolarHBondContact O-N 2.93Å; L303-T307 WeakPolarHBondContact O-CG2 3.45Å; L303-T307 PolarHBondContact O-N 2.92Å; L303-T307 PolarHBondContact O-OG1 3.12Å; L303-L409 HydrophobicContact CD2-CD2 4.31Å; L303-L409 HydrophobicContact CG-CD2 4.16Å; L303-L420 HydrophobicContact CD1-CD1 4.21Å; L303-F423 HydrophobicContact CB-CD1 4.01Å; L303-F423 HydrophobicContact CB-CD2 4.06Å; L303-F423 HydrophobicContact CB-CE1 3.49Å; L303-F423 VanDerWaalsContact CB-CE1 3.49Å; L303-F423 HydrophobicContact CB-CE2 3.52Å; L303-F423 HydrophobicContact CB-CG 4.3Å; L303-F423 HydrophobicContact CB-CZ 3.23Å; L303-F423 HydrophobicContact CD1-CD1 3.91Å; L303-F423 HydrophobicContact CD1-CD2 4.37Å; L303-F423 HydrophobicContact CD1-CE1 4.22Å; L303-F423 HydrophobicContact CD1-CG 4.01Å; L303-F423 HydrophobicContact CG-CE1 4.4Å; L303-F423 HydrophobicContact CG-CZ 4.49Å; L303-F423 WeakPolarHBondContact O-CZ 3.46Å
304	T	85.1	Confident	82.8	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-40.9	172.8	34.5	0	0	0	0	113.6	M296 F297 S300 P301 Y302 V306 T307 L308 F423	M296-T304 HydrophobicContact CB-CG2 3.26Å; M296-T304 HydrophobicContact CE-CG2 4.25Å; M296-T304 VanDerWaalsContact O-CG2 3.28Å; M296-T304 WeakPolarHBondContact O-CG2 3.39Å; F297-T304 HydrophobicContact CD1-CG2 4.49Å; F297-T304 HydrophobicContact CD2-CG2 4.39Å; F297-T304 HydrophobicContact CG-CG2 4.27Å; S300-T304 PolarHBondContact O-N 3.4Å; S300-T304 VanDerWaalsContact O-N 3.15Å; S300-T304 PolarHBondContact O-OG1 2.99Å; P301-T304 WeakPolarHBondContact CA-OG1 3.4Å; P301-T304 PolarHBondContact O-OG1 3.05Å; Y302-T304 VanDerWaalsContact C-N 3.33Å; Y302-T304 PolarHBondContact O-N 3.03Å; T304-V306 VanDerWaalsContact C-N 3.28Å; T304-V306 PolarHBondContact O-N 3.49Å; T304-T307 WeakPolarHBondContact CA-OG1 3.34Å; T304-T307 PolarHBondContact O-N 3.27Å; T304-T307 PolarHBondContact O-OG1 3.45Å; T304-L308 WeakPolarHBondContact O-CB 3.37Å; T304-L308 PolarHBondContact O-N 2.66Å; T304-F423 HydrophobicContact CG2-CE2 3.97Å
305	L	83.9	Confident	82.2	Confident	93 Å²	93	54.4 Å²	54.4	49%	0.487	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-40	177.5	-167.4	70.2	0	0	0	110.4	P301 Y302 T307 L308 I309	P301-L305 PolarHBondContact O-N 3.03Å; Y302-L305 PolarHBondContact O-N 2.74Å; L305-T307 PolarHBondContact O-N 3.39Å; L305-L308 PolarHBondContact O-N 2.93Å; L305-I309 HydrophobicContact CD2-CD1 4.47Å; L305-I309 HydrophobicContact CG-CD1 3.97Å; L305-I309 WeakPolarHBondContact O-CB 3.49Å; L305-I309 VanDerWaalsContact O-CG1 3.23Å; L305-I309 WeakPolarHBondContact O-CG1 3.29Å; L305-I309 PolarHBondContact O-N 3.02Å
306	V	83.4	Confident	81.8	Confident	20 Å²	20	55.7 Å²	55.7	12%	0.121	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-43.9	173.9	172.8	0	0	0	0	111.2	Y302 L303 T304 I309 N310 L405	Y302-V306 HydrophobicContact CE1-CG2 4.24Å; Y302-V306 WeakPolarHBondContact O-CG2 3.21Å; Y302-V306 PolarHBondContact O-N 3.48Å; L303-V306 PolarHBondContact O-N 2.93Å; T304-V306 VanDerWaalsContact C-N 3.28Å; T304-V306 PolarHBondContact O-N 3.49Å; V306-I309 PolarHBondContact O-N 3.28Å; V306-N310 PolarHBondContact O-N 3.1Å; V306-N310 VanDerWaalsContact O-N 3.15Å; V306-N310 PolarHBondContact O-ND2 3.44Å; V306-L405 HydrophobicContact CG1-CD1 3.76Å
307	T	82.4	Confident	81.3	Confident	8 Å²	8	59.9 Å²	59.9	5%	0.049	30%	0.301	C	S	.	.	H	α-helix	trans	-65.6	-42.1	177.8	57.1	0	0	0	0	111.6	M296 L303 T304 L305 I309 N310 L311 I402 F423 Q427	M296-T307 HydrophobicContact CE-CG2 4.13Å; L303-T307 WeakPolarHBondContact O-CG2 3.45Å; L303-T307 PolarHBondContact O-N 2.92Å; L303-T307 PolarHBondContact O-OG1 3.12Å; T304-T307 WeakPolarHBondContact CA-OG1 3.34Å; T304-T307 PolarHBondContact O-N 3.27Å; T304-T307 PolarHBondContact O-OG1 3.45Å; L305-T307 PolarHBondContact O-N 3.39Å; T307-I309 PolarHBondContact O-N 2.99Å; T307-N310 PolarHBondContact O-N 3.06Å; T307-L311 PolarHBondContact O-N 2.83Å; T307-I402 HydrophobicContact CG2-CD1 3.57Å; T307-F423 HydrophobicContact CG2-CE1 3.92Å; T307-F423 HydrophobicContact CG2-CZ 3.76Å; T307-Q427 HydrophobicContact CG2-CG 3.64Å
308	L	83.4	Confident	80.9	Confident	80 Å²	80	56.1 Å²	56.1	42%	0.419	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-36.4	179.4	-166.4	69.5	0	0	0	112.4	T304 L305 L311 P312	T304-L308 WeakPolarHBondContact O-CB 3.37Å; T304-L308 PolarHBondContact O-N 2.66Å; L305-L308 PolarHBondContact O-N 2.93Å; L308-L311 HydrophobicContact CD1-CD2 4.43Å; L308-L311 WeakPolarHBondContact O-CB 3.26Å; L308-P312 WeakPolarHBondContact O-CD 3.3Å
309	I	83.4	Confident	80.6	Confident	99 Å²	99	50.7 Å²	50.7	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-69.6	-33.2	176	-70.8	167.3	0	0	0	111.8	L305 V306 T307 P312	L305-I309 HydrophobicContact CD2-CD1 4.47Å; L305-I309 HydrophobicContact CG-CD1 3.97Å; L305-I309 WeakPolarHBondContact O-CB 3.49Å; L305-I309 VanDerWaalsContact O-CG1 3.23Å; L305-I309 WeakPolarHBondContact O-CG1 3.29Å; L305-I309 PolarHBondContact O-N 3.02Å; V306-I309 PolarHBondContact O-N 3.28Å; T307-I309 PolarHBondContact O-N 2.99Å; I309-P312 WeakPolarHBondContact O-CD 3.4Å
310	N	79	Confident	80.6	Confident	52 Å²	52	56 Å²	56	28%	0.278	28%	0.28	S	S	.	.	H	α-helix	trans	-86.4	-19.4	179.5	-74.8	-66	0	0	0	113.7	V306 T307 L313 L314 L398	V306-N310 PolarHBondContact O-N 3.1Å; V306-N310 VanDerWaalsContact O-N 3.15Å; V306-N310 PolarHBondContact O-ND2 3.44Å; T307-N310 PolarHBondContact O-N 3.06Å; N310-L313 WeakPolarHBondContact O-CB 3.49Å; N310-L313 PolarHBondContact O-N 3.11Å; N310-L313 VanDerWaalsContact O-N 3.12Å; N310-L314 PolarHBondContact O-N 3.39Å; N310-L314 VanDerWaalsContact O-N 3.1Å; N310-L398 HydrophobicContact CB-CD1 3.51Å
311	L	81.1	Confident	80.4	Confident	25 Å²	25	58.5 Å²	58.5	13%	0.131	29%	0.293	C	S	.	.	H	α-helix	trans	-48	-45.7	174.5	-159	80.5	0	0	0	114.5	T307 L308 L313 L314 F315 F430 V434	T307-L311 PolarHBondContact O-N 2.83Å; L308-L311 HydrophobicContact CD1-CD2 4.43Å; L308-L311 WeakPolarHBondContact O-CB 3.26Å; L311-L313 PolarHBondContact O-N 2.66Å; L311-L314 WeakPolarHBondContact O-CB 3.25Å; L311-L314 PolarHBondContact O-N 2.93Å; L311-F315 HydrophobicContact CD1-CE2 3.83Å; L311-F315 HydrophobicContact CD2-CE2 4.33Å; L311-F315 HydrophobicContact CG-CD2 4.11Å; L311-F315 HydrophobicContact CG-CE2 3.67Å; L311-F315 WeakPolarHBondContact O-CD2 3.33Å; L311-F315 PolarHBondContact O-N 3.36Å; L311-F430 HydrophobicContact CD1-CE1 3.99Å; L311-V434 HydrophobicContact CD2-CG1 4.36Å
312	P	79.2	Confident	80.3	Confident	21 Å²	21	56.6 Å²	56.6	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-69.2	-35.4	-179.6	-2.5	17.7	0	0	0	112	L129 L308 I309 L314 F315 L316	L129-P312 HydrophobicContact CD1-CB 3.39Å; L129-P312 HydrophobicContact CD1-CG 3.11Å; L129-P312 HydrophobicContact CD2-CB 3.85Å; L129-P312 HydrophobicContact CD2-CG 3.53Å; L129-P312 HydrophobicContact CG-CB 3.88Å; L129-P312 HydrophobicContact CG-CG 3.79Å; L308-P312 WeakPolarHBondContact O-CD 3.3Å; I309-P312 WeakPolarHBondContact O-CD 3.4Å; P312-L314 VanDerWaalsContact C-N 3.28Å; P312-L314 PolarHBondContact O-N 2.96Å; P312-F315 PolarHBondContact O-N 3.11Å; P312-L316 VanDerWaalsContact O-CB 3.32Å; P312-L316 WeakPolarHBondContact O-CB 3.39Å; P312-L316 PolarHBondContact O-N 3.26Å
313	L	77.8	Confident	80.4	Confident	101 Å²	101	57.5 Å²	57.5	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-41.2	175.7	-179.6	65.2	0	0	0	110.6	N310 L311 F315 L317	N310-L313 WeakPolarHBondContact O-CB 3.49Å; N310-L313 PolarHBondContact O-N 3.11Å; N310-L313 VanDerWaalsContact O-N 3.12Å; L311-L313 PolarHBondContact O-N 2.66Å; L313-F315 VanDerWaalsContact C-N 3.28Å; L313-F315 PolarHBondContact O-N 2.95Å; L313-L317 HydrophobicContact CD1-CD1 4.5Å
314	L	78.1	Confident	80.6	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-36	177.3	-169.3	149.6	0	0	0	112.1	N310 L311 P312 P318 L398	N310-L314 PolarHBondContact O-N 3.39Å; N310-L314 VanDerWaalsContact O-N 3.1Å; L311-L314 WeakPolarHBondContact O-CB 3.25Å; L311-L314 PolarHBondContact O-N 2.93Å; P312-L314 VanDerWaalsContact C-N 3.28Å; P312-L314 PolarHBondContact O-N 2.96Å; L314-P318 WeakPolarHBondContact O-CD 3.46Å; L314-P318 VanDerWaalsContact O-CG 3.23Å; L314-P318 WeakPolarHBondContact O-CG 3.29Å; L314-L398 HydrophobicContact CD1-CD2 3.51Å
315	F	75.9	Confident	80.6	Confident	43 Å²	43	62.7 Å²	62.7	19%	0.189	32%	0.318	C	S	.	.	H	α-helix	trans	-95	-26.3	-177.2	-64.6	-59.2	0	0	0	114.9	L311 P312 L313 K319 V434 Q435 L438	L311-F315 HydrophobicContact CD1-CE2 3.83Å; L311-F315 HydrophobicContact CD2-CE2 4.33Å; L311-F315 HydrophobicContact CG-CD2 4.11Å; L311-F315 HydrophobicContact CG-CE2 3.67Å; L311-F315 WeakPolarHBondContact O-CD2 3.33Å; L311-F315 PolarHBondContact O-N 3.36Å; P312-F315 PolarHBondContact O-N 3.11Å; L313-F315 VanDerWaalsContact C-N 3.28Å; L313-F315 PolarHBondContact O-N 2.95Å; F315-K319 WeakPolarHBondContact O-CB 3.47Å; F315-K319 PolarHBondContact O-N 3.48Å; F315-K319 VanDerWaalsContact O-N 3.15Å; F315-V434 HydrophobicContact CE2-CB 4.43Å; F315-V434 HydrophobicContact CE2-CG1 3.53Å; F315-V434 HydrophobicContact CZ-CB 4.19Å; F315-V434 HydrophobicContact CZ-CG1 3.63Å; F315-Q435 HydrophobicContact CE1-CB 4.09Å; F315-Q435 HydrophobicContact CE1-CG 4.46Å; F315-Q435 HydrophobicContact CZ-CB 4.41Å; F315-L438 HydrophobicContact CB-CD1 4.38Å; F315-L438 HydrophobicContact CD1-CD1 3.45Å; F315-L438 VanDerWaalsContact CD1-CD1 3.45Å; F315-L438 HydrophobicContact CD2-CD1 3.57Å; F315-L438 HydrophobicContact CE1-CD1 3.48Å; F315-L438 VanDerWaalsContact CE1-CD1 3.48Å; F315-L438 HydrophobicContact CE2-CD1 3.57Å; F315-L438 HydrophobicContact CG-CD1 3.52Å; F315-L438 HydrophobicContact CZ-CD1 3.55Å
316	L	78.6	Confident	80.6	Confident	68 Å²	68	64.3 Å²	64.3	36%	0.356	32%	0.323	S	S	.	.	H	α-helix	trans	-70.2	-38.3	-174.7	-126.4	128	0	0	0	113.1	P312 K320	P312-L316 VanDerWaalsContact O-CB 3.32Å; P312-L316 WeakPolarHBondContact O-CB 3.39Å; P312-L316 PolarHBondContact O-N 3.26Å; L316-K320 PolarHBondContact O-N 3.3Å
317	L	77.1	Confident	80.9	Confident	90 Å²	90	66.1 Å²	66.1	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-56.3	179.2	-111.4	71.8	0	0	0	111.2	L313 K319 K320 T390	L313-L317 HydrophobicContact CD1-CD1 4.5Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.18Å; L317-K320 PolarHBondContact O-N 2.68Å; L317-T390 HydrophobicContact CB-CG2 4.18Å; L317-T390 HydrophobicContact CD2-CG2 4.02Å; L317-T390 HydrophobicContact CG-CG2 4.46Å
318	P	77.1	Confident	81.2	Confident	15 Å²	15	67.2 Å²	67.2	10%	0.097	34%	0.342	C	S	.	.	H	α-helix	trans	-57.7	-40.3	177.6	-27.6	37.6	0	0	0	112.5	L314 K320 L321 G322 T391	L314-P318 WeakPolarHBondContact O-CD 3.46Å; L314-P318 VanDerWaalsContact O-CG 3.23Å; L314-P318 WeakPolarHBondContact O-CG 3.29Å; P318-K320 VanDerWaalsContact C-N 3.3Å; P318-K320 PolarHBondContact O-N 2.93Å; P318-L321 PolarHBondContact O-N 3.41Å; P318-L321 VanDerWaalsContact O-N 3.15Å; P318-G322 PolarHBondContact O-N 3.01Å; P318-T391 WeakPolarHBondContact CB-OG1 3.48Å; P318-T391 HydrophobicContact CG-CG2 4.35Å
319	K	79.2	Confident	81.4	Confident	102 Å²	102	64.7 Å²	64.7	44%	0.443	33%	0.333	S	S	.	.	H	α-helix	trans	-58.7	-36.8	179.7	-178.3	172.5	-177.2	168.3	0	113.9	F315 L317 K323	F315-K319 WeakPolarHBondContact O-CB 3.47Å; F315-K319 PolarHBondContact O-N 3.48Å; F315-K319 VanDerWaalsContact O-N 3.15Å; L317-K319 VanDerWaalsContact C-N 3.28Å; L317-K319 PolarHBondContact O-N 3.18Å; K319-K323 PolarHBondContact O-N 2.94Å
320	K	80.1	Confident	81.7	Confident	151 Å²	151	64 Å²	64	66%	0.657	33%	0.333	S	S	*	.	H	α-helix	trans	-69	-41.2	178.5	-77.2	-172.7	178.5	-176.4	0	111.6	L316 L317 P318	L316-K320 PolarHBondContact O-N 3.3Å; L317-K320 PolarHBondContact O-N 2.68Å; P318-K320 VanDerWaalsContact C-N 3.3Å; P318-K320 PolarHBondContact O-N 2.93Å
321	L	79.7	Confident	82.3	Confident	61 Å²	61	67 Å²	67	32%	0.319	34%	0.344	S	S	.	.	H	α-helix	trans	-73.1	-40	178.6	-69.6	168.4	0	0	0	111.8	P318 K323 V324 H325 T390	P318-L321 PolarHBondContact O-N 3.41Å; P318-L321 VanDerWaalsContact O-N 3.15Å; L321-K323 PolarHBondContact O-N 3.36Å; L321-V324 WeakPolarHBondContact O-CA 3.42Å; L321-V324 WeakPolarHBondContact O-CB 3.14Å; L321-V324 PolarHBondContact O-N 2.89Å; L321-H325 PolarHBondContact O-N 2.95Å; L321-H325 VanDerWaalsContact O-N 3.11Å; L321-T390 HydrophobicContact CD1-CG2 3.64Å; L321-T390 WeakPolarHBondContact CD1-OG1 3.43Å
322	G	80	Confident	82.8	Confident	13 Å²	13	66.7 Å²	66.7	13%	0.134	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-31	176.8	0	0	0	0	0	113.2	P318 V324 H325 Q326	P318-G322 PolarHBondContact O-N 3.01Å; G322-V324 VanDerWaalsContact C-N 3.3Å; G322-V324 PolarHBondContact O-N 3.26Å; G322-H325 PolarHBondContact O-N 3.28Å; G322-Q326 VanDerWaalsContact O-CB 3.28Å; G322-Q326 WeakPolarHBondContact O-CB 3.46Å; G322-Q326 PolarHBondContact O-N 3.27Å
323	K	83.1	Confident	83.2	Confident	140 Å²	140	72.3 Å²	72.3	61%	0.609	37%	0.367	S	S	*	.	H	α-helix	trans	-61.3	-38.9	171.3	-78.4	-171.1	176.4	-165	0	112.8	K319 L321 S327	K319-K323 PolarHBondContact O-N 2.94Å; L321-K323 PolarHBondContact O-N 3.36Å; K323-S327 WeakPolarHBondContact O-CB 3.46Å; K323-S327 PolarHBondContact O-N 2.84Å; K323-S327 PolarHBondContact O-OG 3.11Å
324	V	85.8	Confident	83.9	Confident	78 Å²	78	72.4 Å²	72.4	47%	0.473	37%	0.365	S	S	.	.	H	α-helix	trans	-67.7	-49.9	177.7	-179.6	0	0	0	0	108.9	L321 G322 Q326 S327 L328	L321-V324 WeakPolarHBondContact O-CA 3.42Å; L321-V324 WeakPolarHBondContact O-CB 3.14Å; L321-V324 PolarHBondContact O-N 2.89Å; G322-V324 VanDerWaalsContact C-N 3.3Å; G322-V324 PolarHBondContact O-N 3.26Å; V324-Q326 PolarHBondContact O-N 3.3Å; V324-S327 PolarHBondContact O-N 2.87Å; V324-S327 PolarHBondContact O-OG 3.48Å; V324-L328 HydrophobicContact CG1-CD1 3.95Å; V324-L328 WeakPolarHBondContact O-CD1 3.43Å; V324-L328 PolarHBondContact O-N 3.23Å; V324-L328 VanDerWaalsContact O-N 3.1Å
325	H	85.4	Confident	84.5	Confident	39 Å²	39	72 Å²	72	18%	0.181	36%	0.364	C	S	.	.	H	α-helix	trans	-55.2	-50.8	176.5	176	48.6	0	0	0	112	L321 G322 S327 L328 A329 E380 A383 Y384 E387	L321-H325 PolarHBondContact O-N 2.95Å; L321-H325 VanDerWaalsContact O-N 3.11Å; G322-H325 PolarHBondContact O-N 3.28Å; H325-S327 VanDerWaalsContact C-N 3.33Å; H325-S327 PolarHBondContact O-N 3.03Å; H325-L328 PolarHBondContact O-N 3.45Å; H325-L328 VanDerWaalsContact O-N 3.08Å; H325-A329 PolarHBondContact O-N 3.04Å; H325-E380 IonicContact CE1-OE1 3.74Å; H325-A383 HydrophobicContact CB-CB 4.22Å; H325-Y384 AromaticContact NE2-CD2 3.9Å; H325-E387 WeakPolarHBondContact CB-OE2 3.34Å; H325-E387 IonicContact CD2-OE2 2.83Å; H325-E387 PolarHBondContact CD2-OE2 2.83Å; H325-E387 IonicContact CG-OE2 3.18Å
326	Q	83.9	Confident	85.3	Confident	126 Å²	126	74 Å²	74	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-58.7	-41.2	177.9	-170.1	-179.9	15.3	0	0	112.6	G322 V324 L328 A329 V330	G322-Q326 VanDerWaalsContact O-CB 3.28Å; G322-Q326 WeakPolarHBondContact O-CB 3.46Å; G322-Q326 PolarHBondContact O-N 3.27Å; V324-Q326 PolarHBondContact O-N 3.3Å; Q326-L328 VanDerWaalsContact C-N 3.29Å; Q326-L328 PolarHBondContact O-N 3.3Å; Q326-A329 PolarHBondContact O-N 2.87Å; Q326-V330 WeakPolarHBondContact O-CG2 3.21Å; Q326-V330 PolarHBondContact O-N 3.21Å; Q326-V330 VanDerWaalsContact O-N 3.12Å
327	S	88.3	Confident	85.8	Confident	58 Å²	58	73.5 Å²	73.5	41%	0.406	38%	0.381	S	S	.	.	H	α-helix	trans	-66.7	-30.6	178	75.5	0	0	0	0	113.3	K323 V324 H325 K331	K323-S327 WeakPolarHBondContact O-CB 3.46Å; K323-S327 PolarHBondContact O-N 2.84Å; K323-S327 PolarHBondContact O-OG 3.11Å; V324-S327 PolarHBondContact O-N 2.87Å; V324-S327 PolarHBondContact O-OG 3.48Å; H325-S327 VanDerWaalsContact C-N 3.33Å; H325-S327 PolarHBondContact O-N 3.03Å; S327-K331 WeakPolarHBondContact O-CG 3.43Å
328	L	89.1	Confident	86.4	Confident	31 Å²	31	73.7 Å²	73.7	16%	0.162	38%	0.378	C	S	.	.	H	α-helix	trans	-76.5	-41.1	174.6	-89.4	77.2	0	0	0	111.2	V324 H325 Q326 V330 K331 V332 K379 E380	V324-L328 HydrophobicContact CG1-CD1 3.95Å; V324-L328 WeakPolarHBondContact O-CD1 3.43Å; V324-L328 PolarHBondContact O-N 3.23Å; V324-L328 VanDerWaalsContact O-N 3.1Å; H325-L328 PolarHBondContact O-N 3.45Å; H325-L328 VanDerWaalsContact O-N 3.08Å; Q326-L328 VanDerWaalsContact C-N 3.29Å; Q326-L328 PolarHBondContact O-N 3.3Å; L328-V330 VanDerWaalsContact C-N 3.28Å; L328-V330 PolarHBondContact O-N 3.43Å; L328-K331 WeakPolarHBondContact O-CB 3.14Å; L328-K331 PolarHBondContact O-N 2.88Å; L328-V332 PolarHBondContact O-N 3.26Å; L328-K379 HydrophobicContact CD2-CB 3.47Å; L328-K379 VanDerWaalsContact CD2-CB 3.47Å; L328-E380 HydrophobicContact CB-CB 4.15Å; L328-E380 HydrophobicContact CB-CG 4.32Å; L328-E380 HydrophobicContact CD2-CB 4.43Å
329	A	88.1	Confident	87.2	Confident	28 Å²	28	73.1 Å²	73.1	23%	0.231	38%	0.375	C	S	.	.	H	α-helix	trans	-56.7	-42.4	176.5	0	0	0	0	0	111.7	H325 Q326 K331 V332 Q333 E380	H325-A329 PolarHBondContact O-N 3.04Å; Q326-A329 PolarHBondContact O-N 2.87Å; A329-K331 VanDerWaalsContact C-N 3.35Å; A329-K331 PolarHBondContact O-N 3.29Å; A329-V332 PolarHBondContact O-N 3.24Å; A329-Q333 WeakPolarHBondContact O-CB 3.28Å; A329-Q333 PolarHBondContact O-N 3.4Å; A329-E380 WeakPolarHBondContact CB-OE1 3.28Å
330	V	89.1	Confident	87.8	Confident	84 Å²	84	71.4 Å²	71.4	51%	0.509	37%	0.373	S	S	.	.	H	α-helix	trans	-60.6	-42.3	174.9	172.8	0	0	0	0	111.8	Q326 L328 Q333 E334	Q326-V330 WeakPolarHBondContact O-CG2 3.21Å; Q326-V330 PolarHBondContact O-N 3.21Å; Q326-V330 VanDerWaalsContact O-N 3.12Å; L328-V330 VanDerWaalsContact C-N 3.28Å; L328-V330 PolarHBondContact O-N 3.43Å; V330-Q333 PolarHBondContact O-N 3.26Å; V330-E334 PolarHBondContact O-N 3.08Å
331	K	90.8	Very high	88.4	Confident	115 Å²	115	70.4 Å²	70.4	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-37.5	177.8	-68.8	176.4	-178.5	179.7	0	112.3	S327 L328 A329 E334 S335	S327-K331 WeakPolarHBondContact O-CG 3.43Å; L328-K331 WeakPolarHBondContact O-CB 3.14Å; L328-K331 PolarHBondContact O-N 2.88Å; A329-K331 VanDerWaalsContact C-N 3.35Å; A329-K331 PolarHBondContact O-N 3.29Å; K331-E334 PolarHBondContact O-N 3.13Å; K331-S335 WeakPolarHBondContact O-CB 3.43Å; K331-S335 PolarHBondContact O-N 3.36Å
332	V	92.1	Very high	89	Confident	18 Å²	18	68.3 Å²	68.3	11%	0.109	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-43.4	174.8	170.2	0	0	0	0	110.5	L328 A329 E334 S335 L336 L376 E380	L328-V332 PolarHBondContact O-N 3.26Å; A329-V332 PolarHBondContact O-N 3.24Å; V332-E334 PolarHBondContact O-N 3.02Å; V332-S335 PolarHBondContact O-N 2.9Å; V332-L336 WeakPolarHBondContact O-CB 3.47Å; V332-L336 PolarHBondContact O-N 2.86Å; V332-L376 HydrophobicContact CG2-CB 3.61Å; V332-E380 WeakPolarHBondContact CB-OE2 3.28Å; V332-E380 HydrophobicContact CG2-CB 4.35Å; V332-E380 WeakPolarHBondContact CG2-OE2 3.38Å
333	Q	88.4	Confident	89.6	Confident	140 Å²	140	69.1 Å²	69.1	65%	0.654	37%	0.365	S	S	*	.	H	α-helix	trans	-62.9	-40.4	176.1	-169.7	176.1	1.6	0	0	112.4	A329 V330 L336 A337	A329-Q333 WeakPolarHBondContact O-CB 3.28Å; A329-Q333 PolarHBondContact O-N 3.4Å; V330-Q333 PolarHBondContact O-N 3.26Å; Q333-L336 PolarHBondContact O-N 3.35Å; Q333-A337 PolarHBondContact O-N 3.02Å
334	E	91.4	Very high	90.1	Very high	103 Å²	103	67.8 Å²	67.8	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-64.9	-41.5	174.7	-166.6	-167.5	151.2	0	0	111.9	V330 K331 V332 L336 A337 K338	V330-E334 PolarHBondContact O-N 3.08Å; K331-E334 PolarHBondContact O-N 3.13Å; V332-E334 PolarHBondContact O-N 3.02Å; E334-L336 VanDerWaalsContact C-N 3.33Å; E334-A337 PolarHBondContact O-N 3.39Å; E334-K338 WeakPolarHBondContact O-CG 3.46Å; E334-K338 PolarHBondContact O-N 3.45Å; E334-K338 VanDerWaalsContact O-N 3.07Å; E334-K338 WeakPolarHBondContact OE1-CE 3.43Å; E334-K338 IonicContact OE1-NZ 3.54Å; E334-K338 PolarHBondContact OE1-NZ 3.28Å
335	S	91.8	Very high	90.4	Very high	10 Å²	10	69.7 Å²	69.7	7%	0.07	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-39.1	175.5	-168.4	0	0	0	0	111.9	K331 V332 K338 S339	K331-S335 WeakPolarHBondContact O-CB 3.43Å; K331-S335 PolarHBondContact O-N 3.36Å; V332-S335 PolarHBondContact O-N 2.9Å; S335-K338 PolarHBondContact O-N 3.39Å; S335-S339 PolarHBondContact O-N 3.26Å
336	L	92.1	Very high	90.8	Very high	84 Å²	84	68.7 Å²	68.7	44%	0.44	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-46.4	175.2	178.1	65.5	0	0	0	110.7	V332 Q333 E334 K338 S339 T340 M373	V332-L336 WeakPolarHBondContact O-CB 3.47Å; V332-L336 PolarHBondContact O-N 2.86Å; Q333-L336 PolarHBondContact O-N 3.35Å; E334-L336 VanDerWaalsContact C-N 3.33Å; L336-K338 VanDerWaalsContact C-N 3.29Å; L336-K338 PolarHBondContact O-N 3.12Å; L336-S339 WeakPolarHBondContact CA-OG 3.44Å; L336-S339 PolarHBondContact O-N 3.43Å; L336-S339 VanDerWaalsContact O-N 3.08Å; L336-S339 PolarHBondContact O-OG 3.1Å; L336-T340 PolarHBondContact O-N 3.45Å; L336-T340 PolarHBondContact O-OG1 3.21Å; L336-T340 VanDerWaalsContact O-OG1 3.09Å; L336-M373 HydrophobicContact CB-SD 4.23Å; L336-M373 HydrophobicContact CD1-SD 4.04Å
337	A	89	Confident	91.3	Very high	57 Å²	57	68.5 Å²	68.5	47%	0.471	37%	0.369	S	S	.	.	H	α-helix	trans	-57.2	-42.5	176.7	0	0	0	0	0	111.9	Q333 E334 T340 Q341	Q333-A337 PolarHBondContact O-N 3.02Å; E334-A337 PolarHBondContact O-N 3.39Å; A337-T340 PolarHBondContact O-N 3.43Å; A337-Q341 WeakPolarHBondContact O-CB 3.32Å; A337-Q341 PolarHBondContact O-N 3.37Å
338	K	90.9	Very high	91.5	Very high	94 Å²	94	70.5 Å²	70.5	41%	0.409	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-42.6	174.4	-70.8	172.3	-174	166.2	0	112.4	E334 S335 L336 Q341 V342	E334-K338 WeakPolarHBondContact O-CG 3.46Å; E334-K338 PolarHBondContact O-N 3.45Å; E334-K338 VanDerWaalsContact O-N 3.07Å; E334-K338 WeakPolarHBondContact OE1-CE 3.43Å; E334-K338 IonicContact OE1-NZ 3.54Å; E334-K338 PolarHBondContact OE1-NZ 3.28Å; S335-K338 PolarHBondContact O-N 3.39Å; L336-K338 VanDerWaalsContact C-N 3.29Å; L336-K338 PolarHBondContact O-N 3.12Å; K338-Q341 PolarHBondContact O-N 2.95Å; K338-V342 WeakPolarHBondContact O-CG2 3.46Å; K338-V342 PolarHBondContact O-N 2.95Å
339	S	92.8	Very high	91.8	Very high	3 Å²	3	70.7 Å²	70.7	2%	0.021	39%	0.389	C	S	.	.	H	α-helix	trans	-66.1	-40.3	175.7	58.2	0	0	0	0	112.6	S335 L336 Q341 V342 A343 F366	S335-S339 PolarHBondContact O-N 3.26Å; L336-S339 WeakPolarHBondContact CA-OG 3.44Å; L336-S339 PolarHBondContact O-N 3.43Å; L336-S339 VanDerWaalsContact O-N 3.08Å; L336-S339 PolarHBondContact O-OG 3.1Å; S339-Q341 VanDerWaalsContact C-N 3.32Å; S339-Q341 PolarHBondContact O-N 3.12Å; S339-V342 PolarHBondContact O-N 2.88Å; S339-A343 PolarHBondContact O-N 2.72Å; S339-A343 VanDerWaalsContact O-N 3.08Å; S339-F366 WeakPolarHBondContact O-CE2 3.28Å
340	T	92.5	Very high	92.1	Very high	66 Å²	66	73.4 Å²	73.4	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-38.6	176.6	-58.5	0	0	0	0	111.1	L336 A337 A343 L344	L336-T340 PolarHBondContact O-N 3.45Å; L336-T340 PolarHBondContact O-OG1 3.21Å; L336-T340 VanDerWaalsContact O-OG1 3.09Å; A337-T340 PolarHBondContact O-N 3.43Å; T340-A343 PolarHBondContact O-N 3.42Å; T340-L344 HydrophobicContact CG2-CD1 4.08Å; T340-L344 HydrophobicContact CG2-CG 4.37Å; T340-L344 WeakPolarHBondContact O-CB 3.33Å; T340-L344 WeakPolarHBondContact O-CG 3.47Å; T340-L344 PolarHBondContact O-N 3.42Å
341	Q	91.3	Very high	92.5	Very high	131 Å²	131	74.2 Å²	74.2	61%	0.612	41%	0.405	S	S	*	.	H	α-helix	trans	-61.4	-44.3	175.8	-175.1	178.3	-3.1	0	0	112	A337 K338 S339 A343 L344 E345	A337-Q341 WeakPolarHBondContact O-CB 3.32Å; A337-Q341 PolarHBondContact O-N 3.37Å; K338-Q341 PolarHBondContact O-N 2.95Å; S339-Q341 VanDerWaalsContact C-N 3.32Å; S339-Q341 PolarHBondContact O-N 3.12Å; Q341-A343 VanDerWaalsContact C-N 3.33Å; Q341-A343 PolarHBondContact O-N 3.33Å; Q341-L344 PolarHBondContact O-N 3.07Å; Q341-E345 WeakPolarHBondContact O-CB 3.32Å; Q341-E345 PolarHBondContact O-N 2.97Å
342	V	92.7	Very high	92.8	Very high	17 Å²	17	72.3 Å²	72.3	10%	0.103	40%	0.403	C	S	.	.	H	α-helix	trans	-61	-43.4	175.6	173.2	0	0	0	0	111	K338 S339 E345 A346 K365	K338-V342 WeakPolarHBondContact O-CG2 3.46Å; K338-V342 PolarHBondContact O-N 2.95Å; S339-V342 PolarHBondContact O-N 2.88Å; V342-E345 PolarHBondContact O-N 3.41Å; V342-A346 PolarHBondContact O-N 3.45Å; V342-A346 VanDerWaalsContact O-N 3.07Å; V342-K365 HydrophobicContact CG1-CD 4.06Å; V342-K365 HydrophobicContact CG1-CG 4.17Å
343	A	94	Very high	93.1	Very high	29 Å²	29	72.2 Å²	72.2	24%	0.24	40%	0.403	C	S	.	.	H	α-helix	trans	-63.8	-42.6	176.9	0	0	0	0	0	112.3	S339 T340 Q341 A346 L347 F366	S339-A343 PolarHBondContact O-N 2.72Å; S339-A343 VanDerWaalsContact O-N 3.08Å; T340-A343 PolarHBondContact O-N 3.42Å; Q341-A343 VanDerWaalsContact C-N 3.33Å; Q341-A343 PolarHBondContact O-N 3.33Å; A343-A346 PolarHBondContact O-N 2.9Å; A343-L347 VanDerWaalsContact O-CB 3.3Å; A343-L347 WeakPolarHBondContact O-CB 3.43Å; A343-L347 VanDerWaalsContact O-CG 3.22Å; A343-L347 WeakPolarHBondContact O-CG 3.44Å; A343-L347 PolarHBondContact O-N 2.97Å; A343-F366 HydrophobicContact CB-CD2 4.28Å; A343-F366 HydrophobicContact CB-CE2 3.94Å
344	L	92.3	Very high	93.5	Very high	113 Å²	113	73.6 Å²	73.6	59%	0.592	40%	0.402	S	S	*	.	H	α-helix	trans	-62.4	-43.9	177.1	-76.5	170	0	0	0	111.8	T340 Q341 S348	T340-L344 HydrophobicContact CG2-CD1 4.08Å; T340-L344 HydrophobicContact CG2-CG 4.37Å; T340-L344 WeakPolarHBondContact O-CB 3.33Å; T340-L344 WeakPolarHBondContact O-CG 3.47Å; T340-L344 PolarHBondContact O-N 3.42Å; Q341-L344 PolarHBondContact O-N 3.07Å; L344-S348 WeakPolarHBondContact O-CB 3.34Å; L344-S348 PolarHBondContact O-N 3.28Å; L344-S348 PolarHBondContact O-OG 3.04Å
345	E	92.4	Very high	93.8	Very high	117 Å²	117	72.9 Å²	72.9	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-59.2	-51.9	176.9	-172.8	178.4	-167.1	0	0	110.9	Q341 V342 L347 S348 A349 K365	Q341-E345 WeakPolarHBondContact O-CB 3.32Å; Q341-E345 PolarHBondContact O-N 2.97Å; V342-E345 PolarHBondContact O-N 3.41Å; E345-L347 PolarHBondContact O-N 2.99Å; E345-S348 PolarHBondContact O-OG 3.34Å; E345-A349 PolarHBondContact O-N 3.4Å; E345-K365 IonicContact OE2-NZ 3.64Å
346	A	93.6	Very high	94	Very high	18 Å²	18	79.9 Å²	79.9	15%	0.149	44%	0.438	C	S	.	.	H	α-helix	trans	-63.1	-43.8	-179.9	0	0	0	0	0	113.1	V342 A343 A349 M350 E362	V342-A346 PolarHBondContact O-N 3.45Å; V342-A346 VanDerWaalsContact O-N 3.07Å; A343-A346 PolarHBondContact O-N 2.9Å; A346-A349 CarbonylContact O-C 3.53Å; A346-M350 PolarHBondContact O-N 2.9Å; A346-E362 HydrophobicContact CB-CB 4.28Å; A346-E362 HydrophobicContact CB-CG 4.17Å
347	L	95.1	Very high	94.3	Very high	123 Å²	123	79.6 Å²	79.6	64%	0.644	45%	0.448	S	S	*	.	H	α-helix	trans	-73.9	-35.6	-178.2	-68.2	174.3	0	0	0	112.8	A343 E345 A349 M350	A343-L347 VanDerWaalsContact O-CB 3.3Å; A343-L347 WeakPolarHBondContact O-CB 3.43Å; A343-L347 VanDerWaalsContact O-CG 3.22Å; A343-L347 WeakPolarHBondContact O-CG 3.44Å; A343-L347 PolarHBondContact O-N 2.97Å; E345-L347 PolarHBondContact O-N 2.99Å; L347-A349 VanDerWaalsContact C-N 3.28Å; L347-A349 PolarHBondContact O-N 3.44Å; L347-M350 WeakPolarHBondContact O-CB 3.45Å; L347-M350 PolarHBondContact O-N 3.36Å
348	S	92.9	Very high	94.6	Very high	99 Å²	99	80.2 Å²	80.2	69%	0.692	44%	0.443	S	S	*	.	H	α-helix	trans	-66.9	-32.4	176.8	66	0	0	0	0	112.3	L344 E345	L344-S348 WeakPolarHBondContact O-CB 3.34Å; L344-S348 PolarHBondContact O-N 3.28Å; L344-S348 PolarHBondContact O-OG 3.04Å; E345-S348 PolarHBondContact O-OG 3.34Å
349	A	94.5	Very high	94.9	Very high	36 Å²	36	78.6 Å²	78.6	30%	0.298	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	30	177.1	0	0	0	0	0	112.6	E345 A346 L347 P351 T352 V353	E345-A349 PolarHBondContact O-N 3.4Å; A346-A349 CarbonylContact O-C 3.53Å; L347-A349 VanDerWaalsContact C-N 3.28Å; L347-A349 PolarHBondContact O-N 3.44Å; A349-P351 VanDerWaalsContact C-CD 3.45Å; A349-P351 VanDerWaalsContact C-N 3.34Å; A349-T352 WeakPolarHBondContact O-CA 3.48Å; A349-T352 VanDerWaalsContact O-CB 3.26Å; A349-T352 WeakPolarHBondContact O-CB 3.5Å; A349-T352 PolarHBondContact O-N 3.01Å; A349-V353 PolarHBondContact O-N 2.64Å
350	M	94.9	Very high	95.1	Very high	84 Å²	84	85.4 Å²	85.4	41%	0.414	47%	0.468	S	S	.	.	H	α-helix	trans	-53.5	-40.2	-175	-168.3	64.9	-168.4	0	0	114.3	A346 L347 T352 V353 R354	A346-M350 PolarHBondContact O-N 2.9Å; L347-M350 WeakPolarHBondContact O-CB 3.45Å; L347-M350 PolarHBondContact O-N 3.36Å; M350-T352 VanDerWaalsContact C-N 3.26Å; M350-T352 PolarHBondContact O-N 2.94Å; M350-V353 PolarHBondContact O-N 2.79Å; M350-R354 WeakPolarHBondContact O-CB 3.33Å; M350-R354 PolarHBondContact O-N 2.69Å
351	P	96.7	Very high	95.3	Very high	102 Å²	102	83.8 Å²	83.8	66%	0.662	47%	0.465	S	S	*	.	H	α-helix	trans	-60	-36.1	174.4	-24.6	35.6	0	0	0	113.1	A349 S355	A349-P351 VanDerWaalsContact C-CD 3.45Å; A349-P351 VanDerWaalsContact C-N 3.34Å; P351-S355 WeakPolarHBondContact O-CB 3.45Å; P351-S355 PolarHBondContact O-N 3.01Å; P351-S355 PolarHBondContact O-OG 3.44Å
352	T	97.3	Very high	95.5	Very high	74 Å²	74	79.7 Å²	79.7	45%	0.454	45%	0.446	S	S	.	.	H	α-helix	trans	-70.1	-47.2	176.6	-50.3	0	0	0	0	110.9	A349 M350 R354 S355 F356	A349-T352 WeakPolarHBondContact O-CA 3.48Å; A349-T352 VanDerWaalsContact O-CB 3.26Å; A349-T352 WeakPolarHBondContact O-CB 3.5Å; A349-T352 PolarHBondContact O-N 3.01Å; M350-T352 VanDerWaalsContact C-N 3.26Å; M350-T352 PolarHBondContact O-N 2.94Å; T352-R354 PolarHBondContact O-N 3.35Å; T352-S355 WeakPolarHBondContact CA-OG 3.46Å; T352-S355 PolarHBondContact O-N 3.47Å; T352-S355 PolarHBondContact O-OG 3.28Å; T352-F356 HydrophobicContact CG2-CD2 3.74Å; T352-F356 HydrophobicContact CG2-CE2 3.72Å; T352-F356 WeakPolarHBondContact O-CD2 3.3Å; T352-F356 PolarHBondContact O-N 2.88Å
353	V	97.7	Very high	95.7	Very high	17 Å²	17	81.3 Å²	81.3	10%	0.103	46%	0.46	C	S	.	.	H	α-helix	trans	-56.5	-43.3	175.9	179.5	0	0	0	0	110.4	A349 M350 F356 A357 N358 E359 E362	A349-V353 PolarHBondContact O-N 2.64Å; M350-V353 PolarHBondContact O-N 2.79Å; V353-F356 PolarHBondContact O-N 2.74Å; V353-A357 PolarHBondContact O-N 3.34Å; V353-A357 VanDerWaalsContact O-N 3.08Å; V353-N358 PolarHBondContact O-N 3.11Å; V353-N358 VanDerWaalsContact O-N 3.11Å; V353-E359 HydrophobicContact CG1-CG 4.23Å; V353-E362 HydrophobicContact CG1-CG 4.39Å; V353-E362 HydrophobicContact CG2-CG 4.48Å
354	R	96.9	Very high	95.8	Very high	169 Å²	169	85.1 Å²	85.1	64%	0.638	47%	0.473	S	S	*	.	H	α-helix	trans	-69.3	-38.6	178.2	-166	60.4	163.3	-168.9	0.3	112.8	M350 T352 F356 A357 E359	M350-R354 WeakPolarHBondContact O-CB 3.33Å; M350-R354 PolarHBondContact O-N 2.69Å; T352-R354 PolarHBondContact O-N 3.35Å; R354-F356 VanDerWaalsContact C-N 3.26Å; R354-F356 PolarHBondContact O-N 3.37Å; R354-A357 PolarHBondContact O-N 3.33Å; R354-E359 WeakPolarHBondContact CD-OE1 3.42Å; R354-E359 IonicContact CZ-OE1 3.97Å; R354-E359 IonicContact NE-OE1 2.93Å; R354-E359 IonicContact NH1-OE1 3.99Å; R354-E359 PolarHBondContact NH1-OE1 3.02Å
355	S	97.8	Very high	95.9	Very high	87 Å²	87	83.5 Å²	83.5	61%	0.608	46%	0.461	S	S	*	.	H	α-helix	trans	-66.9	-29.2	178.4	66.6	0	0	0	0	112.6	P351 T352	P351-S355 WeakPolarHBondContact O-CB 3.45Å; P351-S355 PolarHBondContact O-N 3.01Å; P351-S355 PolarHBondContact O-OG 3.44Å; T352-S355 WeakPolarHBondContact CA-OG 3.46Å; T352-S355 PolarHBondContact O-N 3.47Å; T352-S355 PolarHBondContact O-OG 3.28Å
356	F	97.5	Very high	96.1	Very high	158 Å²	158	81.3 Å²	81.3	69%	0.693	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	0.6	176.1	-71.4	-73.5	0	0	0	113.9	T352 V353 R354 N358	T352-F356 HydrophobicContact CG2-CD2 3.74Å; T352-F356 HydrophobicContact CG2-CE2 3.72Å; T352-F356 WeakPolarHBondContact O-CD2 3.3Å; T352-F356 PolarHBondContact O-N 2.88Å; V353-F356 PolarHBondContact O-N 2.74Å; R354-F356 VanDerWaalsContact C-N 3.26Å; R354-F356 PolarHBondContact O-N 3.37Å; F356-N358 HydrophobicContact CB-CB 4.49Å; F356-N358 PolarHBondContact O-N 3.07Å
357	A	97.1	Very high	96.2	Very high	78 Å²	78	87.3 Å²	87.3	65%	0.645	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	39	-176.5	0	0	0	0	0	113.6	V353 R354 E359	V353-A357 PolarHBondContact O-N 3.34Å; V353-A357 VanDerWaalsContact O-N 3.08Å; R354-A357 PolarHBondContact O-N 3.33Å; A357-E359 VanDerWaalsContact CA-OE2 3.3Å; A357-E359 WeakPolarHBondContact CA-OE2 3.27Å
358	N	96.6	Very high	96.2	Very high	69 Å²	69	86.8 Å²	86.8	37%	0.369	46%	0.463	S	S	.	.			trans	-100.7	25.9	-174.3	-167	45.1	0	0	0	113.2	V353 F356 E360 G361 E362	V353-N358 PolarHBondContact O-N 3.11Å; V353-N358 VanDerWaalsContact O-N 3.11Å; F356-N358 HydrophobicContact CB-CB 4.49Å; F356-N358 PolarHBondContact O-N 3.07Å; N358-E360 VanDerWaalsContact C-N 3.34Å; N358-E360 PolarHBondContact O-N 3.04Å; N358-G361 PolarHBondContact O-N 3.13Å; N358-E362 PolarHBondContact O-N 2.88Å; N358-E362 VanDerWaalsContact O-N 3.13Å
359	E	96.8	Very high	96.3	Very high	60 Å²	60	84.7 Å²	84.7	28%	0.28	44%	0.442	S	S	.	.	H	α-helix	trans	-60.7	-42.5	-178	-61.6	91.6	153.9	0	0	112.2	V353 R354 A357 E362 A363	V353-E359 HydrophobicContact CG1-CG 4.23Å; R354-E359 WeakPolarHBondContact CD-OE1 3.42Å; R354-E359 IonicContact CZ-OE1 3.97Å; R354-E359 IonicContact NE-OE1 2.93Å; R354-E359 IonicContact NH1-OE1 3.99Å; R354-E359 PolarHBondContact NH1-OE1 3.02Å; A357-E359 VanDerWaalsContact CA-OE2 3.3Å; A357-E359 WeakPolarHBondContact CA-OE2 3.27Å; E359-E362 PolarHBondContact O-N 3.45Å; E359-A363 WeakPolarHBondContact O-CB 3.29Å; E359-A363 PolarHBondContact O-N 2.75Å
360	E	97.1	Very high	96.2	Very high	147 Å²	147	86.1 Å²	86.1	69%	0.687	44%	0.444	S	S	*	.	H	α-helix	trans	-69.7	-34.5	-179.9	-164.9	61.6	-147.9	0	0	111.9	N358 A363 Q364	N358-E360 VanDerWaalsContact C-N 3.34Å; N358-E360 PolarHBondContact O-N 3.04Å; E360-A363 PolarHBondContact O-N 3.21Å; E360-Q364 WeakPolarHBondContact O-CB 3.02Å; E360-Q364 PolarHBondContact O-N 2.89Å
361	G	95.8	Very high	96.2	Very high	32 Å²	32	86.9 Å²	86.9	33%	0.33	45%	0.446	S	S	.	.	H	α-helix	trans	-64.3	-45.7	176.2	0	0	0	0	0	112.1	N358 Q364 K365	N358-G361 PolarHBondContact O-N 3.13Å; G361-Q364 PolarHBondContact O-N 3.44Å; G361-K365 WeakPolarHBondContact O-CB 3.18Å; G361-K365 PolarHBondContact O-N 2.94Å
362	E	96.5	Very high	96	Very high	45 Å²	45	85.5 Å²	85.5	21%	0.21	43%	0.431	C	S	.	.	H	α-helix	trans	-67.9	-36.9	174.7	-68.3	-56.3	148.2	0	0	112.1	A346 V353 N358 E359 Q364 K365 F366	A346-E362 HydrophobicContact CB-CB 4.28Å; A346-E362 HydrophobicContact CB-CG 4.17Å; V353-E362 HydrophobicContact CG1-CG 4.39Å; V353-E362 HydrophobicContact CG2-CG 4.48Å; N358-E362 PolarHBondContact O-N 2.88Å; N358-E362 VanDerWaalsContact O-N 3.13Å; E359-E362 PolarHBondContact O-N 3.45Å; E362-Q364 PolarHBondContact O-N 2.72Å; E362-K365 PolarHBondContact O-N 3.25Å; E362-K365 IonicContact OE2-NZ 2.85Å; E362-F366 WeakPolarHBondContact O-CB 3.24Å; E362-F366 PolarHBondContact O-N 3.38Å
363	A	95.7	Very high	95.8	Very high	50 Å²	50	83.6 Å²	83.6	41%	0.413	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-42.9	174.4	0	0	0	0	0	112.2	E359 E360 F366 R367	E359-A363 WeakPolarHBondContact O-CB 3.29Å; E359-A363 PolarHBondContact O-N 2.75Å; E360-A363 PolarHBondContact O-N 3.21Å; A363-F366 PolarHBondContact O-N 2.91Å; A363-R367 WeakPolarHBondContact O-CB 3.36Å; A363-R367 PolarHBondContact O-N 2.97Å
364	Q	96.7	Very high	95.7	Very high	110 Å²	110	89 Å²	89	51%	0.514	44%	0.44	S	S	.	.	H	α-helix	trans	-67.2	-40.9	177.6	-176.3	63.5	6.4	0	0	112.1	E360 G361 E362 F366 R367 Q368	E360-Q364 WeakPolarHBondContact O-CB 3.02Å; E360-Q364 PolarHBondContact O-N 2.89Å; G361-Q364 PolarHBondContact O-N 3.44Å; E362-Q364 PolarHBondContact O-N 2.72Å; Q364-F366 VanDerWaalsContact C-N 3.34Å; Q364-F366 PolarHBondContact O-N 3.33Å; Q364-R367 WeakPolarHBondContact O-CB 3.21Å; Q364-R367 PolarHBondContact O-N 2.87Å; Q364-Q368 PolarHBondContact O-N 3.2Å
365	K	94.9	Very high	95.4	Very high	78 Å²	78	85 Å²	85	34%	0.339	43%	0.434	S	S	.	.	H	α-helix	trans	-60.5	-43.4	174.1	-174.7	-176	173.5	-167.3	0	111.3	V342 E345 G361 E362 Q368 K369	V342-K365 HydrophobicContact CG1-CD 4.06Å; V342-K365 HydrophobicContact CG1-CG 4.17Å; E345-K365 IonicContact OE2-NZ 3.64Å; G361-K365 WeakPolarHBondContact O-CB 3.18Å; G361-K365 PolarHBondContact O-N 2.94Å; E362-K365 PolarHBondContact O-N 3.25Å; E362-K365 IonicContact OE2-NZ 2.85Å; K365-Q368 PolarHBondContact O-N 3.48Å; K365-K369 PolarHBondContact O-N 2.91Å
366	F	95.8	Very high	95.2	Very high	71 Å²	71	83 Å²	83	31%	0.311	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-42.9	175.2	-173	-106.8	0	0	0	112	S339 A343 E362 A363 Q364 Q368 K369 L370	S339-F366 WeakPolarHBondContact O-CE2 3.28Å; A343-F366 HydrophobicContact CB-CD2 4.28Å; A343-F366 HydrophobicContact CB-CE2 3.94Å; E362-F366 WeakPolarHBondContact O-CB 3.24Å; E362-F366 PolarHBondContact O-N 3.38Å; A363-F366 PolarHBondContact O-N 2.91Å; Q364-F366 VanDerWaalsContact C-N 3.34Å; Q364-F366 PolarHBondContact O-N 3.33Å; F366-Q368 VanDerWaalsContact C-N 3.35Å; F366-Q368 PolarHBondContact O-N 3.4Å; F366-K369 PolarHBondContact O-N 3.32Å; F366-K369 VanDerWaalsContact O-N 3.16Å; F366-L370 HydrophobicContact CD1-CD1 3.74Å; F366-L370 HydrophobicContact CD1-CG 4.18Å; F366-L370 HydrophobicContact CE1-CD1 3.45Å; F366-L370 VanDerWaalsContact CE1-CD1 3.45Å; F366-L370 HydrophobicContact CE1-CD2 4.28Å; F366-L370 HydrophobicContact CE1-CG 3.91Å; F366-L370 HydrophobicContact CZ-CD1 4.23Å; F366-L370 HydrophobicContact CZ-CD2 4.25Å; F366-L370 HydrophobicContact CZ-CG 4.27Å; F366-L370 PolarHBondContact O-N 2.68Å
367	R	96	Very high	94.9	Very high	145 Å²	145	79.1 Å²	79.1	55%	0.547	40%	0.403	S	S	.	.	H	α-helix	trans	-57.6	-44.9	175.6	-179	-179.4	178.1	142.3	-0.4	112.3	A363 Q364 K369 L370 E371	A363-R367 WeakPolarHBondContact O-CB 3.36Å; A363-R367 PolarHBondContact O-N 2.97Å; Q364-R367 WeakPolarHBondContact O-CB 3.21Å; Q364-R367 PolarHBondContact O-N 2.87Å; R367-K369 VanDerWaalsContact C-N 3.28Å; R367-K369 PolarHBondContact O-N 3.4Å; R367-L370 WeakPolarHBondContact O-CB 3.42Å; R367-L370 PolarHBondContact O-N 2.78Å; R367-L370 VanDerWaalsContact O-N 3.13Å; R367-E371 IonicContact CZ-OE1 3.82Å; R367-E371 IonicContact NE-OE1 3.05Å; R367-E371 PolarHBondContact NE-OE1 3.35Å; R367-E371 IonicContact NH2-OE1 3.66Å; R367-E371 PolarHBondContact O-N 3.32Å
368	Q	95.5	Very high	94.8	Very high	111 Å²	111	81.9 Å²	81.9	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-58.4	-41.6	177.5	-173.5	179.6	6	0	0	111.5	Q364 K365 F366 E371 E372	Q364-Q368 PolarHBondContact O-N 3.2Å; K365-Q368 PolarHBondContact O-N 3.48Å; F366-Q368 VanDerWaalsContact C-N 3.35Å; F366-Q368 PolarHBondContact O-N 3.4Å; Q368-E371 PolarHBondContact O-N 3.15Å; Q368-E372 PolarHBondContact O-N 3.35Å
369	K	93.6	Very high	94.6	Very high	56 Å²	56	84.9 Å²	84.9	24%	0.243	41%	0.41	C	S	.	.	H	α-helix	trans	-67.2	-35.8	175.4	-66.8	-51.5	-176.4	-164.2	0	113.5	K365 F366 R367 E372 M373	K365-K369 PolarHBondContact O-N 2.91Å; F366-K369 PolarHBondContact O-N 3.32Å; F366-K369 VanDerWaalsContact O-N 3.16Å; R367-K369 VanDerWaalsContact C-N 3.28Å; R367-K369 PolarHBondContact O-N 3.4Å; K369-E372 WeakPolarHBondContact CD-OE2 3.35Å; K369-E372 VanDerWaalsContact NZ-CD 3.33Å; K369-E372 IonicContact NZ-OE1 3.44Å; K369-E372 PolarHBondContact NZ-OE1 3.39Å; K369-E372 IonicContact NZ-OE2 3.15Å; K369-E372 PolarHBondContact NZ-OE2 3.48Å; K369-M373 WeakPolarHBondContact O-CB 3.44Å; K369-M373 PolarHBondContact O-N 2.92Å
370	L	94.3	Very high	94.3	Very high	66 Å²	66	83.6 Å²	83.6	35%	0.346	40%	0.404	S	S	.	.	H	α-helix	trans	-66.8	-37.2	172.6	-71.5	177.6	0	0	0	112.6	F366 R367 M373 K374	F366-L370 HydrophobicContact CD1-CD1 3.74Å; F366-L370 HydrophobicContact CD1-CG 4.18Å; F366-L370 HydrophobicContact CE1-CD1 3.45Å; F366-L370 VanDerWaalsContact CE1-CD1 3.45Å; F366-L370 HydrophobicContact CE1-CD2 4.28Å; F366-L370 HydrophobicContact CE1-CG 3.91Å; F366-L370 HydrophobicContact CZ-CD1 4.23Å; F366-L370 HydrophobicContact CZ-CD2 4.25Å; F366-L370 HydrophobicContact CZ-CG 4.27Å; F366-L370 PolarHBondContact O-N 2.68Å; R367-L370 WeakPolarHBondContact O-CB 3.42Å; R367-L370 PolarHBondContact O-N 2.78Å; R367-L370 VanDerWaalsContact O-N 3.13Å; L370-M373 HydrophobicContact CD2-CE 3.78Å; L370-M373 PolarHBondContact O-N 3.48Å; L370-K374 WeakPolarHBondContact O-CB 3.3Å; L370-K374 PolarHBondContact O-N 3.49Å
371	E	95.1	Very high	94.1	Very high	99 Å²	99	79 Å²	79	46%	0.463	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-43.3	177.1	-74	-179.8	-172.8	0	0	111.6	R367 Q368 M373 K374 T375	R367-E371 IonicContact CZ-OE1 3.82Å; R367-E371 IonicContact NE-OE1 3.05Å; R367-E371 PolarHBondContact NE-OE1 3.35Å; R367-E371 IonicContact NH2-OE1 3.66Å; R367-E371 PolarHBondContact O-N 3.32Å; Q368-E371 PolarHBondContact O-N 3.15Å; E371-M373 PolarHBondContact O-N 3.12Å; E371-K374 PolarHBondContact O-N 3.49Å; E371-T375 PolarHBondContact O-N 2.89Å
372	E	91.8	Very high	93.9	Very high	74 Å²	74	83.5 Å²	83.5	35%	0.346	41%	0.407	S	S	.	.	H	α-helix	trans	-53.4	-52	170	-73	173	-158.8	0	0	110.6	Q368 K369 K374 T375 L376	Q368-E372 PolarHBondContact O-N 3.35Å; K369-E372 WeakPolarHBondContact CD-OE2 3.35Å; K369-E372 VanDerWaalsContact NZ-CD 3.33Å; K369-E372 IonicContact NZ-OE1 3.44Å; K369-E372 PolarHBondContact NZ-OE1 3.39Å; K369-E372 IonicContact NZ-OE2 3.15Å; K369-E372 PolarHBondContact NZ-OE2 3.48Å; E372-K374 PolarHBondContact O-N 2.99Å; E372-T375 PolarHBondContact O-N 2.71Å; E372-T375 PolarHBondContact O-OG1 2.81Å; E372-L376 PolarHBondContact O-N 3.03Å
373	M	93.3	Very high	93.6	Very high	34 Å²	34	82.2 Å²	82.2	17%	0.167	40%	0.404	C	S	.	.	H	α-helix	trans	-59.9	-42.2	178.7	-174	-172.3	70.3	0	0	112.3	L336 K369 L370 E371 T375 L376 N377	L336-M373 HydrophobicContact CB-SD 4.23Å; L336-M373 HydrophobicContact CD1-SD 4.04Å; K369-M373 WeakPolarHBondContact O-CB 3.44Å; K369-M373 PolarHBondContact O-N 2.92Å; L370-M373 HydrophobicContact CD2-CE 3.78Å; L370-M373 PolarHBondContact O-N 3.48Å; E371-M373 PolarHBondContact O-N 3.12Å; M373-T375 VanDerWaalsContact C-N 3.3Å; M373-T375 PolarHBondContact O-N 2.89Å; M373-L376 PolarHBondContact O-N 3.16Å; M373-N377 WeakPolarHBondContact O-CB 3.41Å; M373-N377 PolarHBondContact O-N 2.89Å
374	K	94.2	Very high	93.3	Very high	131 Å²	131	85.9 Å²	85.9	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-60	-38.7	-179.3	-173.8	178	-175.7	175.6	0	112	L370 E371 E372 K378	L370-K374 WeakPolarHBondContact O-CB 3.3Å; L370-K374 PolarHBondContact O-N 3.49Å; E371-K374 PolarHBondContact O-N 3.49Å; E372-K374 PolarHBondContact O-N 2.99Å; K374-K378 WeakPolarHBondContact O-CG 3.23Å; K374-K378 PolarHBondContact O-N 3.31Å
375	T	92.4	Very high	93	Very high	83 Å²	83	84 Å²	84	51%	0.509	40%	0.404	S	S	.	.	H	α-helix	trans	-67.7	-37	177.8	66.8	0	0	0	0	112.5	E371 E372 M373 K379	E371-T375 PolarHBondContact O-N 2.89Å; E372-T375 PolarHBondContact O-N 2.71Å; E372-T375 PolarHBondContact O-OG1 2.81Å; M373-T375 VanDerWaalsContact C-N 3.3Å; M373-T375 PolarHBondContact O-N 2.89Å; T375-K379 PolarHBondContact O-N 3.1Å
376	L	91.9	Very high	92.8	Very high	47 Å²	47	82.3 Å²	82.3	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-69.4	-45.2	175.1	-68.6	168.9	0	0	0	111.1	V332 E372 M373 K378 K379 E380	V332-L376 HydrophobicContact CG2-CB 3.61Å; E372-L376 PolarHBondContact O-N 3.03Å; M373-L376 PolarHBondContact O-N 3.16Å; L376-K378 VanDerWaalsContact C-N 3.31Å; L376-K378 PolarHBondContact O-N 3.29Å; L376-K379 WeakPolarHBondContact O-CB 3.41Å; L376-K379 PolarHBondContact O-N 3.2Å; L376-E380 PolarHBondContact O-N 2.84Å
377	N	92.2	Very high	92.2	Very high	76 Å²	76	81.2 Å²	81.2	41%	0.406	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-37.9	-179.9	-163.2	-3.7	0	0	0	111.8	M373 K379 E380 A381	M373-N377 WeakPolarHBondContact O-CB 3.41Å; M373-N377 PolarHBondContact O-N 2.89Å; N377-K379 VanDerWaalsContact C-N 3.34Å; N377-K379 PolarHBondContact O-N 2.84Å; N377-E380 PolarHBondContact O-N 3.02Å; N377-A381 WeakPolarHBondContact O-CB 3.33Å; N377-A381 PolarHBondContact O-N 3.37Å
378	K	93.8	Very high	91.7	Very high	135 Å²	135	76.9 Å²	76.9	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-58.1	-43.2	171.3	-77.9	179.7	178.4	-175.6	0	112.9	K374 L376 L382	K374-K378 WeakPolarHBondContact O-CG 3.23Å; K374-K378 PolarHBondContact O-N 3.31Å; L376-K378 VanDerWaalsContact C-N 3.31Å; L376-K378 PolarHBondContact O-N 3.29Å; K378-L382 WeakPolarHBondContact O-CG 3.24Å; K378-L382 PolarHBondContact O-N 2.88Å
379	K	92.4	Very high	91.4	Very high	132 Å²	132	80.2 Å²	80.2	57%	0.574	40%	0.398	S	S	*	.	H	α-helix	trans	-68.8	-38.8	178.2	-66.3	177.7	179.7	175.8	0	111.2	L328 T375 L376 N377 L382 A383	L328-K379 HydrophobicContact CD2-CB 3.47Å; L328-K379 VanDerWaalsContact CD2-CB 3.47Å; T375-K379 PolarHBondContact O-N 3.1Å; L376-K379 WeakPolarHBondContact O-CB 3.41Å; L376-K379 PolarHBondContact O-N 3.2Å; N377-K379 VanDerWaalsContact C-N 3.34Å; N377-K379 PolarHBondContact O-N 2.84Å; K379-L382 PolarHBondContact O-N 3.09Å; K379-A383 PolarHBondContact O-N 2.96Å
380	E	91.8	Very high	90.9	Very high	34 Å²	34	79.3 Å²	79.3	16%	0.159	40%	0.397	C	S	.	.	H	α-helix	trans	-62.8	-46.3	175.9	-174.1	-173	175.3	0	0	111.3	H325 L328 A329 V332 L376 N377 L382 A383 Y384	H325-E380 IonicContact CE1-OE1 3.74Å; L328-E380 HydrophobicContact CB-CB 4.15Å; L328-E380 HydrophobicContact CB-CG 4.32Å; L328-E380 HydrophobicContact CD2-CB 4.43Å; A329-E380 WeakPolarHBondContact CB-OE1 3.28Å; V332-E380 WeakPolarHBondContact CB-OE2 3.28Å; V332-E380 HydrophobicContact CG2-CB 4.35Å; V332-E380 WeakPolarHBondContact CG2-OE2 3.38Å; L376-E380 PolarHBondContact O-N 2.84Å; N377-E380 PolarHBondContact O-N 3.02Å; E380-L382 VanDerWaalsContact C-N 3.33Å; E380-L382 PolarHBondContact O-N 3.32Å; E380-A383 WeakPolarHBondContact O-CB 3.43Å; E380-A383 PolarHBondContact O-N 3.05Å; E380-A383 VanDerWaalsContact O-N 3.12Å; E380-Y384 WeakPolarHBondContact O-CB 3.31Å; E380-Y384 PolarHBondContact O-N 3.34Å
381	A	92	Very high	90.4	Very high	49 Å²	49	77.9 Å²	77.9	41%	0.405	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-42.1	177.7	0	0	0	0	0	112.1	N377 Y384 V385	N377-A381 WeakPolarHBondContact O-CB 3.33Å; N377-A381 PolarHBondContact O-N 3.37Å; A381-Y384 PolarHBondContact O-N 2.91Å; A381-V385 WeakPolarHBondContact O-CG2 3.34Å; A381-V385 PolarHBondContact O-N 3.48Å
382	L	92.8	Very high	89.8	Confident	128 Å²	128	76.7 Å²	76.7	67%	0.67	39%	0.394	S	S	*	.	H	α-helix	trans	-64.2	-41.7	174.4	-72.3	173.3	0	0	0	112.1	K378 K379 E380 Y384 V385 A386	K378-L382 WeakPolarHBondContact O-CG 3.24Å; K378-L382 PolarHBondContact O-N 2.88Å; K379-L382 PolarHBondContact O-N 3.09Å; E380-L382 VanDerWaalsContact C-N 3.33Å; E380-L382 PolarHBondContact O-N 3.32Å; L382-Y384 VanDerWaalsContact C-N 3.35Å; L382-V385 PolarHBondContact O-N 3.31Å; L382-A386 WeakPolarHBondContact O-CB 3.45Å; L382-A386 PolarHBondContact O-N 3.37Å
383	A	90	Very high	89.5	Confident	18 Å²	18	77.6 Å²	77.6	15%	0.149	40%	0.404	C	S	.	.	H	α-helix	trans	-63.6	-41	176.2	0	0	0	0	0	111.8	H325 K379 E380 A386 E387	H325-A383 HydrophobicContact CB-CB 4.22Å; K379-A383 PolarHBondContact O-N 2.96Å; E380-A383 WeakPolarHBondContact O-CB 3.43Å; E380-A383 PolarHBondContact O-N 3.05Å; E380-A383 VanDerWaalsContact O-N 3.12Å; A383-A386 PolarHBondContact O-N 3.49Å; A383-E387 PolarHBondContact O-N 2.84Å
384	Y	88.9	Confident	89	Confident	126 Å²	126	76.9 Å²	76.9	49%	0.494	40%	0.403	S	S	.	.	H	α-helix	trans	-61.1	-49.1	175	173.3	-102.2	0	0	0	111.8	H325 E380 A381 L382 A386 E387 V388	H325-Y384 AromaticContact NE2-CD2 3.9Å; E380-Y384 WeakPolarHBondContact O-CB 3.31Å; E380-Y384 PolarHBondContact O-N 3.34Å; A381-Y384 PolarHBondContact O-N 2.91Å; L382-Y384 VanDerWaalsContact C-N 3.35Å; Y384-A386 VanDerWaalsContact C-N 3.3Å; Y384-A386 PolarHBondContact O-N 2.84Å; Y384-E387 WeakPolarHBondContact O-CB 3.48Å; Y384-E387 PolarHBondContact O-N 3.32Å; Y384-E387 VanDerWaalsContact O-N 3.15Å; Y384-V388 HydrophobicContact CD1-CG2 4.36Å; Y384-V388 HydrophobicContact CD2-CG2 4.2Å; Y384-V388 HydrophobicContact CE1-CG2 3.91Å; Y384-V388 HydrophobicContact CE2-CG2 3.72Å; Y384-V388 WeakPolarHBondContact O-CG2 3.24Å; Y384-V388 PolarHBondContact O-N 3.39Å
385	V	91.3	Very high	88.3	Confident	72 Å²	72	71.7 Å²	71.7	44%	0.436	39%	0.386	S	S	.	.	H	α-helix	trans	-58.8	-44.3	177.3	171.8	0	0	0	0	110.7	A381 L382 E387 V388 W389	A381-V385 WeakPolarHBondContact O-CG2 3.34Å; A381-V385 PolarHBondContact O-N 3.48Å; L382-V385 PolarHBondContact O-N 3.31Å; V385-E387 VanDerWaalsContact C-N 3.33Å; V385-E387 PolarHBondContact O-N 2.85Å; V385-V388 PolarHBondContact O-N 3.04Å; V385-W389 HydrophobicContact CG1-CG 4.49Å; V385-W389 WeakPolarHBondContact O-CB 3.38Å; V385-W389 PolarHBondContact O-N 2.96Å
386	A	89	Confident	87.9	Confident	42 Å²	42	74 Å²	74	35%	0.347	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-39.9	177.2	0	0	0	0	0	112.5	L382 A383 Y384 T390	L382-A386 WeakPolarHBondContact O-CB 3.45Å; L382-A386 PolarHBondContact O-N 3.37Å; A383-A386 PolarHBondContact O-N 3.49Å; Y384-A386 VanDerWaalsContact C-N 3.3Å; Y384-A386 PolarHBondContact O-N 2.84Å; A386-T390 VanDerWaalsContact O-CB 3.29Å; A386-T390 WeakPolarHBondContact O-CB 3.12Å; A386-T390 PolarHBondContact O-N 3.07Å; A386-T390 PolarHBondContact O-OG1 2.71Å
387	E	85.1	Confident	87.6	Confident	47 Å²	47	77.5 Å²	77.5	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-64.5	-49.9	175.6	-180	177.1	-178.1	0	0	112.2	H325 A383 Y384 V385 W389 T390 T391	H325-E387 WeakPolarHBondContact CB-OE2 3.34Å; H325-E387 IonicContact CD2-OE2 2.83Å; H325-E387 PolarHBondContact CD2-OE2 2.83Å; H325-E387 IonicContact CG-OE2 3.18Å; A383-E387 PolarHBondContact O-N 2.84Å; Y384-E387 WeakPolarHBondContact O-CB 3.48Å; Y384-E387 PolarHBondContact O-N 3.32Å; Y384-E387 VanDerWaalsContact O-N 3.15Å; V385-E387 VanDerWaalsContact C-N 3.33Å; V385-E387 PolarHBondContact O-N 2.85Å; E387-W389 PolarHBondContact O-N 3.4Å; E387-T390 PolarHBondContact O-N 3.02Å; E387-T391 WeakPolarHBondContact O-CB 3.2Å; E387-T391 PolarHBondContact O-N 2.83Å; E387-T391 PolarHBondContact O-OG1 2.79Å
388	V	85.5	Confident	87.1	Confident	54 Å²	54	74.8 Å²	74.8	33%	0.327	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-44.3	-179.9	174.8	0	0	0	0	111.1	Y384 V385 T391 S392	Y384-V388 HydrophobicContact CD1-CG2 4.36Å; Y384-V388 HydrophobicContact CD2-CG2 4.2Å; Y384-V388 HydrophobicContact CE1-CG2 3.91Å; Y384-V388 HydrophobicContact CE2-CG2 3.72Å; Y384-V388 WeakPolarHBondContact O-CG2 3.24Å; Y384-V388 PolarHBondContact O-N 3.39Å; V385-V388 PolarHBondContact O-N 3.04Å; V388-T391 PolarHBondContact O-N 2.88Å; V388-S392 WeakPolarHBondContact O-CB 3.5Å; V388-S392 PolarHBondContact O-N 3.39Å; V388-S392 PolarHBondContact O-OG 2.87Å
389	W	87.6	Confident	86.5	Confident	181 Å²	181	74.1 Å²	74.1	69%	0.686	39%	0.393	S	S	*	.	H	α-helix	trans	-65.3	-44.6	178.5	-84.5	57.4	0	0	0	111.7	V385 E387 T391 S392 V393	V385-W389 HydrophobicContact CG1-CG 4.49Å; V385-W389 WeakPolarHBondContact O-CB 3.38Å; V385-W389 PolarHBondContact O-N 2.96Å; E387-W389 PolarHBondContact O-N 3.4Å; W389-T391 VanDerWaalsContact C-N 3.32Å; W389-T391 PolarHBondContact O-N 2.99Å; W389-S392 PolarHBondContact O-N 3.29Å; W389-V393 WeakPolarHBondContact O-CB 3.35Å; W389-V393 VanDerWaalsContact O-CG2 3.32Å; W389-V393 WeakPolarHBondContact O-CG2 3.16Å; W389-V393 PolarHBondContact O-N 3.41Å
390	T	84.8	Confident	86.1	Confident	37 Å²	37	72 Å²	72	23%	0.227	39%	0.391	C	S	.	.	H	α-helix	trans	-62.5	-42.3	178.8	-56.8	0	0	0	0	111.3	L317 L321 A386 E387 S394	L317-T390 HydrophobicContact CB-CG2 4.18Å; L317-T390 HydrophobicContact CD2-CG2 4.02Å; L317-T390 HydrophobicContact CG-CG2 4.46Å; L321-T390 HydrophobicContact CD1-CG2 3.64Å; L321-T390 WeakPolarHBondContact CD1-OG1 3.43Å; A386-T390 VanDerWaalsContact O-CB 3.29Å; A386-T390 WeakPolarHBondContact O-CB 3.12Å; A386-T390 PolarHBondContact O-N 3.07Å; A386-T390 PolarHBondContact O-OG1 2.71Å; E387-T390 PolarHBondContact O-N 3.02Å; T390-S394 WeakPolarHBondContact O-CB 3.41Å; T390-S394 PolarHBondContact O-N 3.13Å; T390-S394 PolarHBondContact O-OG 3.44Å
391	T	81.8	Confident	85.8	Confident	36 Å²	36	71.8 Å²	71.8	22%	0.221	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-47.5	175.1	-52.2	0	0	0	0	111	P318 E387 V388 W389 S394 G395	P318-T391 WeakPolarHBondContact CB-OG1 3.48Å; P318-T391 HydrophobicContact CG-CG2 4.35Å; E387-T391 WeakPolarHBondContact O-CB 3.2Å; E387-T391 PolarHBondContact O-N 2.83Å; E387-T391 PolarHBondContact O-OG1 2.79Å; V388-T391 PolarHBondContact O-N 2.88Å; W389-T391 VanDerWaalsContact C-N 3.32Å; W389-T391 PolarHBondContact O-N 2.99Å; T391-S394 PolarHBondContact O-N 3.43Å; T391-S394 PolarHBondContact O-OG 2.96Å; T391-G395 PolarHBondContact O-N 3.46Å
392	S	83.6	Confident	85.3	Confident	75 Å²	75	69.6 Å²	69.6	52%	0.524	38%	0.38	S	S	.	.	H	α-helix	trans	-62.9	-46.7	-180	-58.5	0	0	0	0	112.7	V388 W389 G395 M396	V388-S392 WeakPolarHBondContact O-CB 3.5Å; V388-S392 PolarHBondContact O-N 3.39Å; V388-S392 PolarHBondContact O-OG 2.87Å; W389-S392 PolarHBondContact O-N 3.29Å; S392-G395 PolarHBondContact O-N 3.49Å; S392-M396 PolarHBondContact O-N 3.21Å
393	V	85.7	Confident	84.9	Confident	93 Å²	93	69 Å²	69	56%	0.564	38%	0.377	S	S	*	.	H	α-helix	trans	-63.8	-42.8	178.6	171.1	0	0	0	0	111	W389 G395 M396 L397	W389-V393 WeakPolarHBondContact O-CB 3.35Å; W389-V393 VanDerWaalsContact O-CG2 3.32Å; W389-V393 WeakPolarHBondContact O-CG2 3.16Å; W389-V393 PolarHBondContact O-N 3.41Å; V393-G395 VanDerWaalsContact C-N 3.34Å; V393-G395 PolarHBondContact O-N 2.9Å; V393-M396 PolarHBondContact O-N 3.06Å; V393-L397 WeakPolarHBondContact O-CB 3.37Å; V393-L397 PolarHBondContact O-N 2.98Å
394	S	81.8	Confident	84.8	Confident	19 Å²	19	75.8 Å²	75.8	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-62.2	-40.4	177.5	72.8	0	0	0	0	112.5	T390 T391 L397 L398	T390-S394 WeakPolarHBondContact O-CB 3.41Å; T390-S394 PolarHBondContact O-N 3.13Å; T390-S394 PolarHBondContact O-OG 3.44Å; T391-S394 PolarHBondContact O-N 3.43Å; T391-S394 PolarHBondContact O-OG 2.96Å; S394-L397 PolarHBondContact O-N 3.13Å; S394-L398 PolarHBondContact O-N 3Å; S394-L398 VanDerWaalsContact O-N 3.13Å
395	G	80.9	Confident	84.7	Confident	21 Å²	21	72.4 Å²	72.4	22%	0.216	39%	0.39	C	S	.	.	H	α-helix	trans	-66	-39	175	0	0	0	0	0	112.6	T391 S392 V393 L398 K399	T391-G395 PolarHBondContact O-N 3.46Å; S392-G395 PolarHBondContact O-N 3.49Å; V393-G395 VanDerWaalsContact C-N 3.34Å; V393-G395 PolarHBondContact O-N 2.9Å; G395-L398 PolarHBondContact O-N 2.71Å; G395-K399 WeakPolarHBondContact O-CG 3.05Å; G395-K399 PolarHBondContact O-N 2.87Å; G395-K399 VanDerWaalsContact O-N 3.12Å
396	M	83.8	Confident	84.4	Confident	133 Å²	133	69 Å²	69	66%	0.655	37%	0.37	S	S	*	.	H	α-helix	trans	-69.2	-40.2	177.5	-168	148.5	155.1	0	0	112.2	S392 V393 L398 K399 V400	S392-M396 PolarHBondContact O-N 3.21Å; V393-M396 PolarHBondContact O-N 3.06Å; M396-L398 VanDerWaalsContact C-N 3.3Å; M396-L398 PolarHBondContact O-N 3.46Å; M396-K399 WeakPolarHBondContact O-CB 3.16Å; M396-K399 PolarHBondContact O-N 2.88Å; M396-V400 WeakPolarHBondContact O-CG2 3.38Å; M396-V400 PolarHBondContact O-N 3.35Å
397	L	84.2	Confident	84.2	Confident	120 Å²	120	68.1 Å²	68.1	63%	0.628	36%	0.364	S	S	*	.	H	α-helix	trans	-59.8	-41.7	174.1	-175.9	64.4	0	0	0	111.5	V393 S394 V400 G401	V393-L397 WeakPolarHBondContact O-CB 3.37Å; V393-L397 PolarHBondContact O-N 2.98Å; S394-L397 PolarHBondContact O-N 3.13Å; L397-V400 PolarHBondContact O-N 2.85Å; L397-G401 PolarHBondContact O-N 3.46Å
398	L	81.9	Confident	84.2	Confident	19 Å²	19	69.1 Å²	69.1	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-43	175.3	-177.7	60.8	0	0	0	112.1	N310 L314 S394 G395 M396 G401 I402 T431	N310-L398 HydrophobicContact CB-CD1 3.51Å; L314-L398 HydrophobicContact CD1-CD2 3.51Å; S394-L398 PolarHBondContact O-N 3Å; S394-L398 VanDerWaalsContact O-N 3.13Å; G395-L398 PolarHBondContact O-N 2.71Å; M396-L398 VanDerWaalsContact C-N 3.3Å; M396-L398 PolarHBondContact O-N 3.46Å; L398-G401 PolarHBondContact O-N 2.92Å; L398-I402 HydrophobicContact CD1-CD1 3.6Å; L398-I402 HydrophobicContact CD1-CG1 4.31Å; L398-I402 HydrophobicContact CG-CD1 3.84Å; L398-I402 WeakPolarHBondContact O-CG1 3.15Å; L398-I402 PolarHBondContact O-N 3.25Å; L398-T431 HydrophobicContact CD2-CG2 4.22Å
399	K	80.9	Confident	84.2	Confident	120 Å²	120	67.6 Å²	67.6	52%	0.522	36%	0.359	S	S	.	.	H	α-helix	trans	-59.8	-47.5	176.6	-70.7	173	-173.1	179.4	0	111.5	G395 M396 I402 L403	G395-K399 WeakPolarHBondContact O-CG 3.05Å; G395-K399 PolarHBondContact O-N 2.87Å; G395-K399 VanDerWaalsContact O-N 3.12Å; M396-K399 WeakPolarHBondContact O-CB 3.16Å; M396-K399 PolarHBondContact O-N 2.88Å; K399-I402 PolarHBondContact O-N 2.87Å; K399-L403 WeakPolarHBondContact O-CB 3.42Å; K399-L403 PolarHBondContact O-N 3Å
400	V	85.5	Confident	84.1	Confident	87 Å²	87	61.3 Å²	61.3	53%	0.527	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-43.6	178	174.3	0	0	0	0	111	M396 L397 I402 L403 Y404	M396-V400 WeakPolarHBondContact O-CG2 3.38Å; M396-V400 PolarHBondContact O-N 3.35Å; L397-V400 PolarHBondContact O-N 2.85Å; V400-I402 VanDerWaalsContact C-N 3.32Å; V400-I402 PolarHBondContact O-N 3.34Å; V400-L403 PolarHBondContact O-N 3.33Å; V400-Y404 WeakPolarHBondContact O-CB 3.18Å; V400-Y404 PolarHBondContact O-N 3.26Å
401	G	84.4	Confident	84.2	Confident	31 Å²	31	65.9 Å²	65.9	32%	0.32	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-40.6	178.1	0	0	0	0	0	113	L397 L398 Y404 L405	L397-G401 PolarHBondContact O-N 3.46Å; L398-G401 PolarHBondContact O-N 2.92Å; G401-Y404 PolarHBondContact O-N 2.99Å; G401-L405 WeakPolarHBondContact O-CB 3.5Å; G401-L405 WeakPolarHBondContact O-CG 3.35Å; G401-L405 PolarHBondContact O-N 3.44Å
402	I	83	Confident	84.4	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.015	39%	0.385	C	S	.	.	H	α-helix	trans	-78	-34.5	-179.7	-69.9	163.1	0	0	0	112	T307 L398 K399 V400 Y404 G406 F423 Q427	T307-I402 HydrophobicContact CG2-CD1 3.57Å; L398-I402 HydrophobicContact CD1-CD1 3.6Å; L398-I402 HydrophobicContact CD1-CG1 4.31Å; L398-I402 HydrophobicContact CG-CD1 3.84Å; L398-I402 WeakPolarHBondContact O-CG1 3.15Å; L398-I402 PolarHBondContact O-N 3.25Å; K399-I402 PolarHBondContact O-N 2.87Å; V400-I402 VanDerWaalsContact C-N 3.32Å; V400-I402 PolarHBondContact O-N 3.34Å; I402-Y404 VanDerWaalsContact C-N 3.31Å; I402-Y404 PolarHBondContact O-N 2.9Å; I402-G406 WeakPolarHBondContact O-CA 3.3Å; I402-G406 PolarHBondContact O-N 3.04Å; I402-F423 HydrophobicContact CG2-CD1 4.38Å; I402-F423 HydrophobicContact CG2-CE1 4.13Å; I402-Q427 HydrophobicContact CD1-CG 4.32Å
403	L	83.6	Confident	84.1	Confident	114 Å²	114	72.7 Å²	72.7	60%	0.597	39%	0.392	S	S	*	.	H	α-helix	trans	-61.9	-41.6	171.1	-175	63.6	0	0	0	111.2	K399 V400 G407	K399-L403 WeakPolarHBondContact O-CB 3.42Å; K399-L403 PolarHBondContact O-N 3Å; V400-L403 PolarHBondContact O-N 3.33Å; L403-G407 WeakPolarHBondContact O-CA 3.5Å; L403-G407 PolarHBondContact O-N 3.01Å
404	Y	87.3	Confident	83.8	Confident	161 Å²	161	72.8 Å²	72.8	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-65	-51.4	177.3	-178.7	-98.8	0	0	0	112.1	V400 G401 I402 G407 Q408	V400-Y404 WeakPolarHBondContact O-CB 3.18Å; V400-Y404 PolarHBondContact O-N 3.26Å; G401-Y404 PolarHBondContact O-N 2.99Å; I402-Y404 VanDerWaalsContact C-N 3.31Å; I402-Y404 PolarHBondContact O-N 2.9Å; Y404-G407 PolarHBondContact O-N 2.89Å; Y404-Q408 WeakPolarHBondContact O-CG 3.49Å; Y404-Q408 PolarHBondContact O-N 2.6Å
405	L	86.4	Confident	83.8	Confident	56 Å²	56	72.9 Å²	72.9	29%	0.293	39%	0.393	S	S	.	.	H	α-helix	trans	-67.3	-44.1	-179.8	-69.5	172.1	0	0	0	112.1	V306 G401 Q408 L409	V306-L405 HydrophobicContact CG1-CD1 3.76Å; G401-L405 WeakPolarHBondContact O-CB 3.5Å; G401-L405 WeakPolarHBondContact O-CG 3.35Å; G401-L405 PolarHBondContact O-N 3.44Å; L405-Q408 WeakPolarHBondContact O-CB 3.2Å; L405-Q408 PolarHBondContact O-N 3.04Å; L405-L409 WeakPolarHBondContact O-CD1 3.2Å; L405-L409 PolarHBondContact O-N 3.37Å; L405-L409 VanDerWaalsContact O-N 3.14Å
406	G	85.3	Confident	84	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-63.3	-40.4	175.7	0	0	0	0	0	112.3	I402 Q408 L409 V410	I402-G406 WeakPolarHBondContact O-CA 3.3Å; I402-G406 PolarHBondContact O-N 3.04Å; G406-Q408 PolarHBondContact O-N 3.45Å; G406-L409 WeakPolarHBondContact O-CB 3.4Å; G406-L409 PolarHBondContact O-N 2.93Å; G406-L409 VanDerWaalsContact O-N 3.12Å; G406-V410 WeakPolarHBondContact O-CG2 3.33Å; G406-V410 PolarHBondContact O-N 3.49Å
407	G	84.9	Confident	84	Confident	22 Å²	22	68.9 Å²	68.9	23%	0.227	38%	0.375	C	S	.	.	H	α-helix	trans	-61	-41.7	173.7	0	0	0	0	0	112.8	L403 Y404 L409 V410 I411	L403-G407 WeakPolarHBondContact O-CA 3.5Å; L403-G407 PolarHBondContact O-N 3.01Å; Y404-G407 PolarHBondContact O-N 2.89Å; G407-L409 VanDerWaalsContact C-N 3.3Å; G407-L409 PolarHBondContact O-N 2.93Å; G407-V410 PolarHBondContact O-N 3.36Å; G407-I411 VanDerWaalsContact O-CG1 3.28Å; G407-I411 WeakPolarHBondContact O-CG1 3.49Å; G407-I411 PolarHBondContact O-N 3.46Å
408	Q	85.9	Confident	84.1	Confident	69 Å²	69	63.2 Å²	63.2	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-36.9	172.8	-71.6	-72.1	-30.1	0	0	112.4	Y404 L405 G406 R412	Y404-Q408 WeakPolarHBondContact O-CG 3.49Å; Y404-Q408 PolarHBondContact O-N 2.6Å; L405-Q408 WeakPolarHBondContact O-CB 3.2Å; L405-Q408 PolarHBondContact O-N 3.04Å; G406-Q408 PolarHBondContact O-N 3.45Å; Q408-R412 VanDerWaalsContact O-CG 3.28Å; Q408-R412 WeakPolarHBondContact O-CG 3.4Å; Q408-R412 PolarHBondContact O-N 3.35Å; Q408-R412 VanDerWaalsContact O-N 3.11Å
409	L	84.6	Confident	84.3	Confident	22 Å²	22	65.7 Å²	65.7	12%	0.115	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-35.4	175.4	-94	73.8	0	0	0	112.7	Y302 L303 L405 G406 G407 G413 T414 V415	Y302-L409 HydrophobicContact CD1-CD1 3.96Å; Y302-L409 HydrophobicContact CD1-CD2 3.8Å; Y302-L409 HydrophobicContact CE1-CD1 3.79Å; Y302-L409 HydrophobicContact CE1-CD2 4.47Å; L303-L409 HydrophobicContact CD2-CD2 4.31Å; L303-L409 HydrophobicContact CG-CD2 4.16Å; L405-L409 WeakPolarHBondContact O-CD1 3.2Å; L405-L409 PolarHBondContact O-N 3.37Å; L405-L409 VanDerWaalsContact O-N 3.14Å; G406-L409 WeakPolarHBondContact O-CB 3.4Å; G406-L409 PolarHBondContact O-N 2.93Å; G406-L409 VanDerWaalsContact O-N 3.12Å; G407-L409 VanDerWaalsContact C-N 3.3Å; G407-L409 PolarHBondContact O-N 2.93Å; L409-G413 PolarHBondContact O-N 3.24Å; L409-T414 PolarHBondContact O-N 3.45Å; L409-T414 VanDerWaalsContact O-N 3.11Å; L409-T414 PolarHBondContact O-OG1 3.26Å; L409-V415 HydrophobicContact CB-CG2 4.29Å; L409-V415 HydrophobicContact CD2-CG2 3.93Å
410	V	86.4	Confident	84.6	Confident	49 Å²	49	60.8 Å²	60.8	30%	0.297	34%	0.338	S	S	.	.	H	α-helix	trans	-69.2	-44.1	174.5	174.1	0	0	0	0	110.9	G406 G407 R412 G413 L420	G406-V410 WeakPolarHBondContact O-CG2 3.33Å; G406-V410 PolarHBondContact O-N 3.49Å; G407-V410 PolarHBondContact O-N 3.36Å; V410-R412 PolarHBondContact O-N 2.89Å; V410-G413 PolarHBondContact O-N 2.86Å; V410-L420 HydrophobicContact CG2-CB 4.06Å; V410-L420 HydrophobicContact CG2-CD2 3.65Å; V410-L420 HydrophobicContact CG2-CG 4.43Å
411	I	86.8	Confident	84.8	Confident	133 Å²	133	59 Å²	59	68%	0.682	33%	0.327	S	S	*	.	H	α-helix	trans	-59.4	-36.6	176.3	-66.9	163.9	0	0	0	111.1	G407 G413	G407-I411 VanDerWaalsContact O-CG1 3.28Å; G407-I411 WeakPolarHBondContact O-CG1 3.49Å; G407-I411 PolarHBondContact O-N 3.46Å; I411-G413 PolarHBondContact O-N 3.37Å
412	R	85	Confident	85	Confident	188 Å²	188	57.9 Å²	57.9	71%	0.709	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.8	175.9	-68.8	174.5	-174.1	-164.3	0.8	114.1	Q408 V410 T414	Q408-R412 VanDerWaalsContact O-CG 3.28Å; Q408-R412 WeakPolarHBondContact O-CG 3.4Å; Q408-R412 PolarHBondContact O-N 3.35Å; Q408-R412 VanDerWaalsContact O-N 3.11Å; V410-R412 PolarHBondContact O-N 2.89Å; R412-T414 HydrophobicContact CB-CG2 4.22Å; R412-T414 PolarHBondContact O-N 2.89Å
413	G	78.6	Confident	85.3	Confident	65 Å²	65	58 Å²	58	67%	0.67	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	10.9	180	0	0	0	0	0	115.1	L409 V410 I411	L409-G413 PolarHBondContact O-N 3.24Å; V410-G413 PolarHBondContact O-N 2.86Å; I411-G413 PolarHBondContact O-N 3.37Å
414	T	78.8	Confident	85.6	Confident	96 Å²	96	55.2 Å²	55.2	59%	0.589	30%	0.303	S	S	*	.	S	Bend	trans	-80.9	-23.5	-176.5	57.5	0	0	0	0	113.6	L409 R412	L409-T414 PolarHBondContact O-N 3.45Å; L409-T414 VanDerWaalsContact O-N 3.11Å; L409-T414 PolarHBondContact O-OG1 3.26Å; R412-T414 HydrophobicContact CB-CG2 4.22Å; R412-T414 PolarHBondContact O-N 2.89Å
415	V	81.4	Confident	85.7	Confident	20 Å²	20	50.4 Å²	50.4	12%	0.121	29%	0.287	C	S	.	.	S	Bend	trans	-138.6	137.3	-179.3	-178.8	0	0	0	0	108.2	L409 N419	L409-V415 HydrophobicContact CB-CG2 4.29Å; L409-V415 HydrophobicContact CD2-CG2 3.93Å; V415-N419 HydrophobicContact CG1-CB 3.63Å
416	S	85.2	Confident	86	Confident	37 Å²	37	48.2 Å²	48.2	26%	0.259	28%	0.275	S	S	.	.			trans	-71.6	157.9	175.2	72.5	0	0	0	0	112	D189 G418 N419 L420	D189-S416 VanDerWaalsContact OD2-CB 3.3Å; D189-S416 WeakPolarHBondContact OD2-CB 3.33Å; D189-S416 PolarHBondContact OD2-OG 3.19Å; S416-G418 VanDerWaalsContact C-N 3.25Å; S416-G418 PolarHBondContact O-N 2.97Å; S416-N419 PolarHBondContact O-N 3.41Å; S416-N419 WeakPolarHBondContact OG-CB 3.34Å; S416-N419 PolarHBondContact OG-N 3.44Å; S416-N419 VanDerWaalsContact OG-N 3.08Å; S416-L420 PolarHBondContact O-N 2.91Å
417	S	84.9	Confident	86.1	Confident	34 Å²	34	48.5 Å²	48.5	24%	0.238	28%	0.276	C	S	.	.	H	α-helix	trans	-53.8	-41.5	172.7	33.3	0	0	0	0	112.8	D189 L192 L420 V421	D189-S417 PolarHBondContact OD1-OG 2.63Å; L192-S417 VanDerWaalsContact CD1-OG 3.24Å; L192-S417 WeakPolarHBondContact CD1-OG 3.25Å; S417-L420 WeakPolarHBondContact O-CB 3.48Å; S417-L420 PolarHBondContact O-N 3.28Å; S417-V421 WeakPolarHBondContact O-CG2 3.2Å; S417-V421 PolarHBondContact O-N 2.87Å
418	G	85.2	Confident	86.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-71.6	-39.1	-179.8	0	0	0	0	0	112.7	G185 D189 S416 L420 V421 S422	G185-G418 WeakPolarHBondContact CA-O 3.44Å; G185-G418 WeakPolarHBondContact O-CA 3.3Å; D189-G418 VanDerWaalsContact CG-CA 3.47Å; D189-G418 VanDerWaalsContact CG-N 3.29Å; D189-G418 WeakPolarHBondContact OD1-CA 3.42Å; D189-G418 PolarHBondContact OD1-N 2.85Å; D189-G418 WeakPolarHBondContact OD2-CA 3.33Å; D189-G418 PolarHBondContact OD2-N 2.92Å; S416-G418 VanDerWaalsContact C-N 3.25Å; S416-G418 PolarHBondContact O-N 2.97Å; G418-L420 VanDerWaalsContact C-N 3.28Å; G418-L420 PolarHBondContact O-N 3.45Å; G418-V421 PolarHBondContact O-N 3.39Å; G418-S422 PolarHBondContact O-N 3.31Å; G418-S422 PolarHBondContact O-OG 3.07Å
419	N	86.1	Confident	86.4	Confident	71 Å²	71	48.9 Å²	48.9	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-35.3	172.4	-76.8	-7.8	0	0	0	111.6	V415 S416 F423	V415-N419 HydrophobicContact CG1-CB 3.63Å; S416-N419 PolarHBondContact O-N 3.41Å; S416-N419 WeakPolarHBondContact OG-CB 3.34Å; S416-N419 PolarHBondContact OG-N 3.44Å; S416-N419 VanDerWaalsContact OG-N 3.08Å; N419-F423 VanDerWaalsContact O-CB 3.23Å; N419-F423 WeakPolarHBondContact O-CB 3.37Å; N419-F423 PolarHBondContact O-N 3.3Å
420	L	87	Confident	86.6	Confident	18 Å²	18	48.6 Å²	48.6	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-43.3	172.7	-178.9	63	0	0	0	111.7	L303 V410 S416 S417 G418 F423 V424	L303-L420 HydrophobicContact CD1-CD1 4.21Å; V410-L420 HydrophobicContact CG2-CB 4.06Å; V410-L420 HydrophobicContact CG2-CD2 3.65Å; V410-L420 HydrophobicContact CG2-CG 4.43Å; S416-L420 PolarHBondContact O-N 2.91Å; S417-L420 WeakPolarHBondContact O-CB 3.48Å; S417-L420 PolarHBondContact O-N 3.28Å; G418-L420 VanDerWaalsContact C-N 3.28Å; G418-L420 PolarHBondContact O-N 3.45Å; L420-F423 PolarHBondContact O-N 2.88Å; L420-V424 HydrophobicContact CD1-CG2 4.34Å; L420-V424 WeakPolarHBondContact O-CG2 3.35Å; L420-V424 PolarHBondContact O-N 3.1Å
421	V	89.6	Confident	86.5	Confident	49 Å²	49	47.4 Å²	47.4	30%	0.297	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-49.1	175.6	170.7	0	0	0	0	111.3	T184 T188 S417 G418 F423 V424 L425	T184-V421 HydrophobicContact CG2-CG1 4.18Å; T188-V421 HydrophobicContact CG2-CG2 4.18Å; S417-V421 WeakPolarHBondContact O-CG2 3.2Å; S417-V421 PolarHBondContact O-N 2.87Å; G418-V421 PolarHBondContact O-N 3.39Å; V421-F423 VanDerWaalsContact C-N 3.27Å; V421-F423 PolarHBondContact O-N 2.8Å; V421-V424 PolarHBondContact O-N 3.41Å; V421-L425 HydrophobicContact CG1-CD1 4.11Å; V421-L425 WeakPolarHBondContact O-CG 3.26Å; V421-L425 PolarHBondContact O-N 3Å
422	S	89.7	Confident	86.5	Confident	8 Å²	8	46 Å²	46	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-54.5	-45.6	174.1	-65.1	0	0	0	0	111.3	P181 G185 G418 L425 Y426	P181-S422 PolarHBondContact O-OG 2.87Å; G185-S422 VanDerWaalsContact CA-OG 3.31Å; G185-S422 WeakPolarHBondContact CA-OG 3.14Å; G418-S422 PolarHBondContact O-N 3.31Å; G418-S422 PolarHBondContact O-OG 3.07Å; S422-L425 PolarHBondContact O-N 3.47Å; S422-Y426 WeakPolarHBondContact O-CD2 3.4Å; S422-Y426 PolarHBondContact O-N 2.96Å
423	F	89.4	Confident	86.7	Confident	5 Å²	5	37.1 Å²	37.1	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-46.9	-179.9	-175.8	-87.4	0	0	0	112.3	M296 L303 T304 T307 I402 N419 L420 V421 L425 Y426 Q427	M296-F423 HydrophobicContact CB-CE2 4.24Å; M296-F423 HydrophobicContact CE-CE1 4.36Å; M296-F423 HydrophobicContact CE-CE2 3.8Å; M296-F423 HydrophobicContact CE-CZ 3.6Å; L303-F423 HydrophobicContact CB-CD1 4.01Å; L303-F423 HydrophobicContact CB-CD2 4.06Å; L303-F423 HydrophobicContact CB-CE1 3.49Å; L303-F423 VanDerWaalsContact CB-CE1 3.49Å; L303-F423 HydrophobicContact CB-CE2 3.52Å; L303-F423 HydrophobicContact CB-CG 4.3Å; L303-F423 HydrophobicContact CB-CZ 3.23Å; L303-F423 HydrophobicContact CD1-CD1 3.91Å; L303-F423 HydrophobicContact CD1-CD2 4.37Å; L303-F423 HydrophobicContact CD1-CE1 4.22Å; L303-F423 HydrophobicContact CD1-CG 4.01Å; L303-F423 HydrophobicContact CG-CE1 4.4Å; L303-F423 HydrophobicContact CG-CZ 4.49Å; L303-F423 WeakPolarHBondContact O-CZ 3.46Å; T304-F423 HydrophobicContact CG2-CE2 3.97Å; T307-F423 HydrophobicContact CG2-CE1 3.92Å; T307-F423 HydrophobicContact CG2-CZ 3.76Å; I402-F423 HydrophobicContact CG2-CD1 4.38Å; I402-F423 HydrophobicContact CG2-CE1 4.13Å; N419-F423 VanDerWaalsContact O-CB 3.23Å; N419-F423 WeakPolarHBondContact O-CB 3.37Å; N419-F423 PolarHBondContact O-N 3.3Å; L420-F423 PolarHBondContact O-N 2.88Å; V421-F423 VanDerWaalsContact C-N 3.27Å; V421-F423 PolarHBondContact O-N 2.8Å; F423-L425 VanDerWaalsContact C-N 3.3Å; F423-L425 PolarHBondContact O-N 3.28Å; F423-Y426 PolarHBondContact O-N 3.5Å; F423-Q427 HydrophobicContact CE1-CB 4.3Å; F423-Q427 VanDerWaalsContact O-CB 3.24Å; F423-Q427 WeakPolarHBondContact O-CB 3.49Å; F423-Q427 PolarHBondContact O-N 2.83Å
424	V	88.8	Confident	87	Confident	56 Å²	56	35 Å²	35	34%	0.339	20%	0.195	S	C	.	.	H	α-helix	trans	-61.5	-40.7	178.3	169.9	0	0	0	0	111	L420 V421 L428	L420-V424 HydrophobicContact CD1-CG2 4.34Å; L420-V424 WeakPolarHBondContact O-CG2 3.35Å; L420-V424 PolarHBondContact O-N 3.1Å; V421-V424 PolarHBondContact O-N 3.41Å; V424-L428 WeakPolarHBondContact O-CB 3.33Å; V424-L428 PolarHBondContact O-N 3.25Å
425	L	90.4	Very high	87.3	Confident	59 Å²	59	35 Å²	35	31%	0.309	19%	0.189	S	C	.	.	H	α-helix	trans	-66.2	-46.4	176.7	-71.1	176.1	0	0	0	112.1	P181 T184 V421 S422 F423 Q427 L428 Q429	P181-L425 HydrophobicContact CB-CB 3.78Å; P181-L425 HydrophobicContact CB-CD1 4.22Å; P181-L425 HydrophobicContact CG-CB 4.12Å; T184-L425 HydrophobicContact CG2-CD1 3.89Å; V421-L425 HydrophobicContact CG1-CD1 4.11Å; V421-L425 WeakPolarHBondContact O-CG 3.26Å; V421-L425 PolarHBondContact O-N 3Å; S422-L425 PolarHBondContact O-N 3.47Å; F423-L425 VanDerWaalsContact C-N 3.3Å; F423-L425 PolarHBondContact O-N 3.28Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 3.06Å; L425-L428 PolarHBondContact O-N 3.49Å; L425-Q429 WeakPolarHBondContact O-CG 3.25Å; L425-Q429 PolarHBondContact O-N 3.06Å; L425-Q429 VanDerWaalsContact O-N 3.13Å
426	Y	90.9	Very high	87.5	Confident	10 Å²	10	35.9 Å²	35.9	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-61.4	-43.4	175.5	-72.2	-47.7	0	0	0	112.1	M178 P181 F182 L292 F295 M296 S422 F423 L428 Q429 F430	M178-Y426 HydrophobicContact CB-CE1 4.13Å; M178-Y426 PolarHBondContact O-OH 3.46Å; M178-Y426 HydrophobicContact SD-CD1 4.26Å; M178-Y426 HydrophobicContact SD-CE1 4.13Å; P181-Y426 HydrophobicContact CB-CD1 3.7Å; P181-Y426 HydrophobicContact CB-CD2 4.38Å; P181-Y426 HydrophobicContact CB-CE1 3.48Å; P181-Y426 VanDerWaalsContact CB-CE1 3.48Å; P181-Y426 HydrophobicContact CB-CE2 4.19Å; P181-Y426 HydrophobicContact CB-CG 4.15Å; P181-Y426 HydrophobicContact CG-CD1 3.71Å; P181-Y426 HydrophobicContact CG-CE1 3.6Å; F182-Y426 WeakPolarHBondContact CB-OH 3.14Å; L292-Y426 HydrophobicContact CD2-CD1 3.64Å; L292-Y426 HydrophobicContact CD2-CG 4.33Å; F295-Y426 HydrophobicContact CB-CE1 4.29Å; F295-Y426 HydrophobicContact CB-CE2 4.15Å; M296-Y426 HydrophobicContact CG-CG 4.38Å; S422-Y426 WeakPolarHBondContact O-CD2 3.4Å; S422-Y426 PolarHBondContact O-N 2.96Å; F423-Y426 PolarHBondContact O-N 3.5Å; Y426-L428 PolarHBondContact O-N 3.4Å; Y426-Q429 PolarHBondContact O-N 2.85Å; Y426-F430 VanDerWaalsContact O-CB 3.3Å; Y426-F430 WeakPolarHBondContact O-CB 3.33Å; Y426-F430 PolarHBondContact O-N 3.24Å
427	Q	87.6	Confident	87.5	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-44.2	177.5	-177.6	-144.5	-30.3	0	0	111.6	M296 T307 I402 F423 L425 Q429 F430 T431	M296-Q427 HydrophobicContact CE-CB 3.8Å; M296-Q427 HydrophobicContact CE-CG 4.15Å; T307-Q427 HydrophobicContact CG2-CG 3.64Å; I402-Q427 HydrophobicContact CD1-CG 4.32Å; F423-Q427 HydrophobicContact CE1-CB 4.3Å; F423-Q427 VanDerWaalsContact O-CB 3.24Å; F423-Q427 WeakPolarHBondContact O-CB 3.49Å; F423-Q427 PolarHBondContact O-N 2.83Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 3.06Å; Q427-Q429 VanDerWaalsContact C-N 3.34Å; Q427-Q429 PolarHBondContact O-N 3.04Å; Q427-F430 PolarHBondContact O-N 3.42Å; Q427-T431 WeakPolarHBondContact O-CG2 3.42Å; Q427-T431 PolarHBondContact O-N 3.1Å; Q427-T431 PolarHBondContact O-OG1 2.99Å
428	L	86.9	Confident	87.4	Confident	60 Å²	60	38.4 Å²	38.4	31%	0.314	20%	0.202	S	C	.	.	H	α-helix	trans	-56.7	-51.2	177.4	-171.5	98.2	0	0	0	110.2	V424 L425 Y426 F430 T431 Q432	V424-L428 WeakPolarHBondContact O-CB 3.33Å; V424-L428 PolarHBondContact O-N 3.25Å; L425-L428 PolarHBondContact O-N 3.49Å; Y426-L428 PolarHBondContact O-N 3.4Å; L428-F430 VanDerWaalsContact C-N 3.32Å; L428-F430 PolarHBondContact O-N 3.47Å; L428-T431 PolarHBondContact O-N 3.45Å; L428-T431 PolarHBondContact O-OG1 3.4Å; L428-Q432 WeakPolarHBondContact O-CG 3.48Å; L428-Q432 PolarHBondContact O-N 3.33Å; L428-Q432 VanDerWaalsContact O-N 3.12Å
429	Q	90.3	Very high	87.1	Confident	38 Å²	38	41.7 Å²	41.7	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-37.9	178.1	-67	-172.1	12.5	0	0	112.2	L292 L425 Y426 Q427 Q432 A433	L292-Q429 HydrophobicContact CD1-CB 3.95Å; L292-Q429 HydrophobicContact CD2-CB 4.11Å; L425-Q429 WeakPolarHBondContact O-CG 3.25Å; L425-Q429 PolarHBondContact O-N 3.06Å; L425-Q429 VanDerWaalsContact O-N 3.13Å; Y426-Q429 PolarHBondContact O-N 2.85Å; Q427-Q429 VanDerWaalsContact C-N 3.34Å; Q427-Q429 PolarHBondContact O-N 3.04Å; Q429-Q432 PolarHBondContact O-N 3.43Å; Q429-A433 WeakPolarHBondContact O-CB 3.35Å; Q429-A433 PolarHBondContact O-N 3.42Å
430	F	89.4	Confident	86.9	Confident	16 Å²	16	38.8 Å²	38.8	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-45.3	177.7	179.6	-101.9	0	0	0	111.7	A289 L292 L293 M296 L311 Y426 Q427 L428 Q432 A433 V434	A289-F430 HydrophobicContact CB-CD2 4.47Å; A289-F430 HydrophobicContact CB-CE2 4.27Å; L292-F430 HydrophobicContact CB-CB 4.35Å; L292-F430 HydrophobicContact CB-CD2 4.08Å; L292-F430 HydrophobicContact CD1-CB 4.24Å; L293-F430 HydrophobicContact CB-CE2 4.18Å; L293-F430 HydrophobicContact CD1-CE2 4.31Å; L293-F430 HydrophobicContact CD1-CZ 4.32Å; M296-F430 HydrophobicContact SD-CB 3.83Å; M296-F430 HydrophobicContact SD-CD1 4.42Å; M296-F430 HydrophobicContact SD-CG 4.05Å; L311-F430 HydrophobicContact CD1-CE1 3.99Å; Y426-F430 VanDerWaalsContact O-CB 3.3Å; Y426-F430 WeakPolarHBondContact O-CB 3.33Å; Y426-F430 PolarHBondContact O-N 3.24Å; Q427-F430 PolarHBondContact O-N 3.42Å; L428-F430 VanDerWaalsContact C-N 3.32Å; L428-F430 PolarHBondContact O-N 3.47Å; F430-Q432 VanDerWaalsContact C-N 3.31Å; F430-Q432 PolarHBondContact O-N 3.42Å; F430-A433 PolarHBondContact O-N 3.21Å; F430-V434 HydrophobicContact CD1-CG2 4.25Å; F430-V434 HydrophobicContact CD2-CG2 4.26Å; F430-V434 HydrophobicContact CE1-CG2 3.85Å; F430-V434 HydrophobicContact CE2-CG2 3.85Å; F430-V434 HydrophobicContact CG-CG2 4.44Å; F430-V434 HydrophobicContact CZ-CG2 3.64Å; F430-V434 WeakPolarHBondContact O-CG2 3.3Å; F430-V434 PolarHBondContact O-N 3.07Å
431	T	84.9	Confident	86.3	Confident	24 Å²	24	42.5 Å²	42.5	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-39.4	177.2	54.5	0	0	0	0	112.1	L398 Q427 L428 Q435	L398-T431 HydrophobicContact CD2-CG2 4.22Å; Q427-T431 WeakPolarHBondContact O-CG2 3.42Å; Q427-T431 PolarHBondContact O-N 3.1Å; Q427-T431 PolarHBondContact O-OG1 2.99Å; L428-T431 PolarHBondContact O-N 3.45Å; L428-T431 PolarHBondContact O-OG1 3.4Å; T431-Q435 VanDerWaalsContact O-CB 3.27Å; T431-Q435 WeakPolarHBondContact O-CB 3.44Å; T431-Q435 PolarHBondContact O-N 3.33Å
432	Q	86.3	Confident	85.6	Confident	105 Å²	105	43.5 Å²	43.5	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-65.2	-47.2	174.2	-71.1	174.1	-21.3	0	0	111.7	L428 Q429 F430 V434 Q435 V436	L428-Q432 WeakPolarHBondContact O-CG 3.48Å; L428-Q432 PolarHBondContact O-N 3.33Å; L428-Q432 VanDerWaalsContact O-N 3.12Å; Q429-Q432 PolarHBondContact O-N 3.43Å; F430-Q432 VanDerWaalsContact C-N 3.31Å; F430-Q432 PolarHBondContact O-N 3.42Å; Q432-V434 PolarHBondContact O-N 2.97Å; Q432-Q435 WeakPolarHBondContact O-CB 3.13Å; Q432-Q435 PolarHBondContact O-N 3.36Å; Q432-V436 WeakPolarHBondContact O-CG2 2.84Å; Q432-V436 PolarHBondContact O-N 3.12Å
433	A	89.3	Confident	84.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-44.6	179.4	0	0	0	0	0	112.1	Y285 A289 L292 Q429 F430 V436 L437	Y285-A433 HydrophobicContact CD1-CB 3.85Å; A289-A433 HydrophobicContact CB-CB 4.41Å; L292-A433 HydrophobicContact CD1-CB 4.49Å; Q429-A433 WeakPolarHBondContact O-CB 3.35Å; Q429-A433 PolarHBondContact O-N 3.42Å; F430-A433 PolarHBondContact O-N 3.21Å; A433-V436 PolarHBondContact O-N 3.22Å; A433-L437 WeakPolarHBondContact O-CB 3.23Å; A433-L437 PolarHBondContact O-N 3.44Å
434	V	85.8	Confident	84.2	Confident	19 Å²	19	46.8 Å²	46.8	12%	0.115	25%	0.251	C	S	.	.	H	α-helix	trans	-66.7	-39.4	176.2	177.3	0	0	0	0	111.3	L311 F315 F430 Q432 V436 L437 L438	L311-V434 HydrophobicContact CD2-CG1 4.36Å; F315-V434 HydrophobicContact CE2-CB 4.43Å; F315-V434 HydrophobicContact CE2-CG1 3.53Å; F315-V434 HydrophobicContact CZ-CB 4.19Å; F315-V434 HydrophobicContact CZ-CG1 3.63Å; F430-V434 HydrophobicContact CD1-CG2 4.25Å; F430-V434 HydrophobicContact CD2-CG2 4.26Å; F430-V434 HydrophobicContact CE1-CG2 3.85Å; F430-V434 HydrophobicContact CE2-CG2 3.85Å; F430-V434 HydrophobicContact CG-CG2 4.44Å; F430-V434 HydrophobicContact CZ-CG2 3.64Å; F430-V434 WeakPolarHBondContact O-CG2 3.3Å; F430-V434 PolarHBondContact O-N 3.07Å; Q432-V434 PolarHBondContact O-N 2.97Å; V434-V436 VanDerWaalsContact C-N 3.35Å; V434-V436 PolarHBondContact O-N 3.36Å; V434-L437 PolarHBondContact O-N 3.13Å; V434-L438 HydrophobicContact CG1-CD1 4.03Å; V434-L438 HydrophobicContact CG1-CG 4.32Å; V434-L438 VanDerWaalsContact O-CG 3.3Å; V434-L438 WeakPolarHBondContact O-CG 3.29Å; V434-L438 PolarHBondContact O-N 3.27Å
435	Q	83.4	Confident	83.5	Confident	97 Å²	97	49.1 Å²	49.1	45%	0.453	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-45.4	177.1	-179.8	179.1	-7.4	0	0	111.5	F315 T431 Q432 L438 S439	F315-Q435 HydrophobicContact CE1-CB 4.09Å; F315-Q435 HydrophobicContact CE1-CG 4.46Å; F315-Q435 HydrophobicContact CZ-CB 4.41Å; T431-Q435 VanDerWaalsContact O-CB 3.27Å; T431-Q435 WeakPolarHBondContact O-CB 3.44Å; T431-Q435 PolarHBondContact O-N 3.33Å; Q432-Q435 WeakPolarHBondContact O-CB 3.13Å; Q432-Q435 PolarHBondContact O-N 3.36Å; Q435-L438 PolarHBondContact O-N 2.88Å; Q435-S439 PolarHBondContact O-N 3.47Å; Q435-S439 VanDerWaalsContact O-N 3.12Å
436	V	86.8	Confident	82.7	Confident	38 Å²	38	53.9 Å²	53.9	23%	0.23	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-45.8	175.8	179.4	0	0	0	0	110.5	Y285 Q432 A433 V434 L438 S439 L440	Y285-V436 HydrophobicContact CD1-CB 4.38Å; Y285-V436 HydrophobicContact CD2-CB 4.07Å; Y285-V436 HydrophobicContact CD2-CG1 3.53Å; Y285-V436 HydrophobicContact CE1-CB 4.25Å; Y285-V436 HydrophobicContact CE1-CG2 4.23Å; Y285-V436 HydrophobicContact CE2-CB 3.97Å; Y285-V436 HydrophobicContact CE2-CG1 3.36Å; Y285-V436 HydrophobicContact CE2-CG2 4.3Å; Y285-V436 HydrophobicContact CG-CB 4.27Å; Y285-V436 HydrophobicContact CG-CG1 4.21Å; Q432-V436 WeakPolarHBondContact O-CG2 2.84Å; Q432-V436 PolarHBondContact O-N 3.12Å; A433-V436 PolarHBondContact O-N 3.22Å; V434-V436 VanDerWaalsContact C-N 3.35Å; V434-V436 PolarHBondContact O-N 3.36Å; V436-L438 PolarHBondContact O-N 2.94Å; V436-L438 VanDerWaalsContact O-N 3.17Å; V436-S439 PolarHBondContact O-N 3.37Å; V436-S439 PolarHBondContact O-OG 3.35Å; V436-L440 HydrophobicContact CG1-CG 4.44Å; V436-L440 WeakPolarHBondContact O-CG 3.14Å; V436-L440 PolarHBondContact O-N 2.95Å
437	L	85.1	Confident	82	Confident	47 Å²	47	53.6 Å²	53.6	25%	0.246	28%	0.276	C	S	.	.	H	α-helix	trans	-56.6	-37	178.5	-169.4	65.1	0	0	0	112.4	L282 L286 A433 V434 L440	L282-L437 HydrophobicContact CG-CD1 4.22Å; L286-L437 HydrophobicContact CB-CD1 4.49Å; L286-L437 HydrophobicContact CD1-CD2 4.01Å; A433-L437 WeakPolarHBondContact O-CB 3.23Å; A433-L437 PolarHBondContact O-N 3.44Å; V434-L437 PolarHBondContact O-N 3.13Å; L437-L440 HydrophobicContact CD1-CD1 4.27Å; L437-L440 PolarHBondContact O-N 3.36Å
438	L	81.7	Confident	81.4	Confident	78 Å²	78	54 Å²	54	41%	0.408	28%	0.279	S	S	.	.	H	α-helix	trans	-71.5	-31.7	175.3	-70.6	172.9	0	0	0	113.3	F315 V434 Q435 V436 L440	F315-L438 HydrophobicContact CB-CD1 4.38Å; F315-L438 HydrophobicContact CD1-CD1 3.45Å; F315-L438 VanDerWaalsContact CD1-CD1 3.45Å; F315-L438 HydrophobicContact CD2-CD1 3.57Å; F315-L438 HydrophobicContact CE1-CD1 3.48Å; F315-L438 VanDerWaalsContact CE1-CD1 3.48Å; F315-L438 HydrophobicContact CE2-CD1 3.57Å; F315-L438 HydrophobicContact CG-CD1 3.52Å; F315-L438 HydrophobicContact CZ-CD1 3.55Å; V434-L438 HydrophobicContact CG1-CD1 4.03Å; V434-L438 HydrophobicContact CG1-CG 4.32Å; V434-L438 VanDerWaalsContact O-CG 3.3Å; V434-L438 WeakPolarHBondContact O-CG 3.29Å; V434-L438 PolarHBondContact O-N 3.27Å; Q435-L438 PolarHBondContact O-N 2.88Å; V436-L438 PolarHBondContact O-N 2.94Å; V436-L438 VanDerWaalsContact O-N 3.17Å; L438-L440 VanDerWaalsContact C-N 3.32Å
439	S	80.5	Confident	80.9	Confident	68 Å²	68	52.8 Å²	52.8	48%	0.476	28%	0.281	S	S	.	.	H	α-helix	trans	-76.7	-18.1	175.8	69.9	0	0	0	0	113.3	Q435 V436 Y441 P442	Q435-S439 PolarHBondContact O-N 3.47Å; Q435-S439 VanDerWaalsContact O-N 3.12Å; V436-S439 PolarHBondContact O-N 3.37Å; V436-S439 PolarHBondContact O-OG 3.35Å; S439-Y441 VanDerWaalsContact C-N 3.33Å; S439-P442 WeakPolarHBondContact O-CD 3.39Å
440	L	80.7	Confident	80.1	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	29%	0.291	C	S	.	.	H	α-helix	trans	-70.9	-26.2	174.7	-63.4	175.1	0	0	0	113	T278 L281 L282 V436 L437 L438 S443 M444	T278-L440 HydrophobicContact CG2-CB 3.89Å; T278-L440 HydrophobicContact CG2-CD2 3.89Å; T278-L440 HydrophobicContact CG2-CG 4.35Å; L281-L440 HydrophobicContact CB-CD1 3.75Å; L281-L440 HydrophobicContact CB-CD2 3.71Å; L281-L440 HydrophobicContact CB-CG 4.39Å; L281-L440 HydrophobicContact CD1-CD2 3.73Å; L281-L440 HydrophobicContact CG-CD2 4.38Å; L282-L440 HydrophobicContact CB-CD1 4.01Å; V436-L440 HydrophobicContact CG1-CG 4.44Å; V436-L440 WeakPolarHBondContact O-CG 3.14Å; V436-L440 PolarHBondContact O-N 2.95Å; L437-L440 HydrophobicContact CD1-CD1 4.27Å; L437-L440 PolarHBondContact O-N 3.36Å; L438-L440 VanDerWaalsContact C-N 3.32Å; L440-S443 PolarHBondContact O-N 3.07Å; L440-M444 WeakPolarHBondContact O-CG 2.95Å; L440-M444 PolarHBondContact O-N 3.36Å
441	Y	75.1	Confident	79.6	Confident	96 Å²	96	52.8 Å²	52.8	38%	0.376	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-51.4	-175.3	175.9	-86.9	0	0	0	113.4	L136 S439 S443 M444 Q445	L136-Y441 VanDerWaalsContact O-CE2 3.24Å; L136-Y441 WeakPolarHBondContact O-CE2 3.14Å; L136-Y441 VanDerWaalsContact O-CZ 3.32Å; L136-Y441 PolarHBondContact O-OH 3.33Å; S439-Y441 VanDerWaalsContact C-N 3.33Å; Y441-S443 VanDerWaalsContact C-N 3.27Å; Y441-S443 PolarHBondContact O-N 3.41Å; Y441-M444 PolarHBondContact O-N 2.72Å; Y441-Q445 PolarHBondContact O-N 3.46Å
442	P	75.2	Confident	79.4	Confident	70 Å²	70	55.5 Å²	55.5	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-58.7	-38.3	174.9	-24.1	34.1	0	0	0	113	S439 Q445 K446	S439-P442 WeakPolarHBondContact O-CD 3.39Å; P442-Q445 PolarHBondContact O-N 3.43Å; P442-K446 WeakPolarHBondContact O-CB 3.26Å; P442-K446 PolarHBondContact O-N 2.91Å
443	S	75.3	Confident	79	Confident	58 Å²	58	56.1 Å²	56.1	41%	0.406	30%	0.3	S	S	.	.	H	α-helix	trans	-65.2	-42.5	177.7	-59.4	0	0	0	0	111.8	L440 Y441 K446 A447	L440-S443 PolarHBondContact O-N 3.07Å; Y441-S443 VanDerWaalsContact C-N 3.27Å; Y441-S443 PolarHBondContact O-N 3.41Å; S443-K446 PolarHBondContact O-N 2.87Å; S443-A447 WeakPolarHBondContact O-CB 3.33Å; S443-A447 PolarHBondContact O-N 3.35Å
444	M	74.6	Confident	78.7	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-46.5	172.1	-72.6	-76	61.7	0	0	111.7	I275 T278 L440 Y441 K446 A447 V448	I275-M444 HydrophobicContact CG1-CE 4.3Å; T278-M444 HydrophobicContact CG2-CB 4.46Å; T278-M444 HydrophobicContact CG2-CE 3.42Å; T278-M444 VanDerWaalsContact CG2-CE 3.42Å; T278-M444 HydrophobicContact CG2-CG 3.38Å; T278-M444 HydrophobicContact CG2-SD 3.51Å; T278-M444 VanDerWaalsContact CG2-SD 3.51Å; L440-M444 WeakPolarHBondContact O-CG 2.95Å; L440-M444 PolarHBondContact O-N 3.36Å; Y441-M444 PolarHBondContact O-N 2.72Å; M444-K446 VanDerWaalsContact C-N 3.3Å; M444-K446 PolarHBondContact O-N 3.09Å; M444-A447 HydrophobicContact CE-CB 4.34Å; M444-A447 PolarHBondContact O-N 2.86Å; M444-V448 WeakPolarHBondContact O-CB 3.41Å; M444-V448 VanDerWaalsContact O-CG2 3.29Å; M444-V448 WeakPolarHBondContact O-CG2 3.34Å; M444-V448 PolarHBondContact O-N 3.08Å
445	Q	73.9	Confident	78.6	Confident	104 Å²	104	56.2 Å²	56.2	49%	0.486	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-39.8	-179.1	-169.8	173.2	5.1	0	0	111.6	Y441 P442 G449	Y441-Q445 PolarHBondContact O-N 3.46Å; P442-Q445 PolarHBondContact O-N 3.43Å; Q445-G449 PolarHBondContact O-N 3.22Å
446	K	73.8	Confident	78.7	Confident	160 Å²	160	57.6 Å²	57.6	70%	0.696	31%	0.305	S	S	*	.	H	α-helix	trans	-63.9	-45.4	174	-172	-178.5	178.8	-172.8	0	111.5	P442 S443 M444 G449 S450	P442-K446 WeakPolarHBondContact O-CB 3.26Å; P442-K446 PolarHBondContact O-N 2.91Å; S443-K446 PolarHBondContact O-N 2.87Å; M444-K446 VanDerWaalsContact C-N 3.3Å; M444-K446 PolarHBondContact O-N 3.09Å; K446-G449 PolarHBondContact O-N 3.48Å; K446-S450 PolarHBondContact O-N 3.07Å; K446-S450 PolarHBondContact O-OG 3.28Å
447	A	75.6	Confident	78.5	Confident	4 Å²	4	56.7 Å²	56.7	3%	0.033	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-41.7	179.4	0	0	0	0	0	112.3	I275 S443 M444 S450 S451	I275-A447 HydrophobicContact CD1-CB 4.34Å; I275-A447 HydrophobicContact CG1-CB 3.72Å; S443-A447 WeakPolarHBondContact O-CB 3.33Å; S443-A447 PolarHBondContact O-N 3.35Å; M444-A447 HydrophobicContact CE-CB 4.34Å; M444-A447 PolarHBondContact O-N 2.86Å; A447-S450 PolarHBondContact O-N 3.31Å; A447-S451 WeakPolarHBondContact O-CB 3.21Å; A447-S451 PolarHBondContact O-N 3.3Å
448	V	76.1	Confident	78.5	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-45.8	173.6	170.6	0	0	0	0	110.8	A145 M148 L149 M444 S450 S451 E452	A145-V448 HydrophobicContact CB-CG1 3.81Å; M148-V448 HydrophobicContact CB-CG1 4.38Å; M148-V448 HydrophobicContact SD-CG1 3.65Å; L149-V448 HydrophobicContact CD2-CG2 4.37Å; L149-V448 HydrophobicContact CG-CG2 4.18Å; M444-V448 WeakPolarHBondContact O-CB 3.41Å; M444-V448 VanDerWaalsContact O-CG2 3.29Å; M444-V448 WeakPolarHBondContact O-CG2 3.34Å; M444-V448 PolarHBondContact O-N 3.08Å; V448-S450 VanDerWaalsContact C-N 3.32Å; V448-S450 PolarHBondContact O-N 3.08Å; V448-S451 WeakPolarHBondContact CA-OG 3.23Å; V448-S451 WeakPolarHBondContact O-CB 3.47Å; V448-S451 PolarHBondContact O-N 3.31Å; V448-S451 PolarHBondContact O-OG 3.47Å; V448-E452 PolarHBondContact O-N 3.06Å; V448-E452 VanDerWaalsContact O-N 3.1Å
449	G	74.4	Confident	78.8	Confident	36 Å²	36	57 Å²	57	37%	0.371	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-36.5	177	0	0	0	0	0	113.7	Q445 K446	Q445-G449 PolarHBondContact O-N 3.22Å; K446-G449 PolarHBondContact O-N 3.48Å
450	S	73.4	Confident	79.1	Confident	54 Å²	54	58.4 Å²	58.4	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-69.2	-35	172	-64.3	0	0	0	0	112.3	K446 A447 V448 E452	K446-S450 PolarHBondContact O-N 3.07Å; K446-S450 PolarHBondContact O-OG 3.28Å; A447-S450 PolarHBondContact O-N 3.31Å; V448-S450 VanDerWaalsContact C-N 3.32Å; V448-S450 PolarHBondContact O-N 3.08Å; S450-E452 VanDerWaalsContact C-N 3.32Å; S450-E452 PolarHBondContact O-N 2.98Å
451	S	80.5	Confident	79.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-31.3	178.8	78.9	0	0	0	0	113.4	M271 A447 V448 K453 I454 F455	M271-S451 WeakPolarHBondContact SD-CA 3.42Å; M271-S451 WeakPolarHBondContact SD-CB 3.49Å; A447-S451 WeakPolarHBondContact O-CB 3.21Å; A447-S451 PolarHBondContact O-N 3.3Å; V448-S451 WeakPolarHBondContact CA-OG 3.23Å; V448-S451 WeakPolarHBondContact O-CB 3.47Å; V448-S451 PolarHBondContact O-N 3.31Å; V448-S451 PolarHBondContact O-OG 3.47Å; S451-K453 VanDerWaalsContact C-N 3.26Å; S451-K453 PolarHBondContact O-N 2.89Å; S451-I454 PolarHBondContact O-N 2.87Å; S451-F455 VanDerWaalsContact O-CD2 3.24Å; S451-F455 WeakPolarHBondContact O-CD2 3.17Å; S451-F455 PolarHBondContact O-N 3.34Å
452	E	80.8	Confident	79.2	Confident	81 Å²	81	60.8 Å²	60.8	38%	0.379	32%	0.321	S	S	.	.	H	α-helix	trans	-54.9	-42.9	-179.9	-174.6	171.3	-173.8	0	0	111.6	N142 M148 V448 S450 F455 E456	N142-E452 PolarHBondContact ND2-OE1 3.32Å; N142-E452 PolarHBondContact ND2-OE2 3.49Å; M148-E452 HydrophobicContact CE-CB 3.78Å; M148-E452 HydrophobicContact CE-CG 3.67Å; M148-E452 HydrophobicContact SD-CB 4.17Å; V448-E452 PolarHBondContact O-N 3.06Å; V448-E452 VanDerWaalsContact O-N 3.1Å; S450-E452 VanDerWaalsContact C-N 3.32Å; S450-E452 PolarHBondContact O-N 2.98Å; E452-F455 PolarHBondContact O-N 3.19Å; E452-E456 PolarHBondContact O-N 3.34Å
453	K	76.8	Confident	78.6	Confident	118 Å²	118	62.8 Å²	62.8	51%	0.513	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-41.7	177.1	-65.5	179.7	-176.5	173.1	0	111.9	S451 F455 E456 Y457	S451-K453 VanDerWaalsContact C-N 3.26Å; S451-K453 PolarHBondContact O-N 2.89Å; K453-F455 VanDerWaalsContact C-N 3.33Å; K453-E456 WeakPolarHBondContact O-CB 3.32Å; K453-E456 PolarHBondContact O-N 3.43Å; K453-Y457 WeakPolarHBondContact O-CD2 3.46Å; K453-Y457 PolarHBondContact O-N 3.44Å
454	I	84.3	Confident	77.9	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-38.4	179.4	-66.3	160.5	0	0	0	110.5	V240 D267 M271 S451 E456 Y457 L458	V240-I454 HydrophobicContact CG2-CG2 3.65Å; D267-I454 HydrophobicContact CB-CD1 4.36Å; M271-I454 HydrophobicContact CB-CD1 3.82Å; M271-I454 HydrophobicContact CE-CD1 3.76Å; M271-I454 HydrophobicContact CE-CG2 4.19Å; M271-I454 HydrophobicContact CG-CD1 4.18Å; M271-I454 HydrophobicContact SD-CB 4.25Å; M271-I454 HydrophobicContact SD-CD1 3.43Å; M271-I454 WeakPolarHBondContact SD-CD1 3.33Å; M271-I454 HydrophobicContact SD-CG1 4.43Å; M271-I454 HydrophobicContact SD-CG2 4.49Å; S451-I454 PolarHBondContact O-N 2.87Å; I454-E456 VanDerWaalsContact C-N 3.31Å; I454-Y457 WeakPolarHBondContact O-CB 3.46Å; I454-Y457 PolarHBondContact O-N 2.92Å; I454-Y457 VanDerWaalsContact O-N 3.17Å; I454-L458 HydrophobicContact CG2-CD1 4.38Å; I454-L458 PolarHBondContact O-N 3.35Å
455	F	83.7	Confident	77.2	Confident	14 Å²	14	64.4 Å²	64.4	6%	0.061	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-33.6	171.8	-79.8	-64.8	0	0	0	112.4	R151 M152 F155 S451 E452 K453 Y457 L458 D459	R151-F455 HydrophobicContact CB-CE1 4.11Å; R151-F455 HydrophobicContact CB-CZ 3.94Å; M152-F455 HydrophobicContact CG-CE2 3.51Å; M152-F455 HydrophobicContact CG-CZ 3.41Å; M152-F455 VanDerWaalsContact CG-CZ 3.41Å; M152-F455 HydrophobicContact SD-CE2 3.97Å; M152-F455 HydrophobicContact SD-CZ 4.39Å; F155-F455 AromaticContact CE2-CE1 3.91Å; F155-F455 HydrophobicContact CE2-CE1 3.91Å; F155-F455 HydrophobicContact CE2-CZ 4.16Å; F155-F455 HydrophobicContact CZ-CE1 4.47Å; S451-F455 VanDerWaalsContact O-CD2 3.24Å; S451-F455 WeakPolarHBondContact O-CD2 3.17Å; S451-F455 PolarHBondContact O-N 3.34Å; E452-F455 PolarHBondContact O-N 3.19Å; K453-F455 VanDerWaalsContact C-N 3.33Å; F455-Y457 VanDerWaalsContact C-N 3.26Å; F455-Y457 PolarHBondContact O-N 2.85Å; F455-L458 HydrophobicContact CD1-CD1 4Å; F455-L458 HydrophobicContact CE1-CD1 4.2Å; F455-L458 PolarHBondContact O-N 3.29Å; F455-L458 VanDerWaalsContact O-N 3.14Å; F455-D459 VanDerWaalsContact O-CB 3.27Å; F455-D459 WeakPolarHBondContact O-CB 3.49Å; F455-D459 PolarHBondContact O-N 2.92Å
456	E	83.8	Confident	76.5	Confident	125 Å²	125	63.1 Å²	63.1	58%	0.584	34%	0.342	S	S	*	.	H	α-helix	trans	-57.1	-41.2	170	-165.3	-169.8	163	0	0	111.2	E452 K453 I454 R460	E452-E456 PolarHBondContact O-N 3.34Å; K453-E456 WeakPolarHBondContact O-CB 3.32Å; K453-E456 PolarHBondContact O-N 3.43Å; I454-E456 VanDerWaalsContact C-N 3.31Å; E456-R460 WeakPolarHBondContact O-CB 3.45Å; E456-R460 PolarHBondContact O-N 2.93Å; E456-R460 VanDerWaalsContact O-N 3.1Å
457	Y	82.8	Confident	76	Confident	20 Å²	20	57.5 Å²	57.5	8%	0.078	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-39.1	173.7	-79.1	-92.5	0	0	0	113.4	V244 F251 R263 K453 I454 F455	V244-Y457 HydrophobicContact CG2-CD1 3.94Å; F251-Y457 AromaticContact CE1-CE1 3.91Å; F251-Y457 HydrophobicContact CE1-CE1 3.91Å; F251-Y457 HydrophobicContact CE2-CE1 4.26Å; F251-Y457 HydrophobicContact CZ-CD1 4.01Å; F251-Y457 AromaticContact CZ-CE1 3.3Å; F251-Y457 HydrophobicContact CZ-CE1 3.3Å; R263-Y457 WeakPolarHBondContact CD-OH 3.41Å; R263-Y457 PolarHBondContact NH1-OH 3.19Å; K453-Y457 WeakPolarHBondContact O-CD2 3.46Å; K453-Y457 PolarHBondContact O-N 3.44Å; I454-Y457 WeakPolarHBondContact O-CB 3.46Å; I454-Y457 PolarHBondContact O-N 2.92Å; I454-Y457 VanDerWaalsContact O-N 3.17Å; F455-Y457 VanDerWaalsContact C-N 3.26Å; F455-Y457 PolarHBondContact O-N 2.85Å
458	L	86.6	Confident	76.1	Confident	39 Å²	39	58.5 Å²	58.5	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-73.1	-39.6	-178.8	-77.6	167.6	0	0	0	112.9	F155 E239 V240 A243 I454 F455	F155-L458 HydrophobicContact CZ-CD1 4.13Å; E239-L458 HydrophobicContact CB-CD2 4.18Å; V240-L458 HydrophobicContact CB-CD2 4.47Å; V240-L458 HydrophobicContact CG2-CD1 3.89Å; V240-L458 HydrophobicContact CG2-CD2 3.92Å; V240-L458 HydrophobicContact CG2-CG 3.92Å; A243-L458 HydrophobicContact CB-CD2 3.99Å; I454-L458 HydrophobicContact CG2-CD1 4.38Å; I454-L458 PolarHBondContact O-N 3.35Å; F455-L458 HydrophobicContact CD1-CD1 4Å; F455-L458 HydrophobicContact CE1-CD1 4.2Å; F455-L458 PolarHBondContact O-N 3.29Å; F455-L458 VanDerWaalsContact O-N 3.14Å
459	D	87.4	Confident	76.5	Confident	92 Å²	92	63.5 Å²	63.5	49%	0.492	37%	0.37	S	S	.	.	H	α-helix	trans	-85.3	-14.4	-176.4	-69.8	-11.2	0	0	0	112	R151 F455 T461	R151-D459 IonicContact CZ-OD2 2.85Å; R151-D459 IonicContact NH1-OD1 3.77Å; R151-D459 IonicContact NH1-OD2 3.47Å; R151-D459 PolarHBondContact NH1-OD2 3.29Å; R151-D459 IonicContact NH2-OD2 2.99Å; F455-D459 VanDerWaalsContact O-CB 3.27Å; F455-D459 WeakPolarHBondContact O-CB 3.49Å; F455-D459 PolarHBondContact O-N 2.92Å; D459-T461 PolarHBondContact O-N 3.02Å; D459-T461 VanDerWaalsContact O-N 3.08Å
460	R	85.6	Confident	77.1	Confident	98 Å²	98	64.4 Å²	64.4	37%	0.37	37%	0.366	S	S	.	.			trans	-64	112.3	174.9	-177.5	175.5	178.1	126.8	1.9	109.9	Q247 E248 E456	Q247-R460 VanDerWaalsContact CD-NE 3.3Å; E248-R460 IonicContact OE1-CZ 3.16Å; E248-R460 IonicContact OE1-NE 3.02Å; E248-R460 IonicContact OE1-NH2 3.49Å; E248-R460 PolarHBondContact OE1-NH2 3.36Å; E456-R460 WeakPolarHBondContact O-CB 3.45Å; E456-R460 PolarHBondContact O-N 2.93Å; E456-R460 VanDerWaalsContact O-N 3.1Å
461	T	80.6	Confident	77.8	Confident	114 Å²	114	64.8 Å²	64.8	70%	0.699	37%	0.372	S	S	*	.			trans	-80.7	135.9	167.9	53.3	0	0	0	0	109.6	D459	D459-T461 PolarHBondContact O-N 3.02Å; D459-T461 VanDerWaalsContact O-N 3.08Å
462	P	77.3	Confident	78.1	Confident	42 Å²	42	66.4 Å²	66.4	27%	0.273	38%	0.383	S	S	.	.			trans	-61.2	141.2	174.2	25.8	-32.9	0	0	0	110.8	E248 S464 L466	E248-P462 VanDerWaalsContact OE2-CA 3.26Å; E248-P462 WeakPolarHBondContact OE2-CA 3.44Å; P462-S464 PolarHBondContact O-N 3.12Å; P462-L466 HydrophobicContact CG-CD1 4.26Å
463	C	64.4	Low	78	Confident	112 Å²	112	68.1 Å²	68.1	76%	0.757	40%	0.404	S	S	*	.	S	Bend	trans	-68	-23	-174.8	-64.5	0	0	0	0	112.7	E248	E248-C463 PolarHBondContact OE2-N 3.08Å
464	S	60.2	Low	78.2	Confident	29 Å²	29	69.5 Å²	69.5	20%	0.203	42%	0.416	C	S	.	.	S	Bend	trans	-117.6	138.8	171.5	172.4	0	0	0	0	109.1	P462 L466 Q532	P462-S464 PolarHBondContact O-N 3.12Å; S464-L466 PolarHBondContact O-N 3.39Å; S464-Q532 PolarHBondContact OG-NE2 3.05Å
465	P	59.7	Low	78.2	Confident	88 Å²	88	70.5 Å²	70.5	57%	0.571	42%	0.421	S	S	*	.			trans	-55.2	133.1	164.9	25.4	-32.2	0	0	0	108.7	S467	P465-S467 PolarHBondContact O-N 2.94Å
466	L	59.3	Low	78.3	Confident	76 Å²	76	77.6 Å²	77.6	40%	0.398	45%	0.452	S	S	.	.	S	Bend	trans	-60	-35.4	179	-98.8	117.7	0	0	0	112	R246 P462 S464 H550	R246-L466 HydrophobicContact CB-CD1 3.87Å; R246-L466 HydrophobicContact CG-CD1 4.13Å; R246-L466 WeakPolarHBondContact O-CD1 3.22Å; P462-L466 HydrophobicContact CG-CD1 4.26Å; S464-L466 PolarHBondContact O-N 3.39Å; L466-H550 WeakPolarHBondContact O-CB 3.49Å
467	S	64	Low	78.4	Confident	43 Å²	43	71.8 Å²	71.8	30%	0.301	43%	0.425	S	S	.	.			trans	-139.3	139.6	-174	-84.1	0	0	0	0	110.4	P465 D549 H550	P465-S467 PolarHBondContact O-N 2.94Å; S467-D549 WeakPolarHBondContact CB-OD1 3.39Å; S467-D549 PolarHBondContact OG-OD1 3.17Å; S467-H550 WeakPolarHBondContact OG-CB 2.85Å; S467-H550 PolarHBondContact OG-N 3.12Å
468	G	77.4	Confident	78.9	Confident	24 Å²	24	72.9 Å²	72.9	25%	0.247	43%	0.432	C	S	.	.			trans	-83.5	-165.4	152.2	0	0	0	0	0	111.2	Q547 Y548 D549	G468-Q547 CarbonylContact C-O 3.58Å; G468-Q547 WeakPolarHBondContact CA-O 3.47Å; G468-Y548 PolarHBondContact N-O 2.88Å; G468-D549 WeakPolarHBondContact O-CA 3.19Å
469	S	83.8	Confident	79.3	Confident	120 Å²	120	71 Å²	71	84%	0.839	42%	0.423	S	S	*	.	S	Bend	trans	-109.2	-1.6	-176.2	69.2	0	0	0	0	114.4	A471 Q547	S469-A471 PolarHBondContact O-N 3.06Å; S469-Q547 PolarHBondContact N-O 2.95Å; S469-Q547 VanDerWaalsContact N-O 3.1Å
470	L	87.2	Confident	79.7	Confident	56 Å²	56	69 Å²	69	29%	0.293	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-78.2	121.3	-176.2	-105	139.4	0	0	0	111.6	Q547 Y548 D549	L470-Q547 WeakPolarHBondContact CB-O 3.36Å; L470-Q547 HydrophobicContact CD1-CB 3.81Å; L470-Q547 PolarHBondContact N-O 2.93Å; L470-Y548 HydrophobicContact CB-CD1 4.24Å; L470-Y548 HydrophobicContact CB-CG 4.43Å; L470-Y548 WeakPolarHBondContact O-CA 3.3Å; L470-D549 PolarHBondContact O-N 2.7Å
471	A	87.2	Confident	80.2	Confident	61 Å²	61	64.5 Å²	64.5	50%	0.504	39%	0.393	S	S	.	.			trans	-139.9	73	171.3	0	0	0	0	0	109.8	S469 Y552	S469-A471 PolarHBondContact O-N 3.06Å; A471-Y552 HydrophobicContact CB-CD1 4.46Å; A471-Y552 HydrophobicContact CB-CD2 3.77Å; A471-Y552 HydrophobicContact CB-CE2 4.36Å; A471-Y552 HydrophobicContact CB-CG 3.83Å
472	P	87.4	Confident	80.8	Confident	35 Å²	35	62.9 Å²	62.9	23%	0.227	38%	0.378	C	S	.	.			trans	-64.2	147.3	-178.2	24.8	-32.4	0	0	0	112.2	M475 Y548 Y552	P472-M475 HydrophobicContact CB-CG 4.42Å; P472-M475 HydrophobicContact CG-CG 3.68Å; P472-M475 HydrophobicContact CG-SD 3.85Å; P472-Y548 HydrophobicContact CG-CE1 3.88Å; P472-Y552 HydrophobicContact CG-CE1 4.11Å; P472-Y552 VanDerWaalsContact O-CE2 3.3Å; P472-Y552 WeakPolarHBondContact O-CE2 3.45Å; P472-Y552 PolarHBondContact O-OH 3.48Å
473	S	79.7	Confident	81.6	Confident	117 Å²	117	65.8 Å²	65.8	82%	0.818	39%	0.391	S	S	*	.	S	Bend	trans	-74.3	-34.1	178.8	49.7	0	0	0	0	113
474	N	80.8	Confident	83.1	Confident	146 Å²	146	60.4 Å²	60.4	78%	0.781	36%	0.355	S	S	*	.			trans	-120.4	124.6	179.4	-69.4	-28.3	0	0	0	109.8
475	M	84.1	Confident	84.7	Confident	29 Å²	29	60.1 Å²	60.1	14%	0.143	35%	0.353	C	S	.	.			trans	-123.5	145.1	170.7	-75.8	-135.4	-57	0	0	110.6	P472 L540 D541 Y548 Y552 Q556 L638	P472-M475 HydrophobicContact CB-CG 4.42Å; P472-M475 HydrophobicContact CG-CG 3.68Å; P472-M475 HydrophobicContact CG-SD 3.85Å; M475-L540 HydrophobicContact CE-CD2 3.58Å; M475-L540 HydrophobicContact CE-CG 4.22Å; M475-L540 HydrophobicContact SD-CD2 4.16Å; M475-L540 HydrophobicContact SD-CG 4.36Å; M475-D541 WeakPolarHBondContact CA-OD2 3.18Å; M475-D541 VanDerWaalsContact CB-OD2 3.28Å; M475-D541 WeakPolarHBondContact CB-OD2 3.46Å; M475-Y548 HydrophobicContact CE-CE1 4.34Å; M475-Y548 HydrophobicContact SD-CE1 3.57Å; M475-Y548 VanDerWaalsContact SD-CE1 3.57Å; M475-Y552 HydrophobicContact CE-CE1 3.95Å; M475-Y552 WeakPolarHBondContact CG-OH 3.42Å; M475-Y552 HydrophobicContact SD-CE1 4.29Å; M475-Q556 HydrophobicContact CE-CB 4.03Å; M475-Q556 HydrophobicContact CE-CG 3.95Å; M475-L638 HydrophobicContact CB-CD1 3.65Å
476	K	84.6	Confident	86.3	Confident	164 Å²	164	56.1 Å²	56.1	71%	0.713	33%	0.326	S	S	*	.			trans	-91.9	-29.8	177.1	-63.3	178.7	-178.7	176.9	0	110.6	P506 D541	K476-P506 VanDerWaalsContact O-CB 3.26Å; K476-P506 WeakPolarHBondContact O-CB 3.28Å; K476-D541 PolarHBondContact N-OD2 3.34Å
477	G	86.4	Confident	87.9	Confident	2 Å²	2	53 Å²	53	2%	0.021	31%	0.311	C	S	.	.			trans	83.9	25.4	-179.8	0	0	0	0	0	113.8	D541 T671	G477-D541 PolarHBondContact N-OD1 3.24Å; G477-D541 PolarHBondContact N-OD2 3.31Å; G477-D541 VanDerWaalsContact N-OD2 3.16Å; G477-T671 PolarHBondContact O-OG1 3.24Å
478	L	93.4	Very high	89.1	Confident	43 Å²	43	53.4 Å²	53.4	23%	0.225	31%	0.307	C	S	.	.			trans	-77.6	124.1	172	-178.5	73	0	0	0	109.2	E480 L540 D541	L478-E480 HydrophobicContact CD2-CG 4.5Å; L478-E480 HydrophobicContact CG-CG 4.35Å; L478-L540 CarbonylContact O-C 3.34Å; L478-L540 WeakPolarHBondContact O-CA 3.48Å; L478-D541 WeakPolarHBondContact CB-OD1 3.45Å; L478-D541 PolarHBondContact N-OD1 3.21Å; L478-D541 PolarHBondContact O-N 3.42Å
479	V	95	Very high	89.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.1	177.7	-174.3	0	0	0	0	109.5	F481 T503 L504 L527 L538 L539 L540 L639	V479-F481 HydrophobicContact CG1-CD2 4.27Å; V479-F481 HydrophobicContact CG1-CE2 4.03Å; V479-T503 CarbonylContact O-C 3.51Å; V479-T503 VanDerWaalsContact O-CA 3.29Å; V479-T503 WeakPolarHBondContact O-CA 3.43Å; V479-L504 HydrophobicContact CB-CB 3.97Å; V479-L504 HydrophobicContact CB-CD1 4.11Å; V479-L504 HydrophobicContact CB-CG 4.22Å; V479-L504 HydrophobicContact CG1-CD1 4.4Å; V479-L504 HydrophobicContact CG2-CB 4.33Å; V479-L504 HydrophobicContact CG2-CD1 4.25Å; V479-L504 PolarHBondContact N-O 3.47Å; V479-L504 VanDerWaalsContact N-O 3.08Å; V479-L504 PolarHBondContact O-N 3.31Å; V479-L527 HydrophobicContact CG1-CD2 3.52Å; V479-L538 HydrophobicContact CG1-CD1 4.37Å; V479-L539 WeakPolarHBondContact CA-O 3.36Å; V479-L540 HydrophobicContact CG2-CD1 3.75Å; V479-L639 HydrophobicContact CG2-CD1 4.23Å; V479-L639 HydrophobicContact CG2-CD2 3.95Å
480	E	95.3	Very high	89.5	Confident	51 Å²	51	53 Å²	53	24%	0.238	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.9	177.9	-49.9	-176.8	156.8	0	0	110.9	L478 Q482 T503 L539	L478-E480 HydrophobicContact CD2-CG 4.5Å; L478-E480 HydrophobicContact CG-CG 4.35Å; E480-Q482 PolarHBondContact OE2-NE2 3.42Å; E480-T503 HydrophobicContact CB-CG2 4.25Å; E480-T503 HydrophobicContact CG-CG2 4Å; E480-L539 HydrophobicContact CB-CB 4.29Å; E480-L539 PolarHBondContact N-O 3.03Å; E480-L539 PolarHBondContact O-N 3.24Å
481	F	95.6	Very high	89.5	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.009	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.2	165.7	-76.2	-108.3	0	0	0	108.2	V479 V484 L500 T501 F502 V523 L527 L538	V479-F481 HydrophobicContact CG1-CD2 4.27Å; V479-F481 HydrophobicContact CG1-CE2 4.03Å; F481-V484 HydrophobicContact CB-CG2 4.1Å; F481-V484 HydrophobicContact CD1-CB 3.92Å; F481-V484 HydrophobicContact CD1-CG1 4.23Å; F481-V484 HydrophobicContact CD1-CG2 3.75Å; F481-V484 HydrophobicContact CG-CG2 4.31Å; F481-L500 HydrophobicContact CD1-CD2 4.07Å; F481-L500 HydrophobicContact CE1-CD2 4.3Å; F481-T501 VanDerWaalsContact O-CA 3.29Å; F481-T501 WeakPolarHBondContact O-CA 3.22Å; F481-T501 WeakPolarHBondContact O-CG2 3.3Å; F481-F502 HydrophobicContact CB-CD1 4.06Å; F481-F502 HydrophobicContact CB-CE1 4.05Å; F481-F502 AromaticContact CD1-CE1 3.99Å; F481-F502 HydrophobicContact CD1-CE1 3.99Å; F481-F502 HydrophobicContact CD1-CZ 4.25Å; F481-F502 HydrophobicContact CD2-CD1 4.22Å; F481-F502 HydrophobicContact CD2-CD2 4.17Å; F481-F502 AromaticContact CD2-CE1 3.6Å; F481-F502 HydrophobicContact CD2-CE1 3.6Å; F481-F502 AromaticContact CD2-CE2 3.54Å; F481-F502 HydrophobicContact CD2-CE2 3.54Å; F481-F502 HydrophobicContact CD2-CG 4.48Å; F481-F502 AromaticContact CD2-CZ 3.22Å; F481-F502 HydrophobicContact CD2-CZ 3.22Å; F481-F502 HydrophobicContact CE1-CE1 4.36Å; F481-F502 HydrophobicContact CE1-CZ 4.3Å; F481-F502 AromaticContact CE2-CE1 3.96Å; F481-F502 HydrophobicContact CE2-CE1 3.96Å; F481-F502 AromaticContact CE2-CE2 3.7Å; F481-F502 HydrophobicContact CE2-CE2 3.7Å; F481-F502 AromaticContact CE2-CZ 3.24Å; F481-F502 HydrophobicContact CE2-CZ 3.24Å; F481-F502 HydrophobicContact CG-CD1 4.13Å; F481-F502 AromaticContact CG-CE1 3.62Å; F481-F502 HydrophobicContact CG-CE1 3.62Å; F481-F502 HydrophobicContact CG-CE2 4.37Å; F481-F502 AromaticContact CG-CZ 3.77Å; F481-F502 HydrophobicContact CG-CZ 3.77Å; F481-F502 HydrophobicContact CZ-CE1 4.35Å; F481-F502 AromaticContact CZ-CZ 3.83Å; F481-F502 HydrophobicContact CZ-CZ 3.83Å; F481-F502 PolarHBondContact N-O 3.48Å; F481-F502 PolarHBondContact O-N 2.97Å; F481-V523 HydrophobicContact CE1-CG1 4.27Å; F481-V523 HydrophobicContact CE2-CG1 4.36Å; F481-V523 HydrophobicContact CZ-CG1 3.73Å; F481-L527 HydrophobicContact CE2-CD2 3.62Å; F481-L527 HydrophobicContact CE2-CG 4.15Å; F481-L527 HydrophobicContact CZ-CD1 4.5Å; F481-L527 HydrophobicContact CZ-CD2 3.75Å; F481-L527 HydrophobicContact CZ-CG 3.88Å; F481-L538 HydrophobicContact CB-CD1 4.38Å; F481-L538 HydrophobicContact CD1-CD1 3.5Å; F481-L538 HydrophobicContact CD2-CD1 3.4Å; F481-L538 VanDerWaalsContact CD2-CD1 3.4Å; F481-L538 HydrophobicContact CE1-CD1 3.42Å; F481-L538 VanDerWaalsContact CE1-CD1 3.42Å; F481-L538 HydrophobicContact CE1-CD2 4.37Å; F481-L538 HydrophobicContact CE1-CG 4.49Å; F481-L538 HydrophobicContact CE2-CD1 3.35Å; F481-L538 HydrophobicContact CG-CD1 3.47Å; F481-L538 VanDerWaalsContact CG-CD1 3.47Å; F481-L538 HydrophobicContact CZ-CD1 3.34Å; F481-L538 HydrophobicContact CZ-CD2 4.28Å; F481-L538 HydrophobicContact CZ-CG 4.46Å
482	Q	94.9	Very high	89.4	Confident	80 Å²	80	57.5 Å²	57.5	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	102.6	178.5	-61.3	-178.3	0.4	0	0	109.7	E480 V484 G536 Q537 L539	E480-Q482 PolarHBondContact OE2-NE2 3.42Å; Q482-V484 PolarHBondContact O-N 3.43Å; Q482-G536 CarbonylContact O-C 3.6Å; Q482-G536 VanDerWaalsContact O-CA 3.31Å; Q482-G536 WeakPolarHBondContact O-CA 3.41Å; Q482-Q537 PolarHBondContact N-O 3.11Å; Q482-Q537 PolarHBondContact O-N 3.41Å; Q482-L539 VanDerWaalsContact NE2-CD1 3.28Å
483	D	94	Very high	89.4	Confident	103 Å²	103	65.6 Å²	65.6	55%	0.551	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.6	40.2	178.1	-165	33.9	0	0	0	113.8	S485 G499 L500 T501 G536	D483-S485 PolarHBondContact O-N 3.47Å; D483-G499 WeakPolarHBondContact OD1-CA 3.35Å; D483-L500 PolarHBondContact N-O 3.28Å; D483-T501 PolarHBondContact N-OG1 3.03Å; D483-G536 VanDerWaalsContact O-CA 3.24Å; D483-G536 WeakPolarHBondContact O-CA 3.23Å
484	V	94.6	Very high	89.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.4	-171	176.7	0	0	0	0	111	F481 Q482 G499 L500 L526 P533 G535 Q537	F481-V484 HydrophobicContact CB-CG2 4.1Å; F481-V484 HydrophobicContact CD1-CB 3.92Å; F481-V484 HydrophobicContact CD1-CG1 4.23Å; F481-V484 HydrophobicContact CD1-CG2 3.75Å; F481-V484 HydrophobicContact CG-CG2 4.31Å; Q482-V484 PolarHBondContact O-N 3.43Å; V484-G499 PolarHBondContact O-N 3.35Å; V484-L500 HydrophobicContact CB-CB 4.35Å; V484-L500 PolarHBondContact N-O 3.48Å; V484-L500 WeakPolarHBondContact O-CB 3.47Å; V484-L500 PolarHBondContact O-N 2.95Å; V484-L526 HydrophobicContact CG1-CD1 4.13Å; V484-P533 HydrophobicContact CG1-CB 3.71Å; V484-G535 WeakPolarHBondContact CA-O 3.43Å; V484-Q537 VanDerWaalsContact CG2-O 3.23Å; V484-Q537 WeakPolarHBondContact CG2-O 3.43Å
485	S	94.2	Very high	90.2	Very high	22 Å²	22	61.9 Å²	61.9	15%	0.154	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.1	173.7	-60	0	0	0	0	109.9	D483 L497 G499 T534 G535	D483-S485 PolarHBondContact O-N 3.47Å; S485-L497 VanDerWaalsContact CA-O 3.31Å; S485-L497 WeakPolarHBondContact CA-O 3.25Å; S485-G499 PolarHBondContact OG-N 3.49Å; S485-T534 PolarHBondContact O-N 3.48Å; S485-T534 PolarHBondContact O-OG1 3.49Å; S485-G535 PolarHBondContact N-O 3.3Å; S485-G535 PolarHBondContact O-N 3.44Å; S485-G535 VanDerWaalsContact O-N 3.12Å
486	F	94.1	Very high	90.6	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	139.5	-177.3	-178.5	-101.3	0	0	0	113.2	Y488 V496 L497 T522 L526 Y531 Q532 T534	F486-Y488 AromaticContact CE1-CD1 3.76Å; F486-Y488 HydrophobicContact CE1-CD1 3.76Å; F486-Y488 AromaticContact CE1-CD2 3.87Å; F486-Y488 HydrophobicContact CE1-CD2 3.87Å; F486-Y488 AromaticContact CE1-CE1 3.82Å; F486-Y488 HydrophobicContact CE1-CE1 3.82Å; F486-Y488 AromaticContact CE1-CE2 3.91Å; F486-Y488 HydrophobicContact CE1-CE2 3.91Å; F486-Y488 AromaticContact CE1-CG 3.78Å; F486-Y488 HydrophobicContact CE1-CG 3.78Å; F486-Y488 AromaticContact CE1-CZ 3.89Å; F486-Y488 AromaticContact CZ-CD1 3.97Å; F486-Y488 HydrophobicContact CZ-CD1 3.97Å; F486-Y488 HydrophobicContact CZ-CE1 4.21Å; F486-Y488 HydrophobicContact CZ-CG 4.26Å; F486-V496 PolarHBondContact O-N 3.49Å; F486-L497 HydrophobicContact CB-CB 4.1Å; F486-L497 HydrophobicContact CB-CD1 4.13Å; F486-L497 HydrophobicContact CB-CG 4.32Å; F486-L497 PolarHBondContact N-O 3.42Å; F486-L497 PolarHBondContact O-N 3.14Å; F486-T522 HydrophobicContact CD1-CG2 3.29Å; F486-T522 HydrophobicContact CE1-CG2 3.59Å; F486-T522 HydrophobicContact CG-CG2 4.23Å; F486-L526 HydrophobicContact CB-CD1 4.14Å; F486-L526 HydrophobicContact CD2-CD2 3.83Å; F486-L526 HydrophobicContact CE2-CD2 4.1Å; F486-L526 HydrophobicContact CG-CD1 4.3Å; F486-L526 HydrophobicContact CG-CD2 4.22Å; F486-Y531 HydrophobicContact CE2-CG 4.21Å; F486-Y531 HydrophobicContact CZ-CD1 4.14Å; F486-Y531 HydrophobicContact CZ-CD2 4.29Å; F486-Y531 AromaticContact CZ-CG 3.74Å; F486-Y531 HydrophobicContact CZ-CG 3.74Å; F486-Q532 VanDerWaalsContact CD2-O 3.26Å; F486-Q532 WeakPolarHBondContact CD2-O 3.04Å; F486-Q532 VanDerWaalsContact CE2-O 3.27Å; F486-Q532 WeakPolarHBondContact CE2-O 3.37Å; F486-T534 VanDerWaalsContact CA-OG1 3.24Å; F486-T534 WeakPolarHBondContact CA-OG1 3.38Å; F486-T534 PolarHBondContact N-OG1 3.13Å
487	A	91.9	Very high	91	Very high	10 Å²	10	54.5 Å²	54.5	8%	0.083	28%	0.282	C	S	.	.			trans	-133.7	139.6	169.4	0	0	0	0	0	109.9	V494	A487-V494 WeakPolarHBondContact CB-O 3.39Å
488	Y	90.1	Very high	91.3	Very high	53 Å²	53	59 Å²	59	21%	0.208	30%	0.303	C	S	.	.			trans	-70.5	145.7	179.5	-76.2	-83.5	0	0	0	111.7	L253 F486 N490 Q491 V496 T522 Y531	L253-Y488 HydrophobicContact CD1-CD1 4.02Å; F486-Y488 AromaticContact CE1-CD1 3.76Å; F486-Y488 HydrophobicContact CE1-CD1 3.76Å; F486-Y488 AromaticContact CE1-CD2 3.87Å; F486-Y488 HydrophobicContact CE1-CD2 3.87Å; F486-Y488 AromaticContact CE1-CE1 3.82Å; F486-Y488 HydrophobicContact CE1-CE1 3.82Å; F486-Y488 AromaticContact CE1-CE2 3.91Å; F486-Y488 HydrophobicContact CE1-CE2 3.91Å; F486-Y488 AromaticContact CE1-CG 3.78Å; F486-Y488 HydrophobicContact CE1-CG 3.78Å; F486-Y488 AromaticContact CE1-CZ 3.89Å; F486-Y488 AromaticContact CZ-CD1 3.97Å; F486-Y488 HydrophobicContact CZ-CD1 3.97Å; F486-Y488 HydrophobicContact CZ-CE1 4.21Å; F486-Y488 HydrophobicContact CZ-CG 4.26Å; Y488-N490 WeakPolarHBondContact CB-OD1 3.4Å; Y488-N490 PolarHBondContact O-N 3.45Å; Y488-N490 VanDerWaalsContact O-N 3.08Å; Y488-Q491 CarbonylContact O-C 3.42Å; Y488-Q491 PolarHBondContact O-N 2.96Å; Y488-V496 HydrophobicContact CD2-CG2 3.82Å; Y488-V496 HydrophobicContact CE2-CG1 4.48Å; Y488-V496 HydrophobicContact CE2-CG2 4.02Å; Y488-T522 HydrophobicContact CE2-CG2 4.13Å; Y488-T522 PolarHBondContact OH-OG1 3.36Å; Y488-Y531 HydrophobicContact CD1-CE1 4.44Å; Y488-Y531 HydrophobicContact CE1-CD2 4.28Å; Y488-Y531 AromaticContact CE1-CE2 3.91Å; Y488-Y531 HydrophobicContact CE1-CE2 3.91Å
489	P	84.7	Confident	91.2	Very high	53 Å²	53	58.4 Å²	58.4	34%	0.344	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.1	-178.3	-26	34.8	0	0	0	115.6	K254	K254-P489 WeakPolarHBondContact CE-O 3.4Å; K254-P489 PolarHBondContact NZ-O 3.29Å
490	N	84.4	Confident	91.1	Very high	83 Å²	83	58.4 Å²	58.4	44%	0.444	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-23	175.3	62.7	-10.4	0	0	0	112.4	Y488	Y488-N490 WeakPolarHBondContact CB-OD1 3.4Å; Y488-N490 PolarHBondContact O-N 3.45Å; Y488-N490 VanDerWaalsContact O-N 3.08Å
491	Q	86.4	Confident	91.1	Very high	114 Å²	114	59.8 Å²	59.8	53%	0.533	32%	0.319	S	S	.	.			trans	-139.7	66	-178.8	-63.9	-175	5.5	0	0	110.8	Y488 K493 V494	Y488-Q491 CarbonylContact O-C 3.42Å; Y488-Q491 PolarHBondContact O-N 2.96Å; Q491-K493 PolarHBondContact O-N 2.86Å; Q491-V494 PolarHBondContact O-N 2.94Å; Q491-V494 VanDerWaalsContact O-N 3.11Å
492	P	84.9	Confident	91	Very high	97 Å²	97	60.1 Å²	60.1	63%	0.63	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18	-173	26.9	-36	0	0	0	114
493	K	87.5	Confident	91	Very high	205 Å²	205	59 Å²	59	89%	0.891	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-20	179	-65.1	-174.8	178.5	-177.9	0	113.4	Q491	Q491-K493 PolarHBondContact O-N 2.86Å
494	V	88.9	Confident	91	Very high	80 Å²	80	54 Å²	54	49%	0.485	29%	0.292	S	S	.	.	S	Bend	trans	-102.5	106.9	-176.9	-177.1	0	0	0	0	108.2	A487 Q491 V496	A487-V494 WeakPolarHBondContact CB-O 3.39Å; Q491-V494 PolarHBondContact O-N 2.94Å; Q491-V494 VanDerWaalsContact O-N 3.11Å; V494-V496 PolarHBondContact O-N 3.3Å
495	Q	89.3	Confident	90.9	Very high	105 Å²	105	58.5 Å²	58.5	49%	0.491	31%	0.313	S	S	.	.			trans	-77.3	117.4	174.1	-71.4	-174.5	-13.1	0	0	109.8	Q498	Q495-Q498 HydrophobicContact CB-CG 4.1Å
496	V	92.6	Very high	90.8	Very high	37 Å²	37	60.2 Å²	60.2	22%	0.224	32%	0.323	C	S	.	.	S	Bend	trans	-84.3	-35.3	177.9	178.8	0	0	0	0	111	F486 Y488 V494 T522 G694	F486-V496 PolarHBondContact O-N 3.49Å; Y488-V496 HydrophobicContact CD2-CG2 3.82Å; Y488-V496 HydrophobicContact CE2-CG1 4.48Å; Y488-V496 HydrophobicContact CE2-CG2 4.02Å; V494-V496 PolarHBondContact O-N 3.3Å; V496-T522 HydrophobicContact CG1-CG2 4.3Å; V496-G694 WeakPolarHBondContact O-CA 3.35Å
497	L	93.3	Very high	90.5	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.6	174	-58.6	177.5	0	0	0	109.4	S485 F486 L500 T522 V523 L526 G694	S485-L497 VanDerWaalsContact CA-O 3.31Å; S485-L497 WeakPolarHBondContact CA-O 3.25Å; F486-L497 HydrophobicContact CB-CB 4.1Å; F486-L497 HydrophobicContact CB-CD1 4.13Å; F486-L497 HydrophobicContact CB-CG 4.32Å; F486-L497 PolarHBondContact N-O 3.42Å; F486-L497 PolarHBondContact O-N 3.14Å; L497-L500 HydrophobicContact CD1-CD2 4.21Å; L497-L500 HydrophobicContact CD2-CD2 4.23Å; L497-T522 HydrophobicContact CD1-CG2 3.92Å; L497-T522 HydrophobicContact CG-CG2 4.17Å; L497-V523 HydrophobicContact CD1-CG2 4.23Å; L497-V523 HydrophobicContact CD2-CG2 4.25Å; L497-L526 HydrophobicContact CD1-CD1 3.48Å; L497-L526 VanDerWaalsContact CD1-CD1 3.48Å; L497-G694 WeakPolarHBondContact CA-O 3.34Å
498	Q	92.9	Very high	90.5	Very high	98 Å²	98	61.6 Å²	61.6	46%	0.458	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	104.1	-173.4	-60.4	179.8	20.8	0	0	109.2	Q495 L500 G694	Q495-Q498 HydrophobicContact CB-CG 4.1Å; Q498-L500 VanDerWaalsContact C-N 3.33Å; Q498-L500 PolarHBondContact O-N 3Å; Q498-G694 PolarHBondContact N-O 3.19Å
499	G	90.7	Very high	90.6	Very high	30 Å²	30	59.1 Å²	59.1	31%	0.309	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.9	37.2	174.7	0	0	0	0	0	115.6	D483 V484 S485 T501	D483-G499 WeakPolarHBondContact OD1-CA 3.35Å; V484-G499 PolarHBondContact O-N 3.35Å; S485-G499 PolarHBondContact OG-N 3.49Å; G499-T501 PolarHBondContact O-N 3.36Å; G499-T501 PolarHBondContact O-OG1 3.38Å
500	L	93.1	Very high	91.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	121	-173.3	-163.1	74.3	0	0	0	111.4	F481 D483 V484 L497 Q498 F502 V523 L691 V696	F481-L500 HydrophobicContact CD1-CD2 4.07Å; F481-L500 HydrophobicContact CE1-CD2 4.3Å; D483-L500 PolarHBondContact N-O 3.28Å; V484-L500 HydrophobicContact CB-CB 4.35Å; V484-L500 PolarHBondContact N-O 3.48Å; V484-L500 WeakPolarHBondContact O-CB 3.47Å; V484-L500 PolarHBondContact O-N 2.95Å; L497-L500 HydrophobicContact CD1-CD2 4.21Å; L497-L500 HydrophobicContact CD2-CD2 4.23Å; Q498-L500 VanDerWaalsContact C-N 3.33Å; Q498-L500 PolarHBondContact O-N 3Å; L500-F502 HydrophobicContact CD2-CD1 4.29Å; L500-F502 HydrophobicContact CD2-CE1 3.59Å; L500-F502 HydrophobicContact CG-CD1 3.99Å; L500-F502 HydrophobicContact CG-CE1 3.8Å; L500-V523 HydrophobicContact CD2-CG2 3.68Å; L500-L691 HydrophobicContact CD1-CD2 3.6Å; L500-V696 HydrophobicContact CD1-CG2 3.49Å; L500-V696 VanDerWaalsContact CD1-CG2 3.49Å; L500-V696 HydrophobicContact CG-CG2 4.27Å
501	T	94.3	Very high	91.6	Very high	79 Å²	79	52.7 Å²	52.7	49%	0.485	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	117.1	-178.3	-56.7	0	0	0	0	110.9	F481 D483 G499	F481-T501 VanDerWaalsContact O-CA 3.29Å; F481-T501 WeakPolarHBondContact O-CA 3.22Å; F481-T501 WeakPolarHBondContact O-CG2 3.3Å; D483-T501 PolarHBondContact N-OG1 3.03Å; G499-T501 PolarHBondContact O-N 3.36Å; G499-T501 PolarHBondContact O-OG1 3.38Å
502	F	94.6	Very high	92	Very high	9 Å²	9	47.3 Å²	47.3	4%	0.039	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	167.4	173.8	65.8	-89.7	0	0	0	110.9	F481 L500 L504 V523 L689 V696	F481-F502 HydrophobicContact CB-CD1 4.06Å; F481-F502 HydrophobicContact CB-CE1 4.05Å; F481-F502 AromaticContact CD1-CE1 3.99Å; F481-F502 HydrophobicContact CD1-CE1 3.99Å; F481-F502 HydrophobicContact CD1-CZ 4.25Å; F481-F502 HydrophobicContact CD2-CD1 4.22Å; F481-F502 HydrophobicContact CD2-CD2 4.17Å; F481-F502 AromaticContact CD2-CE1 3.6Å; F481-F502 HydrophobicContact CD2-CE1 3.6Å; F481-F502 AromaticContact CD2-CE2 3.54Å; F481-F502 HydrophobicContact CD2-CE2 3.54Å; F481-F502 HydrophobicContact CD2-CG 4.48Å; F481-F502 AromaticContact CD2-CZ 3.22Å; F481-F502 HydrophobicContact CD2-CZ 3.22Å; F481-F502 HydrophobicContact CE1-CE1 4.36Å; F481-F502 HydrophobicContact CE1-CZ 4.3Å; F481-F502 AromaticContact CE2-CE1 3.96Å; F481-F502 HydrophobicContact CE2-CE1 3.96Å; F481-F502 AromaticContact CE2-CE2 3.7Å; F481-F502 HydrophobicContact CE2-CE2 3.7Å; F481-F502 AromaticContact CE2-CZ 3.24Å; F481-F502 HydrophobicContact CE2-CZ 3.24Å; F481-F502 HydrophobicContact CG-CD1 4.13Å; F481-F502 AromaticContact CG-CE1 3.62Å; F481-F502 HydrophobicContact CG-CE1 3.62Å; F481-F502 HydrophobicContact CG-CE2 4.37Å; F481-F502 AromaticContact CG-CZ 3.77Å; F481-F502 HydrophobicContact CG-CZ 3.77Å; F481-F502 HydrophobicContact CZ-CE1 4.35Å; F481-F502 AromaticContact CZ-CZ 3.83Å; F481-F502 HydrophobicContact CZ-CZ 3.83Å; F481-F502 PolarHBondContact N-O 3.48Å; F481-F502 PolarHBondContact O-N 2.97Å; L500-F502 HydrophobicContact CD2-CD1 4.29Å; L500-F502 HydrophobicContact CD2-CE1 3.59Å; L500-F502 HydrophobicContact CG-CD1 3.99Å; L500-F502 HydrophobicContact CG-CE1 3.8Å; F502-L504 HydrophobicContact CD2-CD2 3.97Å; F502-L504 HydrophobicContact CD2-CG 4.21Å; F502-L504 HydrophobicContact CE2-CD1 4.26Å; F502-L504 HydrophobicContact CE2-CD2 3.72Å; F502-L504 HydrophobicContact CE2-CG 3.8Å; F502-V523 HydrophobicContact CZ-CG1 3.93Å; F502-L689 HydrophobicContact CB-CD1 4.16Å; F502-L689 HydrophobicContact CB-CD2 4.14Å; F502-L689 HydrophobicContact CD1-CD1 4.3Å; F502-L689 HydrophobicContact CD2-CD1 3.43Å; F502-L689 VanDerWaalsContact CD2-CD1 3.43Å; F502-L689 HydrophobicContact CE2-CD1 3.81Å; F502-L689 HydrophobicContact CG-CD1 3.71Å; F502-L689 HydrophobicContact CZ-CD1 4.38Å; F502-V696 HydrophobicContact CD1-CG2 4.13Å
503	T	94.6	Very high	92.3	Very high	56 Å²	56	43 Å²	43	34%	0.344	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134	-179.5	54.5	0	0	0	0	111.5	V479 E480 H505	V479-T503 CarbonylContact O-C 3.51Å; V479-T503 VanDerWaalsContact O-CA 3.29Å; V479-T503 WeakPolarHBondContact O-CA 3.43Å; E480-T503 HydrophobicContact CB-CG2 4.25Å; E480-T503 HydrophobicContact CG-CG2 4Å; T503-H505 PolarHBondContact OG1-NE2 3.4Å
504	L	94.4	Very high	92.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.9	172.1	-53.4	176	0	0	0	109.3	V479 F502 T510 L527 L639 T671 L673 L689	V479-L504 HydrophobicContact CB-CB 3.97Å; V479-L504 HydrophobicContact CB-CD1 4.11Å; V479-L504 HydrophobicContact CB-CG 4.22Å; V479-L504 HydrophobicContact CG1-CD1 4.4Å; V479-L504 HydrophobicContact CG2-CB 4.33Å; V479-L504 HydrophobicContact CG2-CD1 4.25Å; V479-L504 PolarHBondContact N-O 3.47Å; V479-L504 VanDerWaalsContact N-O 3.08Å; V479-L504 PolarHBondContact O-N 3.31Å; F502-L504 HydrophobicContact CD2-CD2 3.97Å; F502-L504 HydrophobicContact CD2-CG 4.21Å; F502-L504 HydrophobicContact CE2-CD1 4.26Å; F502-L504 HydrophobicContact CE2-CD2 3.72Å; F502-L504 HydrophobicContact CE2-CG 3.8Å; L504-T510 HydrophobicContact CD2-CG2 3.65Å; L504-L527 HydrophobicContact CD1-CD1 4.36Å; L504-L639 HydrophobicContact CD1-CD1 4.47Å; L504-T671 HydrophobicContact CB-CG2 3.65Å; L504-L673 HydrophobicContact CD1-CB 4.3Å; L504-L673 HydrophobicContact CD1-CD1 4.39Å; L504-L673 HydrophobicContact CD2-CD1 4.16Å; L504-L689 HydrophobicContact CD2-CD1 4.48Å
505	H	92.5	Very high	92.3	Very high	94 Å²	94	33.3 Å²	33.3	44%	0.435	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-95.4	144.5	-175.9	-66.9	-71.3	0	0	0	112.6	T503 T508	T503-H505 PolarHBondContact OG1-NE2 3.4Å; H505-T508 HydrophobicContact CB-CG2 3.94Å; H505-T508 PolarHBondContact O-N 2.85Å; H505-T508 PolarHBondContact O-OG1 2.87Å
506	P	91.6	Very high	92.2	Very high	57 Å²	57	34.6 Å²	34.6	37%	0.37	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	140.7	175.7	27.2	-34.9	0	0	0	112.4	K476 T508 T671	K476-P506 VanDerWaalsContact O-CB 3.26Å; K476-P506 WeakPolarHBondContact O-CB 3.28Å; P506-T508 PolarHBondContact O-N 3.08Å; P506-T671 VanDerWaalsContact CA-OG1 3.32Å; P506-T671 WeakPolarHBondContact CA-OG1 3.3Å
507	G	88.4	Confident	91.7	Very high	9 Å²	9	36.5 Å²	36.5	9%	0.093	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	-0.5	-178	0	0	0	0	0	114.5	R667 R670	G507-R667 WeakPolarHBondContact CA-O 3.5Å; G507-R667 PolarHBondContact O-NH1 3.14Å; G507-R670 VanDerWaalsContact CA-O 3.24Å; G507-R670 WeakPolarHBondContact CA-O 3.21Å; G507-R670 PolarHBondContact N-O 3.39Å; G507-R670 VanDerWaalsContact N-O 3.1Å
508	T	91.3	Very high	91.5	Very high	35 Å²	35	36.7 Å²	36.7	22%	0.215	23%	0.233	C	C	.	.			trans	-104.7	144.2	-178.8	71.2	0	0	0	0	111.9	H505 P506 V672	H505-T508 HydrophobicContact CB-CG2 3.94Å; H505-T508 PolarHBondContact O-N 2.85Å; H505-T508 PolarHBondContact O-OG1 2.87Å; P506-T508 PolarHBondContact O-N 3.08Å; T508-V672 PolarHBondContact O-N 2.97Å; T508-V672 VanDerWaalsContact O-N 3.13Å
509	V	93.3	Very high	91.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	113.4	170.2	-177.4	0	0	0	0	107.7	Y662 V672 L674 H686 H687	V509-Y662 HydrophobicContact CB-CE1 3.88Å; V509-Y662 HydrophobicContact CG1-CE1 3.87Å; V509-Y662 HydrophobicContact CG2-CD1 4.2Å; V509-Y662 HydrophobicContact CG2-CE1 3.95Å; V509-V672 HydrophobicContact CB-CB 4.44Å; V509-V672 HydrophobicContact CG1-CB 4.32Å; V509-V672 HydrophobicContact CG1-CG1 4.17Å; V509-V672 HydrophobicContact CG2-CB 4.13Å; V509-V672 HydrophobicContact CG2-CG2 4.41Å; V509-L674 HydrophobicContact CG1-CB 4.48Å; V509-H686 PolarHBondContact N-ND1 2.88Å; V509-H686 PolarHBondContact O-N 3.31Å; V509-H687 PolarHBondContact O-N 3.06Å
510	T	94.7	Very high	91.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.9	176.8	-56.8	0	0	0	0	109.5	L504 V672 L673 L674 H687 L689	L504-T510 HydrophobicContact CD2-CG2 3.65Å; T510-V672 PolarHBondContact N-O 3.35Å; T510-L673 HydrophobicContact CG2-CD1 4.46Å; T510-L674 PolarHBondContact O-N 3.18Å; T510-H687 CarbonylContact C-O 3.57Å; T510-H687 VanDerWaalsContact CA-O 3.26Å; T510-H687 WeakPolarHBondContact CA-O 3.37Å; T510-H687 HydrophobicContact CG2-CB 4.28Å; T510-L689 HydrophobicContact CG2-CD1 3.66Å; T510-L689 HydrophobicContact CG2-CG 3.87Å
511	A	94.6	Very high	91.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.9	174.2	0	0	0	0	0	111	V513 L674 A682 A685 H687 I688 L689	A511-V513 HydrophobicContact CB-CG2 4.32Å; A511-L674 CarbonylContact C-O 3.49Å; A511-L674 VanDerWaalsContact CA-O 3.23Å; A511-L674 WeakPolarHBondContact CA-O 3.41Å; A511-A682 HydrophobicContact CB-CB 4.35Å; A511-A685 HydrophobicContact CB-CB 3.48Å; A511-A685 VanDerWaalsContact CB-CB 3.48Å; A511-H687 PolarHBondContact N-O 3.33Å; A511-I688 HydrophobicContact CB-CG1 4.37Å; A511-I688 CarbonylContact O-C 3.55Å; A511-I688 WeakPolarHBondContact O-CA 3.19Å; A511-L689 PolarHBondContact O-N 3Å
512	L	94.1	Very high	91.2	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	109.5	178.3	-168.3	66.9	0	0	0	109.3	K520 V523 L673 L674 I675 L689 L691	L512-K520 HydrophobicContact CD2-CB 4.2Å; L512-K520 HydrophobicContact CD2-CG 4.42Å; L512-K520 HydrophobicContact CG-CG 4.43Å; L512-V523 HydrophobicContact CD2-CB 4.07Å; L512-V523 HydrophobicContact CD2-CG1 4.14Å; L512-V523 HydrophobicContact CD2-CG2 4.28Å; L512-L673 HydrophobicContact CB-CD1 4.03Å; L512-L674 PolarHBondContact N-O 2.92Å; L512-I675 HydrophobicContact CB-CG1 3.98Å; L512-I675 HydrophobicContact CD2-CD1 4.34Å; L512-I675 HydrophobicContact CD2-CG1 3.93Å; L512-I675 HydrophobicContact CG-CG1 4.46Å; L512-L689 HydrophobicContact CD1-CB 3.53Å; L512-L689 HydrophobicContact CD1-CD1 4.1Å; L512-L689 HydrophobicContact CD1-CG 4.47Å; L512-L691 HydrophobicContact CD1-CD1 3.32Å; L512-L691 HydrophobicContact CD1-CG 4.04Å; L512-L691 HydrophobicContact CD2-CD1 3.55Å; L512-L691 HydrophobicContact CG-CD1 3.49Å; L512-L691 VanDerWaalsContact CG-CD1 3.49Å
513	V	92.2	Very high	91.1	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.4	-171.1	-156.1	0	0	0	0	110.6	A511 A682 I688 L689 F690 L691 M715	A511-V513 HydrophobicContact CB-CG2 4.32Å; V513-A682 HydrophobicContact CG2-CB 4.12Å; V513-I688 HydrophobicContact CG2-CG2 4.21Å; V513-L689 PolarHBondContact N-O 2.77Å; V513-F690 CarbonylContact O-C 3.58Å; V513-F690 WeakPolarHBondContact O-CA 3.38Å; V513-L691 PolarHBondContact O-N 2.98Å; V513-M715 HydrophobicContact CB-CE 4.15Å; V513-M715 HydrophobicContact CG1-CE 3.32Å; V513-M715 HydrophobicContact CG1-SD 3.54Å; V513-M715 VanDerWaalsContact CG1-SD 3.54Å
514	G	90.1	Very high	91.1	Very high	9 Å²	9	28.2 Å²	28.2	9%	0.093	19%	0.185	C	C	.	.			trans	158.2	171.3	178.1	0	0	0	0	0	112.2	K520	G514-K520 PolarHBondContact O-NZ 3.24Å
515	P	86.6	Confident	90.9	Very high	72 Å²	72	28.8 Å²	28.8	47%	0.468	19%	0.189	S	C	.	.			trans	-62.7	161.1	-177.9	25.6	-33.9	0	0	0	112.9	G517 S518 K520 L691	P515-G517 PolarHBondContact O-N 3.01Å; P515-S518 VanDerWaalsContact O-CB 3.29Å; P515-S518 WeakPolarHBondContact O-CB 3.33Å; P515-S518 PolarHBondContact O-N 3.3Å; P515-S518 PolarHBondContact O-OG 2.76Å; P515-K520 PolarHBondContact O-NZ 3.35Å; P515-L691 WeakPolarHBondContact CD-O 3.26Å
516	N	85.9	Confident	90.9	Very high	131 Å²	131	24.4 Å²	24.4	70%	0.701	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	139.9	173.7	-69.2	-19.5	0	0	0	110.4	S518 Q677	N516-S518 VanDerWaalsContact C-N 3.33Å; N516-S518 PolarHBondContact O-N 3.44Å; N516-Q677 PolarHBondContact OD1-NE2 2.65Å
517	G	83.4	Confident	91	Very high	78 Å²	78	21.7 Å²	21.7	80%	0.804	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	1.8	-175.9	0	0	0	0	0	115.8	P515 G519	P515-G517 PolarHBondContact O-N 3.01Å; G517-G519 PolarHBondContact O-N 2.88Å
518	S	87.9	Confident	91.1	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	-73.2	-0.7	178.6	68	0	0	0	0	115.8	P515 N516 K520 L691 G694	P515-S518 VanDerWaalsContact O-CB 3.29Å; P515-S518 WeakPolarHBondContact O-CB 3.33Å; P515-S518 PolarHBondContact O-N 3.3Å; P515-S518 PolarHBondContact O-OG 2.76Å; N516-S518 VanDerWaalsContact C-N 3.33Å; N516-S518 PolarHBondContact O-N 3.44Å; S518-K520 WeakPolarHBondContact OG-CG 3.41Å; S518-K520 PolarHBondContact OG-NZ 2.92Å; S518-L691 WeakPolarHBondContact CB-O 3.42Å; S518-G694 PolarHBondContact O-N 2.96Å
519	G	89.6	Confident	91.1	Very high	5 Å²	5	22.9 Å²	22.9	5%	0.052	15%	0.153	C	C	.	.	S	Bend	trans	95.2	9.6	178.1	0	0	0	0	0	116.1	G517 S521 T522 V523	G517-G519 PolarHBondContact O-N 2.88Å; G519-S521 PolarHBondContact O-N 3.41Å; G519-T522 WeakPolarHBondContact O-CA 3.37Å; G519-T522 WeakPolarHBondContact O-CB 3.36Å; G519-T522 PolarHBondContact O-N 3.47Å; G519-T522 VanDerWaalsContact O-N 3.08Å; G519-V523 PolarHBondContact O-N 3.3Å
520	K	91.7	Very high	90.9	Very high	19 Å²	19	25.8 Å²	25.8	8%	0.083	17%	0.168	C	C	.	.	H	α-helix	trans	-56.1	-53.3	-177.6	-56.2	-178.9	-62.1	-80	0	113.5	L512 G514 P515 S518 T522 V523 A524 I675 L691	L512-K520 HydrophobicContact CD2-CB 4.2Å; L512-K520 HydrophobicContact CD2-CG 4.42Å; L512-K520 HydrophobicContact CG-CG 4.43Å; G514-K520 PolarHBondContact O-NZ 3.24Å; P515-K520 PolarHBondContact O-NZ 3.35Å; S518-K520 WeakPolarHBondContact OG-CG 3.41Å; S518-K520 PolarHBondContact OG-NZ 2.92Å; K520-T522 PolarHBondContact O-N 2.85Å; K520-V523 WeakPolarHBondContact O-CB 3.24Å; K520-V523 PolarHBondContact O-N 2.85Å; K520-V523 VanDerWaalsContact O-N 3.11Å; K520-A524 PolarHBondContact O-N 2.94Å; K520-I675 HydrophobicContact CB-CD1 4.32Å; K520-I675 HydrophobicContact CB-CG1 4.49Å; K520-I675 HydrophobicContact CB-CG2 3.73Å; K520-I675 HydrophobicContact CD-CG2 3.89Å; K520-I675 HydrophobicContact CG-CG2 4.35Å; K520-I675 WeakPolarHBondContact O-CD1 3.37Å; K520-L691 HydrophobicContact CG-CD1 3.98Å
521	S	90.4	Very high	90.7	Very high	57 Å²	57	27.3 Å²	27.3	40%	0.399	17%	0.174	S	C	.	.	H	α-helix	trans	-65.7	-25.5	177.3	-51.4	0	0	0	0	112.4	G519 A524 A525 D643	G519-S521 PolarHBondContact O-N 3.41Å; S521-A524 PolarHBondContact O-N 3.1Å; S521-A525 WeakPolarHBondContact O-CB 3.42Å; S521-A525 PolarHBondContact O-N 2.75Å; S521-D643 VanDerWaalsContact CB-OD2 3.29Å; S521-D643 WeakPolarHBondContact CB-OD2 3.49Å; S521-D643 PolarHBondContact OG-OD2 2.98Å
522	T	92.8	Very high	90.4	Very high	9 Å²	9	30.9 Å²	30.9	6%	0.055	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-40.1	173.1	-49	0	0	0	0	111.4	F486 Y488 V496 L497 G519 K520 A524 A525 L526	F486-T522 HydrophobicContact CD1-CG2 3.29Å; F486-T522 HydrophobicContact CE1-CG2 3.59Å; F486-T522 HydrophobicContact CG-CG2 4.23Å; Y488-T522 HydrophobicContact CE2-CG2 4.13Å; Y488-T522 PolarHBondContact OH-OG1 3.36Å; V496-T522 HydrophobicContact CG1-CG2 4.3Å; L497-T522 HydrophobicContact CD1-CG2 3.92Å; L497-T522 HydrophobicContact CG-CG2 4.17Å; G519-T522 WeakPolarHBondContact O-CA 3.37Å; G519-T522 WeakPolarHBondContact O-CB 3.36Å; G519-T522 PolarHBondContact O-N 3.47Å; G519-T522 VanDerWaalsContact O-N 3.08Å; K520-T522 PolarHBondContact O-N 2.85Å; T522-A524 VanDerWaalsContact C-N 3.35Å; T522-A524 PolarHBondContact O-N 3.14Å; T522-A525 PolarHBondContact O-N 3.03Å; T522-L526 WeakPolarHBondContact O-CG 3.49Å; T522-L526 PolarHBondContact O-N 2.98Å
523	V	93.7	Very high	90.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-46.8	172.1	176.5	0	0	0	0	110.6	F481 L497 L500 F502 L512 G519 K520 A525 L526 L527 L673 L691	F481-V523 HydrophobicContact CE1-CG1 4.27Å; F481-V523 HydrophobicContact CE2-CG1 4.36Å; F481-V523 HydrophobicContact CZ-CG1 3.73Å; L497-V523 HydrophobicContact CD1-CG2 4.23Å; L497-V523 HydrophobicContact CD2-CG2 4.25Å; L500-V523 HydrophobicContact CD2-CG2 3.68Å; F502-V523 HydrophobicContact CZ-CG1 3.93Å; L512-V523 HydrophobicContact CD2-CB 4.07Å; L512-V523 HydrophobicContact CD2-CG1 4.14Å; L512-V523 HydrophobicContact CD2-CG2 4.28Å; G519-V523 PolarHBondContact O-N 3.3Å; K520-V523 WeakPolarHBondContact O-CB 3.24Å; K520-V523 PolarHBondContact O-N 2.85Å; K520-V523 VanDerWaalsContact O-N 3.11Å; V523-A525 VanDerWaalsContact C-N 3.3Å; V523-A525 PolarHBondContact O-N 2.99Å; V523-L526 PolarHBondContact O-N 3.41Å; V523-L527 HydrophobicContact CG1-CD1 4.25Å; V523-L527 WeakPolarHBondContact O-CG 3.28Å; V523-L527 PolarHBondContact O-N 3.33Å; V523-L673 HydrophobicContact CG1-CD2 4.2Å; V523-L691 HydrophobicContact CG2-CD1 4.29Å
524	A	93.1	Very high	90.1	Very high	5 Å²	5	36.5 Å²	36.5	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-38.7	175.9	0	0	0	0	0	112.7	K520 S521 T522 Q528 I641 I675	K520-A524 PolarHBondContact O-N 2.94Å; S521-A524 PolarHBondContact O-N 3.1Å; T522-A524 VanDerWaalsContact C-N 3.35Å; T522-A524 PolarHBondContact O-N 3.14Å; A524-Q528 WeakPolarHBondContact O-CG 3.26Å; A524-Q528 PolarHBondContact O-N 3.08Å; A524-Q528 PolarHBondContact O-NE2 3.42Å; A524-I641 HydrophobicContact CB-CG2 3.73Å; A524-I675 HydrophobicContact CB-CD1 3.84Å
525	A	92.1	Very high	90.1	Very high	11 Å²	11	37.3 Å²	37.3	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-70.4	-36.8	178.7	0	0	0	0	0	113	S521 T522 V523 Q528 N529 L530 Y531	S521-A525 WeakPolarHBondContact O-CB 3.42Å; S521-A525 PolarHBondContact O-N 2.75Å; T522-A525 PolarHBondContact O-N 3.03Å; V523-A525 VanDerWaalsContact C-N 3.3Å; V523-A525 PolarHBondContact O-N 2.99Å; A525-Q528 PolarHBondContact O-N 3.44Å; A525-N529 PolarHBondContact O-N 3.2Å; A525-L530 HydrophobicContact CB-CD1 4.45Å; A525-L530 WeakPolarHBondContact O-CB 3.27Å; A525-L530 PolarHBondContact O-N 3.07Å; A525-Y531 HydrophobicContact CB-CD2 3.83Å; A525-Y531 HydrophobicContact CB-CE2 4.03Å
526	L	92.6	Very high	90.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-68.2	-39.7	175	-70.9	176.8	0	0	0	112.1	V484 F486 L497 T522 V523 Q528 N529 Y531 L538	V484-L526 HydrophobicContact CG1-CD1 4.13Å; F486-L526 HydrophobicContact CB-CD1 4.14Å; F486-L526 HydrophobicContact CD2-CD2 3.83Å; F486-L526 HydrophobicContact CE2-CD2 4.1Å; F486-L526 HydrophobicContact CG-CD1 4.3Å; F486-L526 HydrophobicContact CG-CD2 4.22Å; L497-L526 HydrophobicContact CD1-CD1 3.48Å; L497-L526 VanDerWaalsContact CD1-CD1 3.48Å; T522-L526 WeakPolarHBondContact O-CG 3.49Å; T522-L526 PolarHBondContact O-N 2.98Å; V523-L526 PolarHBondContact O-N 3.41Å; L526-Q528 VanDerWaalsContact C-N 3.26Å; L526-Q528 PolarHBondContact O-N 3.36Å; L526-N529 WeakPolarHBondContact O-CA 3.1Å; L526-N529 PolarHBondContact O-N 3.16Å; L526-Y531 VanDerWaalsContact CD2-O 3.32Å; L526-Y531 WeakPolarHBondContact CD2-O 3.28Å; L526-L538 HydrophobicContact CB-CD2 4.14Å; L526-L538 WeakPolarHBondContact O-CD2 3.38Å
527	L	92.8	Very high	90.7	Very high	1 Å²	1	33 Å²	33	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-33.2	176	-75.1	174.8	0	0	0	113.6	V479 F481 L504 V523 N529 L538 L545 L639 I641 L673	V479-L527 HydrophobicContact CG1-CD2 3.52Å; F481-L527 HydrophobicContact CE2-CD2 3.62Å; F481-L527 HydrophobicContact CE2-CG 4.15Å; F481-L527 HydrophobicContact CZ-CD1 4.5Å; F481-L527 HydrophobicContact CZ-CD2 3.75Å; F481-L527 HydrophobicContact CZ-CG 3.88Å; L504-L527 HydrophobicContact CD1-CD1 4.36Å; V523-L527 HydrophobicContact CG1-CD1 4.25Å; V523-L527 WeakPolarHBondContact O-CG 3.28Å; V523-L527 PolarHBondContact O-N 3.33Å; L527-N529 PolarHBondContact O-N 2.94Å; L527-L538 HydrophobicContact CD2-CD1 4.48Å; L527-L545 WeakPolarHBondContact O-CD2 3.49Å; L527-L639 HydrophobicContact CD2-CD2 4.38Å; L527-I641 HydrophobicContact CB-CD1 3.57Å; L527-I641 HydrophobicContact CD1-CD1 3.93Å; L527-I641 HydrophobicContact CD1-CG1 4.35Å; L527-I641 HydrophobicContact CG-CD1 4.4Å; L527-L673 HydrophobicContact CD1-CD2 3.34Å
528	Q	91.1	Very high	91.2	Very high	41 Å²	41	29.8 Å²	29.8	19%	0.192	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	0.9	173.3	-71	172.5	79.4	0	0	112.6	A524 A525 L526 L530 H554 V557 A559 I641	A524-Q528 WeakPolarHBondContact O-CG 3.26Å; A524-Q528 PolarHBondContact O-N 3.08Å; A524-Q528 PolarHBondContact O-NE2 3.42Å; A525-Q528 PolarHBondContact O-N 3.44Å; L526-Q528 VanDerWaalsContact C-N 3.26Å; L526-Q528 PolarHBondContact O-N 3.36Å; Q528-L530 HydrophobicContact CB-CD1 4.14Å; Q528-L530 HydrophobicContact CB-CD2 4.42Å; Q528-L530 HydrophobicContact CB-CG 3.73Å; Q528-L530 PolarHBondContact O-N 3.46Å; Q528-L530 VanDerWaalsContact O-N 3.14Å; Q528-H554 PolarHBondContact O-CE1 3.49Å; Q528-H554 PolarHBondContact O-NE2 3.38Å; Q528-V557 HydrophobicContact CG-CG1 4.38Å; Q528-A559 HydrophobicContact CG-CB 3.92Å; Q528-I641 HydrophobicContact CG-CD1 4.13Å
529	N	90.8	Very high	91.5	Very high	27 Å²	27	30.3 Å²	30.3	14%	0.144	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	31.4	-172.6	-164.8	35	0	0	0	112.7	A525 L526 L527 Y531 L545 L553	A525-N529 PolarHBondContact O-N 3.2Å; L526-N529 WeakPolarHBondContact O-CA 3.1Å; L526-N529 PolarHBondContact O-N 3.16Å; L527-N529 PolarHBondContact O-N 2.94Å; N529-Y531 VanDerWaalsContact C-N 3.3Å; N529-L545 HydrophobicContact CB-CD2 4.21Å; N529-L553 HydrophobicContact CB-CD2 3.53Å
530	L	89.1	Confident	91.7	Very high	61 Å²	61	30.3 Å²	30.3	32%	0.319	18%	0.18	S	C	.	.	S	Bend	trans	-72.9	-30.9	173.8	-61.8	178.8	0	0	0	110.6	T249 A525 Q528	T249-L530 HydrophobicContact CG2-CB 4.24Å; T249-L530 HydrophobicContact CG2-CD2 4.15Å; T249-L530 PolarHBondContact OG1-O 3.38Å; A525-L530 HydrophobicContact CB-CD1 4.45Å; A525-L530 WeakPolarHBondContact O-CB 3.27Å; A525-L530 PolarHBondContact O-N 3.07Å; Q528-L530 HydrophobicContact CB-CD1 4.14Å; Q528-L530 HydrophobicContact CB-CD2 4.42Å; Q528-L530 HydrophobicContact CB-CG 3.73Å; Q528-L530 PolarHBondContact O-N 3.46Å; Q528-L530 VanDerWaalsContact O-N 3.14Å
531	Y	89.4	Confident	91.6	Very high	34 Å²	34	31.5 Å²	31.5	13%	0.133	19%	0.188	C	C	.	.	S	Bend	trans	-130.5	155.4	172.1	-55.8	-79.9	0	0	0	109.7	T249 L253 F486 Y488 A525 L526 N529	T249-Y531 VanDerWaalsContact OG1-CE1 3.26Å; T249-Y531 WeakPolarHBondContact OG1-CE1 3.26Å; L253-Y531 HydrophobicContact CD1-CE1 3.93Å; L253-Y531 WeakPolarHBondContact CD1-OH 3.38Å; F486-Y531 HydrophobicContact CE2-CG 4.21Å; F486-Y531 HydrophobicContact CZ-CD1 4.14Å; F486-Y531 HydrophobicContact CZ-CD2 4.29Å; F486-Y531 AromaticContact CZ-CG 3.74Å; F486-Y531 HydrophobicContact CZ-CG 3.74Å; Y488-Y531 HydrophobicContact CD1-CE1 4.44Å; Y488-Y531 HydrophobicContact CE1-CD2 4.28Å; Y488-Y531 AromaticContact CE1-CE2 3.91Å; Y488-Y531 HydrophobicContact CE1-CE2 3.91Å; A525-Y531 HydrophobicContact CB-CD2 3.83Å; A525-Y531 HydrophobicContact CB-CE2 4.03Å; L526-Y531 VanDerWaalsContact CD2-O 3.32Å; L526-Y531 WeakPolarHBondContact CD2-O 3.28Å; N529-Y531 VanDerWaalsContact C-N 3.3Å
532	Q	88.1	Confident	91.6	Very high	74 Å²	74	30.9 Å²	30.9	35%	0.346	19%	0.19	S	C	.	.			trans	-97.4	143.7	172.1	-68.5	-173.7	-15.5	0	0	110.5	S464 F486 V546	S464-Q532 PolarHBondContact OG-NE2 3.05Å; F486-Q532 VanDerWaalsContact CD2-O 3.26Å; F486-Q532 WeakPolarHBondContact CD2-O 3.04Å; F486-Q532 VanDerWaalsContact CE2-O 3.27Å; F486-Q532 WeakPolarHBondContact CE2-O 3.37Å; Q532-V546 HydrophobicContact CG-CG2 4.13Å; Q532-V546 VanDerWaalsContact NE2-CG1 3.33Å
533	P	91.1	Very high	91.6	Very high	38 Å²	38	34.5 Å²	34.5	25%	0.247	21%	0.207	C	C	.	.			trans	-62.9	143	174.3	29.4	-35.3	0	0	0	110.6	V484	V484-P533 HydrophobicContact CG1-CB 3.71Å
534	T	90.1	Very high	91.4	Very high	89 Å²	89	40.3 Å²	40.3	55%	0.546	23%	0.228	S	C	.	.	S	Bend	trans	-80.3	-22.8	175.9	47.8	0	0	0	0	112.3	S485 F486	S485-T534 PolarHBondContact O-N 3.48Å; S485-T534 PolarHBondContact O-OG1 3.49Å; F486-T534 VanDerWaalsContact CA-OG1 3.24Å; F486-T534 WeakPolarHBondContact CA-OG1 3.38Å; F486-T534 PolarHBondContact N-OG1 3.13Å
535	G	90.4	Very high	91.2	Very high	27 Å²	27	40.3 Å²	40.3	28%	0.278	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	162.6	173.4	0	0	0	0	0	111.2	V484 S485	V484-G535 WeakPolarHBondContact CA-O 3.43Å; S485-G535 PolarHBondContact N-O 3.3Å; S485-G535 PolarHBondContact O-N 3.44Å; S485-G535 VanDerWaalsContact O-N 3.12Å
536	G	92.3	Very high	90.9	Very high	39 Å²	39	42.2 Å²	42.2	40%	0.402	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	75.8	-166.3	-175	0	0	0	0	0	113.7	Q482 D483	Q482-G536 CarbonylContact O-C 3.6Å; Q482-G536 VanDerWaalsContact O-CA 3.31Å; Q482-G536 WeakPolarHBondContact O-CA 3.41Å; D483-G536 VanDerWaalsContact O-CA 3.24Å; D483-G536 WeakPolarHBondContact O-CA 3.23Å
537	Q	92.7	Very high	90.8	Very high	72 Å²	72	45.8 Å²	45.8	34%	0.336	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140.9	-179	-60.2	-176.1	42.9	0	0	111.4	Q482 V484 L539 R544	Q482-Q537 PolarHBondContact N-O 3.11Å; Q482-Q537 PolarHBondContact O-N 3.41Å; V484-Q537 VanDerWaalsContact CG2-O 3.23Å; V484-Q537 WeakPolarHBondContact CG2-O 3.43Å; Q537-L539 HydrophobicContact CB-CD2 4.47Å; Q537-R544 VanDerWaalsContact NE2-NH2 3.14Å
538	L	93.7	Very high	90.6	Very high	11 Å²	11	46 Å²	46	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	115.2	175.1	-173	64.2	0	0	0	108.8	V479 F481 L526 L527 L545	V479-L538 HydrophobicContact CG1-CD1 4.37Å; F481-L538 HydrophobicContact CB-CD1 4.38Å; F481-L538 HydrophobicContact CD1-CD1 3.5Å; F481-L538 HydrophobicContact CD2-CD1 3.4Å; F481-L538 VanDerWaalsContact CD2-CD1 3.4Å; F481-L538 HydrophobicContact CE1-CD1 3.42Å; F481-L538 VanDerWaalsContact CE1-CD1 3.42Å; F481-L538 HydrophobicContact CE1-CD2 4.37Å; F481-L538 HydrophobicContact CE1-CG 4.49Å; F481-L538 HydrophobicContact CE2-CD1 3.35Å; F481-L538 HydrophobicContact CG-CD1 3.47Å; F481-L538 VanDerWaalsContact CG-CD1 3.47Å; F481-L538 HydrophobicContact CZ-CD1 3.34Å; F481-L538 HydrophobicContact CZ-CD2 4.28Å; F481-L538 HydrophobicContact CZ-CG 4.46Å; L526-L538 HydrophobicContact CB-CD2 4.14Å; L526-L538 WeakPolarHBondContact O-CD2 3.38Å; L527-L538 HydrophobicContact CD2-CD1 4.48Å; L538-L545 HydrophobicContact CB-CD1 4.21Å; L538-L545 HydrophobicContact CD1-CD1 4.43Å; L538-L545 HydrophobicContact CD2-CD1 3.52Å; L538-L545 HydrophobicContact CG-CD1 3.38Å; L538-L545 PolarHBondContact O-N 3.21Å; L538-L545 VanDerWaalsContact O-N 3.17Å
539	L	94	Very high	90.6	Very high	15 Å²	15	46 Å²	46	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.9	-173.7	-51.9	177.4	0	0	0	111.1	V479 E480 Q482 Q537 Q543 R544	V479-L539 WeakPolarHBondContact CA-O 3.36Å; E480-L539 HydrophobicContact CB-CB 4.29Å; E480-L539 PolarHBondContact N-O 3.03Å; E480-L539 PolarHBondContact O-N 3.24Å; Q482-L539 VanDerWaalsContact NE2-CD1 3.28Å; Q537-L539 HydrophobicContact CB-CD2 4.47Å; L539-Q543 CarbonylContact C-O 3.51Å; L539-Q543 VanDerWaalsContact CA-O 3.23Å; L539-Q543 WeakPolarHBondContact CA-O 3.43Å; L539-R544 HydrophobicContact CD2-CB 4.33Å; L539-R544 HydrophobicContact CD2-CG 3.6Å
540	L	92.8	Very high	90.4	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.7	168.3	-175.6	67.8	0	0	0	106.8	M475 L478 V479 G542 Q543 L545 Y548 L553	M475-L540 HydrophobicContact CE-CD2 3.58Å; M475-L540 HydrophobicContact CE-CG 4.22Å; M475-L540 HydrophobicContact SD-CD2 4.16Å; M475-L540 HydrophobicContact SD-CG 4.36Å; L478-L540 CarbonylContact O-C 3.34Å; L478-L540 WeakPolarHBondContact O-CA 3.48Å; V479-L540 HydrophobicContact CG2-CD1 3.75Å; L540-G542 PolarHBondContact O-N 3.15Å; L540-G542 VanDerWaalsContact O-N 3.09Å; L540-Q543 PolarHBondContact N-O 3.24Å; L540-Q543 PolarHBondContact O-N 2.78Å; L540-L545 HydrophobicContact CB-CD1 4.28Å; L540-L545 HydrophobicContact CB-CG 4.24Å; L540-Y548 HydrophobicContact CB-CE2 4.04Å; L540-Y548 HydrophobicContact CD2-CE2 4.4Å; L540-Y548 PolarHBondContact O-OH 3.08Å; L540-L553 HydrophobicContact CD2-CD1 3.9Å
541	D	91.5	Very high	90.4	Very high	44 Å²	44	50.6 Å²	50.6	24%	0.235	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	36	-174.5	-67.7	-26.3	0	0	0	113.9	M475 K476 G477 L478 Q543	M475-D541 WeakPolarHBondContact CA-OD2 3.18Å; M475-D541 VanDerWaalsContact CB-OD2 3.28Å; M475-D541 WeakPolarHBondContact CB-OD2 3.46Å; K476-D541 PolarHBondContact N-OD2 3.34Å; G477-D541 PolarHBondContact N-OD1 3.24Å; G477-D541 PolarHBondContact N-OD2 3.31Å; G477-D541 VanDerWaalsContact N-OD2 3.16Å; L478-D541 WeakPolarHBondContact CB-OD1 3.45Å; L478-D541 PolarHBondContact N-OD1 3.21Å; L478-D541 PolarHBondContact O-N 3.42Å; D541-Q543 VanDerWaalsContact C-N 3.34Å; D541-Q543 PolarHBondContact O-N 3.15Å
542	G	89.8	Confident	90.4	Very high	44 Å²	44	50.8 Å²	50.8	45%	0.454	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-1.2	179.9	0	0	0	0	0	115.7	L540	L540-G542 PolarHBondContact O-N 3.15Å; L540-G542 VanDerWaalsContact O-N 3.09Å
543	Q	91.7	Very high	90.5	Very high	86 Å²	86	47.3 Å²	47.3	40%	0.402	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.7	176.1	-62.3	-65.8	-26.3	0	0	111	L539 L540 D541 Q547 Y548	L539-Q543 CarbonylContact C-O 3.51Å; L539-Q543 VanDerWaalsContact CA-O 3.23Å; L539-Q543 WeakPolarHBondContact CA-O 3.43Å; L540-Q543 PolarHBondContact N-O 3.24Å; L540-Q543 PolarHBondContact O-N 2.78Å; D541-Q543 VanDerWaalsContact C-N 3.34Å; D541-Q543 PolarHBondContact O-N 3.15Å; Q543-Q547 VanDerWaalsContact OE1-OE1 3.13Å; Q543-Y548 HydrophobicContact CB-CE2 3.75Å
544	R	91.3	Very high	90.5	Very high	121 Å²	121	47.2 Å²	47.2	46%	0.457	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.7	179.8	-68.2	178.9	-179.9	171.7	2.7	110.5	Q537 L539 V546 Q547 Y548	Q537-R544 VanDerWaalsContact NE2-NH2 3.14Å; L539-R544 HydrophobicContact CD2-CB 4.33Å; L539-R544 HydrophobicContact CD2-CG 3.6Å; R544-V546 PolarHBondContact O-N 3.36Å; R544-V546 VanDerWaalsContact O-N 3.08Å; R544-Q547 HydrophobicContact CB-CG 4.21Å; R544-Q547 WeakPolarHBondContact O-CB 3.45Å; R544-Q547 PolarHBondContact O-N 3.11Å; R544-Y548 WeakPolarHBondContact O-CD2 3.49Å
545	L	88.4	Confident	90.4	Very high	6 Å²	6	46 Å²	46	3%	0.031	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-55.5	-32.5	179.9	-98.2	124.8	0	0	0	114.2	L527 N529 L538 L540 Q547 Y548 L553	L527-L545 WeakPolarHBondContact O-CD2 3.49Å; N529-L545 HydrophobicContact CB-CD2 4.21Å; L538-L545 HydrophobicContact CB-CD1 4.21Å; L538-L545 HydrophobicContact CD1-CD1 4.43Å; L538-L545 HydrophobicContact CD2-CD1 3.52Å; L538-L545 HydrophobicContact CG-CD1 3.38Å; L538-L545 PolarHBondContact O-N 3.21Å; L538-L545 VanDerWaalsContact O-N 3.17Å; L540-L545 HydrophobicContact CB-CD1 4.28Å; L540-L545 HydrophobicContact CB-CG 4.24Å; L545-Q547 PolarHBondContact O-N 2.9Å; L545-Y548 PolarHBondContact O-N 2.82Å; L545-L553 HydrophobicContact CD2-CD1 3.64Å; L545-L553 HydrophobicContact CD2-CD2 3.71Å; L545-L553 HydrophobicContact CD2-CG 4.3Å
546	V	86.3	Confident	90.4	Very high	51 Å²	51	46.5 Å²	46.5	31%	0.309	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.8	-23.5	178	-176.2	0	0	0	0	113	Q532 R544	Q532-V546 HydrophobicContact CG-CG2 4.13Å; Q532-V546 VanDerWaalsContact NE2-CG1 3.33Å; R544-V546 PolarHBondContact O-N 3.36Å; R544-V546 VanDerWaalsContact O-N 3.08Å
547	Q	89.3	Confident	90.4	Very high	77 Å²	77	44.8 Å²	44.8	36%	0.36	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-81.6	-18.2	-177.8	-65	171	-26.8	0	0	113	G468 S469 L470 Q543 R544 L545	G468-Q547 CarbonylContact C-O 3.58Å; G468-Q547 WeakPolarHBondContact CA-O 3.47Å; S469-Q547 PolarHBondContact N-O 2.95Å; S469-Q547 VanDerWaalsContact N-O 3.1Å; L470-Q547 WeakPolarHBondContact CB-O 3.36Å; L470-Q547 HydrophobicContact CD1-CB 3.81Å; L470-Q547 PolarHBondContact N-O 2.93Å; Q543-Q547 VanDerWaalsContact OE1-OE1 3.13Å; R544-Q547 HydrophobicContact CB-CG 4.21Å; R544-Q547 WeakPolarHBondContact O-CB 3.45Å; R544-Q547 PolarHBondContact O-N 3.11Å; L545-Q547 PolarHBondContact O-N 2.9Å
548	Y	89.7	Confident	90.5	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.016	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-72.6	147.8	179.1	-73.8	-93.3	0	0	0	111.5	G468 L470 P472 M475 L540 Q543 R544 L545 Y552	G468-Y548 PolarHBondContact N-O 2.88Å; L470-Y548 HydrophobicContact CB-CD1 4.24Å; L470-Y548 HydrophobicContact CB-CG 4.43Å; L470-Y548 WeakPolarHBondContact O-CA 3.3Å; P472-Y548 HydrophobicContact CG-CE1 3.88Å; M475-Y548 HydrophobicContact CE-CE1 4.34Å; M475-Y548 HydrophobicContact SD-CE1 3.57Å; M475-Y548 VanDerWaalsContact SD-CE1 3.57Å; L540-Y548 HydrophobicContact CB-CE2 4.04Å; L540-Y548 HydrophobicContact CD2-CE2 4.4Å; L540-Y548 PolarHBondContact O-OH 3.08Å; Q543-Y548 HydrophobicContact CB-CE2 3.75Å; R544-Y548 WeakPolarHBondContact O-CD2 3.49Å; L545-Y548 PolarHBondContact O-N 2.82Å; Y548-Y552 AromaticContact CD1-CD1 4Å; Y548-Y552 HydrophobicContact CD1-CD1 4Å; Y548-Y552 HydrophobicContact CD1-CE1 4.05Å; Y548-Y552 HydrophobicContact CE1-CE1 4.25Å
549	D	90	Very high	90.4	Very high	42 Å²	42	42.8 Å²	42.8	23%	0.225	22%	0.223	C	C	.	.			trans	-65.8	134.5	165.5	174.2	65.5	0	0	0	110	S467 G468 L470 H551 Y552 L553	S467-D549 WeakPolarHBondContact CB-OD1 3.39Å; S467-D549 PolarHBondContact OG-OD1 3.17Å; G468-D549 WeakPolarHBondContact O-CA 3.19Å; L470-D549 PolarHBondContact O-N 2.7Å; D549-H551 PolarHBondContact O-N 3.15Å; D549-H551 WeakPolarHBondContact OD2-CB 3.02Å; D549-H551 PolarHBondContact OD2-N 3.3Å; D549-Y552 PolarHBondContact O-N 3.26Å; D549-Y552 PolarHBondContact OD2-N 3.48Å; D549-L553 WeakPolarHBondContact O-CB 3.32Å; D549-L553 PolarHBondContact O-N 3.15Å
550	H	87.5	Confident	90.4	Very high	57 Å²	57	42.2 Å²	42.2	26%	0.264	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-44.8	-177.7	-177.2	76.5	0	0	0	113	L466 S467 Y552 L553 H554	L466-H550 WeakPolarHBondContact O-CB 3.49Å; S467-H550 WeakPolarHBondContact OG-CB 2.85Å; S467-H550 PolarHBondContact OG-N 3.12Å; H550-Y552 VanDerWaalsContact C-N 3.35Å; H550-L553 PolarHBondContact O-N 3.37Å; H550-H554 AromaticContact CD2-CD2 3.91Å; H550-H554 AromaticContact CE1-CD2 3.15Å; H550-H554 PolarHBondContact CE1-CD2 3.34Å; H550-H554 AromaticContact CE1-NE2 3.03Å; H550-H554 PolarHBondContact CE1-NE2 3.47Å; H550-H554 AromaticContact CG-CD2 3.82Å; H550-H554 AromaticContact ND1-CD2 3.36Å; H550-H554 PolarHBondContact ND1-CD2 2.88Å; H550-H554 AromaticContact ND1-NE2 3.39Å; H550-H554 PolarHBondContact ND1-NE2 3.26Å; H550-H554 AromaticContact NE2-CD2 3.5Å; H550-H554 AromaticContact NE2-NE2 3.79Å; H550-H554 PolarHBondContact O-CD2 3.48Å; H550-H554 VanDerWaalsContact O-CD2 3.22Å; H550-H554 PolarHBondContact O-N 3.49Å
551	H	87.9	Confident	90.2	Very high	127 Å²	127	43.7 Å²	43.7	59%	0.588	24%	0.236	S	C	*	.	H	α-helix	trans	-66.6	-41.5	-179.9	-68.6	-69.7	0	0	0	110.9	D549 T555	D549-H551 PolarHBondContact O-N 3.15Å; D549-H551 WeakPolarHBondContact OD2-CB 3.02Å; D549-H551 PolarHBondContact OD2-N 3.3Å; H551-T555 PolarHBondContact O-N 3.31Å; H551-T555 PolarHBondContact O-OG1 3.48Å
552	Y	89.6	Confident	90	Very high	38 Å²	38	46.2 Å²	46.2	15%	0.149	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-51	173.5	179.7	-93.4	0	0	0	111.5	A471 P472 M475 Y548 D549 H550 H554 T555 Q556	A471-Y552 HydrophobicContact CB-CD1 4.46Å; A471-Y552 HydrophobicContact CB-CD2 3.77Å; A471-Y552 HydrophobicContact CB-CE2 4.36Å; A471-Y552 HydrophobicContact CB-CG 3.83Å; P472-Y552 HydrophobicContact CG-CE1 4.11Å; P472-Y552 VanDerWaalsContact O-CE2 3.3Å; P472-Y552 WeakPolarHBondContact O-CE2 3.45Å; P472-Y552 PolarHBondContact O-OH 3.48Å; M475-Y552 HydrophobicContact CE-CE1 3.95Å; M475-Y552 WeakPolarHBondContact CG-OH 3.42Å; M475-Y552 HydrophobicContact SD-CE1 4.29Å; Y548-Y552 AromaticContact CD1-CD1 4Å; Y548-Y552 HydrophobicContact CD1-CD1 4Å; Y548-Y552 HydrophobicContact CD1-CE1 4.05Å; Y548-Y552 HydrophobicContact CE1-CE1 4.25Å; D549-Y552 PolarHBondContact O-N 3.26Å; D549-Y552 PolarHBondContact OD2-N 3.48Å; H550-Y552 VanDerWaalsContact C-N 3.35Å; Y552-H554 PolarHBondContact O-N 2.94Å; Y552-T555 WeakPolarHBondContact O-CB 3.09Å; Y552-T555 PolarHBondContact O-N 3.1Å; Y552-Q556 HydrophobicContact CD1-CG 4.36Å; Y552-Q556 HydrophobicContact CE1-CG 3.83Å; Y552-Q556 HydrophobicContact CE2-CG 4.36Å; Y552-Q556 WeakPolarHBondContact O-CG 3.18Å; Y552-Q556 PolarHBondContact O-N 3.36Å
553	L	90.9	Very high	89.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-56.8	-47.6	-179.2	-178.9	68.5	0	0	0	112	N529 L540 L545 D549 H550 T555 Q556 V557	N529-L553 HydrophobicContact CB-CD2 3.53Å; L540-L553 HydrophobicContact CD2-CD1 3.9Å; L545-L553 HydrophobicContact CD2-CD1 3.64Å; L545-L553 HydrophobicContact CD2-CD2 3.71Å; L545-L553 HydrophobicContact CD2-CG 4.3Å; D549-L553 WeakPolarHBondContact O-CB 3.32Å; D549-L553 PolarHBondContact O-N 3.15Å; H550-L553 PolarHBondContact O-N 3.37Å; L553-T555 PolarHBondContact O-N 3.17Å; L553-Q556 CarbonylContact O-C 3.34Å; L553-Q556 PolarHBondContact O-N 3.47Å; L553-V557 HydrophobicContact CD1-CG2 3.71Å; L553-V557 HydrophobicContact CG-CG2 4.23Å; L553-V557 PolarHBondContact O-N 2.93Å
554	H	90.3	Very high	89.4	Confident	36 Å²	36	48.4 Å²	48.4	17%	0.167	25%	0.246	C	C	.	.	H	α-helix	trans	-75.8	-4.9	-179.9	-75	-69.9	0	0	0	114.9	Q528 H550 Y552 R635	Q528-H554 PolarHBondContact O-CE1 3.49Å; Q528-H554 PolarHBondContact O-NE2 3.38Å; H550-H554 AromaticContact CD2-CD2 3.91Å; H550-H554 AromaticContact CE1-CD2 3.15Å; H550-H554 PolarHBondContact CE1-CD2 3.34Å; H550-H554 AromaticContact CE1-NE2 3.03Å; H550-H554 PolarHBondContact CE1-NE2 3.47Å; H550-H554 AromaticContact CG-CD2 3.82Å; H550-H554 AromaticContact ND1-CD2 3.36Å; H550-H554 PolarHBondContact ND1-CD2 2.88Å; H550-H554 AromaticContact ND1-NE2 3.39Å; H550-H554 PolarHBondContact ND1-NE2 3.26Å; H550-H554 AromaticContact NE2-CD2 3.5Å; H550-H554 AromaticContact NE2-NE2 3.79Å; H550-H554 PolarHBondContact O-CD2 3.48Å; H550-H554 VanDerWaalsContact O-CD2 3.22Å; H550-H554 PolarHBondContact O-N 3.49Å; Y552-H554 PolarHBondContact O-N 2.94Å; H554-R635 PolarHBondContact O-NH1 3.33Å; H554-R635 VanDerWaalsContact O-NH1 3.16Å
555	T	88.8	Confident	89.2	Confident	64 Å²	64	48.3 Å²	48.3	39%	0.393	25%	0.254	S	S	.	.	H	α-helix	trans	-82.4	-35.8	164.5	-55.2	0	0	0	0	110.5	H551 Y552 L553	H551-T555 PolarHBondContact O-N 3.31Å; H551-T555 PolarHBondContact O-OG1 3.48Å; Y552-T555 WeakPolarHBondContact O-CB 3.09Å; Y552-T555 PolarHBondContact O-N 3.1Å; L553-T555 PolarHBondContact O-N 3.17Å
556	Q	90.8	Very high	89.3	Confident	38 Å²	38	48.3 Å²	48.3	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-87.3	-30.5	-178.1	-56.6	-57.6	-25.7	0	0	113.5	M475 Y552 L553 P637 L638 L639	M475-Q556 HydrophobicContact CE-CB 4.03Å; M475-Q556 HydrophobicContact CE-CG 3.95Å; Y552-Q556 HydrophobicContact CD1-CG 4.36Å; Y552-Q556 HydrophobicContact CE1-CG 3.83Å; Y552-Q556 HydrophobicContact CE2-CG 4.36Å; Y552-Q556 WeakPolarHBondContact O-CG 3.18Å; Y552-Q556 PolarHBondContact O-N 3.36Å; L553-Q556 CarbonylContact O-C 3.34Å; L553-Q556 PolarHBondContact O-N 3.47Å; Q556-P637 CarbonylContact O-C 3.57Å; Q556-P637 WeakPolarHBondContact O-CA 3.19Å; Q556-P637 WeakPolarHBondContact O-CB 3.33Å; Q556-L638 PolarHBondContact O-N 2.93Å; Q556-L638 VanDerWaalsContact OE1-CD1 3.24Å; Q556-L639 PolarHBondContact O-N 3.47Å
557	V	92.3	Very high	89.4	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.2	179.7	-175.2	0	0	0	0	109.2	Q528 L553 L639 I641	Q528-V557 HydrophobicContact CG-CG1 4.38Å; L553-V557 HydrophobicContact CD1-CG2 3.71Å; L553-V557 HydrophobicContact CG-CG2 4.23Å; L553-V557 PolarHBondContact O-N 2.93Å; V557-L639 WeakPolarHBondContact CA-O 3.34Å; V557-L639 HydrophobicContact CG1-CB 4.43Å; V557-L639 HydrophobicContact CG1-CD2 3.97Å; V557-L639 HydrophobicContact CG1-CG 4.27Å; V557-L639 HydrophobicContact CG2-CB 4.16Å; V557-L639 HydrophobicContact CG2-CD2 4.01Å; V557-I641 HydrophobicContact CG1-CD1 3.89Å
558	A	93	Very high	89.4	Confident	5 Å²	5	48.6 Å²	48.6	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.7	171.3	0	0	0	0	0	110.4	A632 P637 L639 L640 I641	A558-A632 HydrophobicContact CB-CB 3.85Å; A558-P637 HydrophobicContact CB-CB 3.69Å; A558-P637 HydrophobicContact CB-CG 3.67Å; A558-L639 PolarHBondContact N-O 2.93Å; A558-L640 HydrophobicContact CB-CD1 4.37Å; A558-L640 WeakPolarHBondContact O-CA 3.24Å; A558-I641 PolarHBondContact O-N 3.37Å
559	A	92.9	Very high	89.5	Confident	35 Å²	35	53.8 Å²	53.8	29%	0.289	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.5	176.8	0	0	0	0	0	111.1	Q528 I641	Q528-A559 HydrophobicContact CG-CB 3.92Å; A559-I641 CarbonylContact C-O 3.55Å; A559-I641 VanDerWaalsContact CA-O 3.27Å; A559-I641 WeakPolarHBondContact CA-O 3.43Å; A559-I641 HydrophobicContact CB-CB 3.97Å; A559-I641 HydrophobicContact CB-CD1 4.45Å; A559-I641 HydrophobicContact CB-CG2 4.49Å
560	V	93.4	Very high	89.7	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.018	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.5	167.8	-172.6	0	0	0	0	106.8	A628 L629 A632 I641 L642 D643 A645	V560-A628 HydrophobicContact CG1-CB 3.92Å; V560-L629 HydrophobicContact CG2-CD1 4.18Å; V560-A632 HydrophobicContact CG2-CB 3.75Å; V560-I641 PolarHBondContact N-O 3.29Å; V560-L642 HydrophobicContact CB-CD2 3.87Å; V560-L642 HydrophobicContact CG2-CD2 3.74Å; V560-D643 PolarHBondContact O-N 3.48Å; V560-A645 HydrophobicContact CB-CB 3.86Å; V560-A645 HydrophobicContact CG1-CB 3.54Å
561	G	89.5	Confident	90	Very high	35 Å²	35	49.7 Å²	49.7	36%	0.361	27%	0.266	S	S	.	.			trans	-77.4	166.6	178.5	0	0	0	0	0	112.6	E563 P564 D643	G561-E563 PolarHBondContact O-N 2.89Å; G561-P564 WeakPolarHBondContact O-CD 3.37Å; G561-D643 CarbonylContact C-O 3.47Å
562	Q	86.6	Confident	90.3	Very high	97 Å²	97	47.6 Å²	47.6	45%	0.453	25%	0.253	S	S	.	.	S	Bend	trans	-57.3	-47.3	180	-177.2	174.3	15.6	0	0	112.3	P564 Q625 D643 D644	Q562-P564 WeakPolarHBondContact O-CD 3.45Å; Q562-Q625 PolarHBondContact O-NE2 3.3Å; Q562-Q625 VanDerWaalsContact O-NE2 3.14Å; Q562-D643 WeakPolarHBondContact CA-O 3.43Å; Q562-D643 PolarHBondContact N-O 3.35Å; Q562-D644 HydrophobicContact CB-CB 4.45Å; Q562-D644 HydrophobicContact CG-CB 4.12Å
563	E	84.1	Confident	90.5	Very high	161 Å²	161	50.4 Å²	50.4	75%	0.752	27%	0.268	S	S	*	.	S	Bend	trans	-114.9	86.6	174.6	-66.3	-172.4	167	0	0	110.1	G561 L565	G561-E563 PolarHBondContact O-N 2.89Å; E563-L565 PolarHBondContact O-N 3.36Å
564	P	85.2	Confident	90.6	Very high	15 Å²	15	50.4 Å²	50.4	10%	0.097	27%	0.268	C	S	.	.			trans	-73	128.7	-176.9	25.3	-28.7	0	0	0	111.3	G561 Q562 R624 Q625 A628	G561-P564 WeakPolarHBondContact O-CD 3.37Å; Q562-P564 WeakPolarHBondContact O-CD 3.45Å; P564-R624 HydrophobicContact CG-CB 4.28Å; P564-Q625 HydrophobicContact CG-CB 4.44Å; P564-Q625 HydrophobicContact CG-CG 3.87Å; P564-A628 HydrophobicContact CB-CB 3.38Å; P564-A628 HydrophobicContact CG-CB 3.82Å
565	L	86.6	Confident	90.8	Very high	120 Å²	120	48.7 Å²	48.7	63%	0.628	26%	0.26	S	S	*	.			trans	-85.1	134.7	173.9	-61.8	171.5	0	0	0	110.6	E563 R631	E563-L565 PolarHBondContact O-N 3.36Å; L565-R631 PolarHBondContact O-NH1 3.23Å
566	L	89.8	Confident	91.1	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	25%	0.25	C	C	.	.			trans	-107.1	147.8	171.5	-53.5	-177.9	0	0	0	109.6	V612 T615 L619 R624 V627	L566-V612 HydrophobicContact CB-CG1 3.97Å; L566-V612 HydrophobicContact CD1-CG1 3.66Å; L566-V612 HydrophobicContact CG-CG1 4.49Å; L566-T615 CarbonylContact O-C 3.55Å; L566-T615 WeakPolarHBondContact O-CA 3.44Å; L566-L619 HydrophobicContact CD1-CD1 3.57Å; L566-R624 HydrophobicContact CD1-CB 4.32Å; L566-R624 HydrophobicContact CD1-CG 3.93Å; L566-R624 HydrophobicContact CG-CG 4.38Å; L566-V627 HydrophobicContact CD1-CB 4.28Å; L566-V627 HydrophobicContact CD1-CG1 4.32Å; L566-V627 HydrophobicContact CD2-CB 4.13Å; L566-V627 HydrophobicContact CD2-CG1 3.87Å
567	F	89.4	Confident	91.2	Very high	82 Å²	82	49 Å²	49	36%	0.36	26%	0.257	S	S	.	.			trans	-84.1	149.9	175.6	-64.4	-80.1	0	0	0	109.5	R569 N574 Y577	F567-R569 HydrophobicContact CB-CG 4.13Å; F567-R569 PolarHBondContact O-N 3.32Å; F567-N574 PolarHBondContact N-OD1 2.84Å; F567-N574 PolarHBondContact O-ND2 3.26Å; F567-N574 PolarHBondContact O-OD1 3.12Å; F567-Y577 AromaticContact CD2-CD2 3.93Å; F567-Y577 HydrophobicContact CD2-CD2 3.93Å; F567-Y577 AromaticContact CD2-CE2 3.92Å; F567-Y577 HydrophobicContact CD2-CE2 3.92Å; F567-Y577 HydrophobicContact CD2-CG 4.25Å; F567-Y577 AromaticContact CE2-CD1 3.88Å; F567-Y577 HydrophobicContact CE2-CD1 3.88Å; F567-Y577 AromaticContact CE2-CD2 3.84Å; F567-Y577 HydrophobicContact CE2-CD2 3.84Å; F567-Y577 AromaticContact CE2-CE1 3.57Å; F567-Y577 HydrophobicContact CE2-CE1 3.57Å; F567-Y577 AromaticContact CE2-CE2 3.51Å; F567-Y577 HydrophobicContact CE2-CE2 3.51Å; F567-Y577 HydrophobicContact CE2-CG 4Å; F567-Y577 AromaticContact CE2-CZ 3.36Å; F567-Y577 HydrophobicContact CZ-CE1 4.01Å; F567-Y577 AromaticContact CZ-CE2 3.9Å; F567-Y577 HydrophobicContact CZ-CE2 3.9Å; F567-Y577 AromaticContact CZ-CZ 3.53Å; F567-Y577 WeakPolarHBondContact CZ-OH 2.96Å
568	G	90	Very high	90.8	Very high	53 Å²	53	51.2 Å²	51.2	55%	0.546	28%	0.281	S	S	.	.	S	Bend	trans	-68.7	72.7	171.9	0	0	0	0	0	111.3	G613	G568-G613 WeakPolarHBondContact CA-O 3.34Å
569	R	91.6	Very high	90.6	Very high	112 Å²	112	53 Å²	53	42%	0.423	29%	0.289	S	S	.	.	S	Bend	trans	-146.5	172.6	-175.6	-65.1	-175.5	-174.6	-168.9	-0.2	108.6	F567 E573 N574 V612	F567-R569 HydrophobicContact CB-CG 4.13Å; F567-R569 PolarHBondContact O-N 3.32Å; R569-E573 HydrophobicContact CB-CB 3.92Å; R569-E573 WeakPolarHBondContact CB-OE2 3.38Å; R569-E573 WeakPolarHBondContact CD-OE2 3.49Å; R569-N574 PolarHBondContact O-ND2 2.88Å; R569-N574 VanDerWaalsContact O-ND2 3.14Å; R569-V612 WeakPolarHBondContact O-CG2 3.47Å; R569-V612 PolarHBondContact O-N 2.93Å
570	S	93.1	Very high	90.1	Very high	13 Å²	13	58.8 Å²	58.8	9%	0.091	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-62	160.4	173.6	66	0	0	0	0	112.6	R572 E573 N574 T610	S570-R572 VanDerWaalsContact C-N 3.26Å; S570-R572 PolarHBondContact O-N 2.79Å; S570-E573 PolarHBondContact O-N 3.34Å; S570-E573 WeakPolarHBondContact OG-CB 3.43Å; S570-E573 WeakPolarHBondContact OG-CG 3.07Å; S570-E573 PolarHBondContact OG-N 2.96Å; S570-N574 WeakPolarHBondContact O-CB 3.38Å; S570-N574 PolarHBondContact O-N 2.91Å; S570-N574 PolarHBondContact O-ND2 3.4Å; S570-T610 VanDerWaalsContact CA-O 3.27Å; S570-T610 WeakPolarHBondContact CA-O 3.23Å
571	F	94.2	Very high	89.9	Confident	1 Å²	1	64.2 Å²	64.2	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-57	-42.7	171.8	-73.9	-70.7	0	0	0	111.7	E573 N574 I575 F600 I601 F604 Y608 T610 V612 L619 V627	F571-E573 VanDerWaalsContact C-N 3.35Å; F571-E573 PolarHBondContact O-N 3.2Å; F571-N574 PolarHBondContact O-N 3.44Å; F571-I575 WeakPolarHBondContact O-CG1 3.04Å; F571-I575 PolarHBondContact O-N 3.41Å; F571-F600 AromaticContact CE1-CE2 3.88Å; F571-F600 HydrophobicContact CE1-CE2 3.88Å; F571-F600 HydrophobicContact CZ-CE2 4.02Å; F571-I601 HydrophobicContact CB-CD1 4.28Å; F571-I601 HydrophobicContact CB-CG2 4.35Å; F571-I601 HydrophobicContact CD1-CD1 4.03Å; F571-I601 HydrophobicContact CD1-CG1 3.95Å; F571-I601 HydrophobicContact CD2-CG1 4.27Å; F571-I601 HydrophobicContact CD2-CG2 4.06Å; F571-I601 HydrophobicContact CE1-CG1 4.1Å; F571-I601 HydrophobicContact CE2-CG1 4.41Å; F571-I601 HydrophobicContact CG-CD1 4.18Å; F571-I601 HydrophobicContact CG-CG1 4.03Å; F571-I601 HydrophobicContact CG-CG2 4.25Å; F571-I601 HydrophobicContact CZ-CG1 4.32Å; F571-F604 AromaticContact CE2-CD2 3.91Å; F571-F604 HydrophobicContact CE2-CD2 3.91Å; F571-F604 HydrophobicContact CE2-CE2 4.08Å; F571-F604 HydrophobicContact CE2-CG 4.3Å; F571-F604 HydrophobicContact CZ-CD2 4.2Å; F571-F604 AromaticContact CZ-CE2 3.91Å; F571-F604 HydrophobicContact CZ-CE2 3.91Å; F571-F604 HydrophobicContact CZ-CZ 4.36Å; F571-Y608 WeakPolarHBondContact CB-O 3.44Å; F571-Y608 PolarHBondContact N-O 3.45Å; F571-T610 HydrophobicContact CE2-CG2 4.27Å; F571-T610 PolarHBondContact N-O 3.15Å; F571-T610 VanDerWaalsContact N-O 3.16Å; F571-V612 HydrophobicContact CD1-CG2 3.6Å; F571-V612 HydrophobicContact CD2-CG2 4.28Å; F571-V612 HydrophobicContact CE1-CG2 3.64Å; F571-V612 HydrophobicContact CE2-CG2 4.32Å; F571-V612 HydrophobicContact CG-CG2 3.94Å; F571-V612 HydrophobicContact CZ-CG2 4.02Å; F571-L619 HydrophobicContact CE1-CD1 3.69Å; F571-L619 HydrophobicContact CE1-CD2 4.26Å; F571-L619 HydrophobicContact CZ-CD1 4.12Å; F571-L619 HydrophobicContact CZ-CD2 3.88Å; F571-V627 HydrophobicContact CD1-CG2 3.94Å; F571-V627 HydrophobicContact CE1-CG2 3.98Å
572	R	94.4	Very high	89.9	Confident	82 Å²	82	68.9 Å²	68.9	31%	0.309	36%	0.357	S	S	.	.	H	α-helix	trans	-52.9	-51.4	176	-173.7	-164.2	-63.1	-116.7	-0.1	111.6	S570 I575 A576 M585 I588 Y608 D609	S570-R572 VanDerWaalsContact C-N 3.26Å; S570-R572 PolarHBondContact O-N 2.79Å; R572-I575 PolarHBondContact O-N 2.99Å; R572-A576 WeakPolarHBondContact O-CB 3.44Å; R572-A576 PolarHBondContact O-N 2.73Å; R572-M585 HydrophobicContact CG-SD 4.15Å; R572-M585 VanDerWaalsContact NH1-CG 3.27Å; R572-M585 PolarHBondContact NH1-SD 3.26Å; R572-I588 HydrophobicContact CG-CD1 3.52Å; R572-Y608 PolarHBondContact N-O 3.48Å; R572-D609 IonicContact CZ-OD1 2.74Å; R572-D609 VanDerWaalsContact CZ-OD1 3.27Å; R572-D609 IonicContact NE-OD1 3.82Å; R572-D609 PolarHBondContact NE-OD1 2.88Å; R572-D609 IonicContact NH2-OD1 2.7Å; R572-D609 PolarHBondContact NH2-OD1 3.13Å; R572-D609 IonicContact NH2-OD2 3.59Å; R572-D609 PolarHBondContact NH2-OD2 2.98Å
573	E	93.4	Very high	90.1	Very high	98 Å²	98	65.3 Å²	65.3	46%	0.458	34%	0.342	S	S	.	.	H	α-helix	trans	-69.6	-33.7	-179.3	-73.7	177.8	-161.3	0	0	112.8	R569 S570 F571 Y577	R569-E573 HydrophobicContact CB-CB 3.92Å; R569-E573 WeakPolarHBondContact CB-OE2 3.38Å; R569-E573 WeakPolarHBondContact CD-OE2 3.49Å; S570-E573 PolarHBondContact O-N 3.34Å; S570-E573 WeakPolarHBondContact OG-CB 3.43Å; S570-E573 WeakPolarHBondContact OG-CG 3.07Å; S570-E573 PolarHBondContact OG-N 2.96Å; F571-E573 VanDerWaalsContact C-N 3.35Å; F571-E573 PolarHBondContact O-N 3.2Å; E573-Y577 PolarHBondContact O-N 3.39Å; E573-Y577 VanDerWaalsContact O-N 3.14Å
574	N	93.9	Very high	90.6	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-40.3	174.6	-91.7	-76	0	0	0	112.2	F567 R569 S570 F571 Y577 V627 R631	F567-N574 PolarHBondContact N-OD1 2.84Å; F567-N574 PolarHBondContact O-ND2 3.26Å; F567-N574 PolarHBondContact O-OD1 3.12Å; R569-N574 PolarHBondContact O-ND2 2.88Å; R569-N574 VanDerWaalsContact O-ND2 3.14Å; S570-N574 WeakPolarHBondContact O-CB 3.38Å; S570-N574 PolarHBondContact O-N 2.91Å; S570-N574 PolarHBondContact O-ND2 3.4Å; F571-N574 PolarHBondContact O-N 3.44Å; N574-Y577 WeakPolarHBondContact O-CB 3.4Å; N574-V627 HydrophobicContact CB-CG1 4.21Å; N574-R631 WeakPolarHBondContact O-CG 3.43Å; N574-R631 PolarHBondContact O-NE 2.79Å; N574-R631 PolarHBondContact OD1-NH2 3.41Å
575	I	94.9	Very high	91	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-70.5	-43.9	176.7	-65.2	168.7	0	0	0	109.9	F571 R572 Y577 I588 V591 A592 I601 Y608 V627 A630 I634	F571-I575 WeakPolarHBondContact O-CG1 3.04Å; F571-I575 PolarHBondContact O-N 3.41Å; R572-I575 PolarHBondContact O-N 2.99Å; I575-Y577 PolarHBondContact O-N 2.73Å; I575-Y577 VanDerWaalsContact O-N 3.17Å; I575-I588 HydrophobicContact CB-CG2 4.38Å; I575-I588 HydrophobicContact CD1-CG2 3.93Å; I575-I588 HydrophobicContact CG2-CG2 4.2Å; I575-V591 HydrophobicContact CG2-CG2 3.88Å; I575-A592 HydrophobicContact CD1-CB 4.38Å; I575-I601 HydrophobicContact CD1-CD1 4.24Å; I575-Y608 HydrophobicContact CD1-CD1 4.4Å; I575-Y608 HydrophobicContact CD1-CE1 4.13Å; I575-V627 HydrophobicContact CG1-CG1 4.17Å; I575-A630 HydrophobicContact CD1-CB 4.25Å; I575-A630 HydrophobicContact CG1-CB 4.06Å; I575-A630 HydrophobicContact CG2-CB 4.17Å; I575-I634 HydrophobicContact CG2-CD1 3.9Å; I575-I634 WeakPolarHBondContact O-CG2 3.39Å
576	A	93.7	Very high	91.4	Very high	22 Å²	22	64.6 Å²	64.6	18%	0.182	34%	0.34	C	S	.	.	S	Bend	trans	-74.3	0.9	-179.8	0	0	0	0	0	114.6	R572 G578 L579 P583	R572-A576 WeakPolarHBondContact O-CB 3.44Å; R572-A576 PolarHBondContact O-N 2.73Å; A576-G578 PolarHBondContact O-N 3.46Å; A576-L579 PolarHBondContact O-N 3.29Å; A576-P583 HydrophobicContact CB-CG 3.58Å
577	Y	92.5	Very high	91.6	Very high	86 Å²	86	66.9 Å²	66.9	34%	0.337	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	126.4	-172	-176.7	-96.8	0	0	0	113.1	F567 E573 N574 I575 R635	F567-Y577 AromaticContact CD2-CD2 3.93Å; F567-Y577 HydrophobicContact CD2-CD2 3.93Å; F567-Y577 AromaticContact CD2-CE2 3.92Å; F567-Y577 HydrophobicContact CD2-CE2 3.92Å; F567-Y577 HydrophobicContact CD2-CG 4.25Å; F567-Y577 AromaticContact CE2-CD1 3.88Å; F567-Y577 HydrophobicContact CE2-CD1 3.88Å; F567-Y577 AromaticContact CE2-CD2 3.84Å; F567-Y577 HydrophobicContact CE2-CD2 3.84Å; F567-Y577 AromaticContact CE2-CE1 3.57Å; F567-Y577 HydrophobicContact CE2-CE1 3.57Å; F567-Y577 AromaticContact CE2-CE2 3.51Å; F567-Y577 HydrophobicContact CE2-CE2 3.51Å; F567-Y577 HydrophobicContact CE2-CG 4Å; F567-Y577 AromaticContact CE2-CZ 3.36Å; F567-Y577 HydrophobicContact CZ-CE1 4.01Å; F567-Y577 AromaticContact CZ-CE2 3.9Å; F567-Y577 HydrophobicContact CZ-CE2 3.9Å; F567-Y577 AromaticContact CZ-CZ 3.53Å; F567-Y577 WeakPolarHBondContact CZ-OH 2.96Å; E573-Y577 PolarHBondContact O-N 3.39Å; E573-Y577 VanDerWaalsContact O-N 3.14Å; N574-Y577 WeakPolarHBondContact O-CB 3.4Å; I575-Y577 PolarHBondContact O-N 2.73Å; I575-Y577 VanDerWaalsContact O-N 3.17Å; Y577-R635 PolarHBondContact O-NH2 2.95Å
578	G	84.9	Confident	91.8	Very high	50 Å²	50	63 Å²	63	52%	0.515	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	11	177.3	0	0	0	0	0	115	A576	A576-G578 PolarHBondContact O-N 3.46Å
579	L	88.2	Confident	92.1	Very high	41 Å²	41	62.7 Å²	62.7	22%	0.215	32%	0.321	C	S	.	.			trans	-85	137.6	167.8	-67.2	170.4	0	0	0	110.6	A576 R581 P583 I634 R635	A576-L579 PolarHBondContact O-N 3.29Å; L579-R581 WeakPolarHBondContact CB-O 3.23Å; L579-R581 PolarHBondContact O-N 3.07Å; L579-P583 HydrophobicContact CD1-CB 4.14Å; L579-P583 HydrophobicContact CD1-CG 3.81Å; L579-I634 HydrophobicContact CD1-CD1 3.93Å; L579-I634 HydrophobicContact CD1-CG1 4.01Å; L579-I634 HydrophobicContact CD1-CG2 4Å; L579-I634 HydrophobicContact CG-CG2 4.47Å; L579-R635 HydrophobicContact CD2-CG 4.1Å
580	N	83.6	Confident	92.1	Very high	157 Å²	157	59.6 Å²	59.6	84%	0.84	32%	0.32	S	S	*	.	S	Bend	trans	-74.7	-11.9	173.9	-67.2	-19.9	0	0	0	113.2
581	R	88.6	Confident	92.1	Very high	118 Å²	118	59.7 Å²	59.7	45%	0.445	32%	0.319	S	S	.	.	S	Bend	trans	-120.6	153.4	178.4	69.5	-179.9	-177.4	89.8	-2.6	109.9	L579 P583 E587	L579-R581 WeakPolarHBondContact CB-O 3.23Å; L579-R581 PolarHBondContact O-N 3.07Å; R581-P583 VanDerWaalsContact O-CD 3.31Å; R581-P583 WeakPolarHBondContact O-CD 3.1Å; R581-E587 IonicContact CZ-OE1 3.32Å; R581-E587 IonicContact CZ-OE2 2.67Å; R581-E587 VanDerWaalsContact CZ-OE2 3.32Å; R581-E587 IonicContact NH1-OE1 2.7Å; R581-E587 PolarHBondContact NH1-OE1 3.32Å; R581-E587 IonicContact NH1-OE2 3.58Å; R581-E587 PolarHBondContact NH1-OE2 3.08Å; R581-E587 VanDerWaalsContact NH2-CD 3.29Å; R581-E587 IonicContact NH2-OE1 3.97Å; R581-E587 PolarHBondContact NH2-OE1 3Å; R581-E587 IonicContact NH2-OE2 2.71Å; R581-E587 PolarHBondContact NH2-OE2 2.93Å
582	T	89.1	Confident	92	Very high	133 Å²	133	59.6 Å²	59.6	82%	0.816	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-75.5	116.5	167.7	44.7	0	0	0	0	109.4
583	P	91.8	Very high	91.9	Very high	21 Å²	21	58.9 Å²	58.9	14%	0.136	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-71.4	151.1	176	28.6	-32.4	0	0	0	111.1	A576 L579 R581 E587 I588 I634	A576-P583 HydrophobicContact CB-CG 3.58Å; L579-P583 HydrophobicContact CD1-CB 4.14Å; L579-P583 HydrophobicContact CD1-CG 3.81Å; R581-P583 VanDerWaalsContact O-CD 3.31Å; R581-P583 WeakPolarHBondContact O-CD 3.1Å; P583-E587 WeakPolarHBondContact CA-OE2 3.47Å; P583-E587 HydrophobicContact CB-CB 4.41Å; P583-E587 WeakPolarHBondContact CB-OE2 3.49Å; P583-I588 HydrophobicContact CB-CG1 4.17Å; P583-I588 HydrophobicContact CG-CD1 3.97Å; P583-I588 HydrophobicContact CG-CG1 3.92Å; P583-I634 HydrophobicContact CB-CD1 3.84Å; P583-I634 HydrophobicContact CG-CD1 3.87Å
584	T	94.5	Very high	91.6	Very high	69 Å²	69	57 Å²	57	42%	0.423	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-72.4	156.3	173.8	61.9	0	0	0	0	109.9	E586 E587 I588	T584-E586 PolarHBondContact O-N 3.28Å; T584-E587 PolarHBondContact N-OE2 2.83Å; T584-E587 WeakPolarHBondContact O-CB 3.37Å; T584-E587 PolarHBondContact O-N 2.86Å; T584-E587 VanDerWaalsContact O-N 3.09Å; T584-E587 WeakPolarHBondContact OG1-CG 3.27Å; T584-E587 PolarHBondContact OG1-N 3.5Å; T584-I588 PolarHBondContact O-N 3.17Å; T584-I588 VanDerWaalsContact O-N 3.14Å
585	M	93.3	Very high	91.3	Very high	62 Å²	62	56.9 Å²	56.9	31%	0.305	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-32.9	177.6	-83.6	-55.8	-69.9	0	0	112.6	R572 E587 I588 T589 Y608	R572-M585 HydrophobicContact CG-SD 4.15Å; R572-M585 VanDerWaalsContact NH1-CG 3.27Å; R572-M585 PolarHBondContact NH1-SD 3.26Å; M585-E587 VanDerWaalsContact C-N 3.31Å; M585-E587 PolarHBondContact O-N 2.82Å; M585-I588 PolarHBondContact O-N 3.11Å; M585-I588 HydrophobicContact SD-CB 4.45Å; M585-I588 HydrophobicContact SD-CD1 3.89Å; M585-T589 HydrophobicContact CE-CG2 4.4Å; M585-T589 WeakPolarHBondContact O-CG2 3.28Å; M585-T589 PolarHBondContact O-N 3.42Å; M585-T589 PolarHBondContact O-OG1 3.41Å; M585-T589 VanDerWaalsContact O-OG1 3.09Å; M585-Y608 HydrophobicContact CE-CD1 4.47Å; M585-Y608 HydrophobicContact CE-CD2 3.86Å; M585-Y608 HydrophobicContact CE-CE2 4.49Å; M585-Y608 HydrophobicContact CE-CG 3.85Å
586	E	94.4	Very high	91	Very high	151 Å²	151	56.9 Å²	56.9	71%	0.706	31%	0.314	S	S	*	.	H	α-helix	trans	-61.2	-39.3	174.6	-65.3	149.9	-175	0	0	112.1	T584 T589 A590	T584-E586 PolarHBondContact O-N 3.28Å; E586-T589 WeakPolarHBondContact CA-OG1 3.22Å; E586-T589 PolarHBondContact O-OG1 3.31Å; E586-T589 VanDerWaalsContact O-OG1 3.1Å; E586-A590 WeakPolarHBondContact O-CB 3.48Å; E586-A590 PolarHBondContact O-N 3.48Å
587	E	93.5	Very high	90.9	Very high	52 Å²	52	55.9 Å²	55.9	24%	0.243	31%	0.306	C	S	.	.	H	α-helix	trans	-67.5	-42	175.3	-72.6	-179.5	139.6	0	0	111.4	R581 P583 T584 M585 V591	R581-E587 IonicContact CZ-OE1 3.32Å; R581-E587 IonicContact CZ-OE2 2.67Å; R581-E587 VanDerWaalsContact CZ-OE2 3.32Å; R581-E587 IonicContact NH1-OE1 2.7Å; R581-E587 PolarHBondContact NH1-OE1 3.32Å; R581-E587 IonicContact NH1-OE2 3.58Å; R581-E587 PolarHBondContact NH1-OE2 3.08Å; R581-E587 VanDerWaalsContact NH2-CD 3.29Å; R581-E587 IonicContact NH2-OE1 3.97Å; R581-E587 PolarHBondContact NH2-OE1 3Å; R581-E587 IonicContact NH2-OE2 2.71Å; R581-E587 PolarHBondContact NH2-OE2 2.93Å; P583-E587 WeakPolarHBondContact CA-OE2 3.47Å; P583-E587 HydrophobicContact CB-CB 4.41Å; P583-E587 WeakPolarHBondContact CB-OE2 3.49Å; T584-E587 PolarHBondContact N-OE2 2.83Å; T584-E587 WeakPolarHBondContact O-CB 3.37Å; T584-E587 PolarHBondContact O-N 2.86Å; T584-E587 VanDerWaalsContact O-N 3.09Å; T584-E587 WeakPolarHBondContact OG1-CG 3.27Å; T584-E587 PolarHBondContact OG1-N 3.5Å; M585-E587 VanDerWaalsContact C-N 3.31Å; M585-E587 PolarHBondContact O-N 2.82Å; E587-V591 WeakPolarHBondContact O-CG2 3.3Å; E587-V591 PolarHBondContact O-N 2.99Å; E587-V591 VanDerWaalsContact O-N 3.15Å
588	I	94.9	Very high	90.9	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-45.8	178.4	-63.3	177.3	0	0	0	110.7	R572 I575 P583 T584 M585 V591 A592 Y608 I634	R572-I588 HydrophobicContact CG-CD1 3.52Å; I575-I588 HydrophobicContact CB-CG2 4.38Å; I575-I588 HydrophobicContact CD1-CG2 3.93Å; I575-I588 HydrophobicContact CG2-CG2 4.2Å; P583-I588 HydrophobicContact CB-CG1 4.17Å; P583-I588 HydrophobicContact CG-CD1 3.97Å; P583-I588 HydrophobicContact CG-CG1 3.92Å; T584-I588 PolarHBondContact O-N 3.17Å; T584-I588 VanDerWaalsContact O-N 3.14Å; M585-I588 PolarHBondContact O-N 3.11Å; M585-I588 HydrophobicContact SD-CB 4.45Å; M585-I588 HydrophobicContact SD-CD1 3.89Å; I588-V591 VanDerWaalsContact O-CG2 3.22Å; I588-V591 WeakPolarHBondContact O-CG2 3.35Å; I588-V591 PolarHBondContact O-N 2.78Å; I588-A592 VanDerWaalsContact O-CB 3.28Å; I588-A592 WeakPolarHBondContact O-CB 3.18Å; I588-A592 PolarHBondContact O-N 2.89Å; I588-Y608 HydrophobicContact CG2-CD1 3.88Å; I588-Y608 HydrophobicContact CG2-CE1 3.8Å; I588-I634 HydrophobicContact CG1-CD1 4.04Å
589	T	94.8	Very high	91.1	Very high	46 Å²	46	56.1 Å²	56.1	28%	0.282	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-40.6	178.9	55.3	0	0	0	0	111.4	M585 E586 V591 A592 V593 Y608	M585-T589 HydrophobicContact CE-CG2 4.4Å; M585-T589 WeakPolarHBondContact O-CG2 3.28Å; M585-T589 PolarHBondContact O-N 3.42Å; M585-T589 PolarHBondContact O-OG1 3.41Å; M585-T589 VanDerWaalsContact O-OG1 3.09Å; E586-T589 WeakPolarHBondContact CA-OG1 3.22Å; E586-T589 PolarHBondContact O-OG1 3.31Å; E586-T589 VanDerWaalsContact O-OG1 3.1Å; T589-V591 PolarHBondContact O-N 2.92Å; T589-A592 PolarHBondContact O-N 3.06Å; T589-V593 VanDerWaalsContact O-CG2 3.29Å; T589-V593 WeakPolarHBondContact O-CG2 3.42Å; T589-V593 PolarHBondContact O-N 3.49Å; T589-Y608 HydrophobicContact CG2-CE2 3.81Å
590	A	92.6	Very high	91.3	Very high	47 Å²	47	55.8 Å²	55.8	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-58.5	-46.9	177.2	0	0	0	0	0	112.1	E586 V593 E594	E586-A590 WeakPolarHBondContact O-CB 3.48Å; E586-A590 PolarHBondContact O-N 3.48Å; A590-V593 PolarHBondContact O-N 3.05Å; A590-E594 WeakPolarHBondContact O-CG 3.11Å; A590-E594 PolarHBondContact O-N 3.01Å
591	V	92.6	Very high	91.7	Very high	14 Å²	14	48.3 Å²	48.3	9%	0.085	26%	0.256	C	S	.	.	H	α-helix	trans	-72.3	-31.3	178.7	-61.5	0	0	0	0	113.1	I575 E587 I588 T589 V593 E594 S595 A630 L633 I634	I575-V591 HydrophobicContact CG2-CG2 3.88Å; E587-V591 WeakPolarHBondContact O-CG2 3.3Å; E587-V591 PolarHBondContact O-N 2.99Å; E587-V591 VanDerWaalsContact O-N 3.15Å; I588-V591 VanDerWaalsContact O-CG2 3.22Å; I588-V591 WeakPolarHBondContact O-CG2 3.35Å; I588-V591 PolarHBondContact O-N 2.78Å; T589-V591 PolarHBondContact O-N 2.92Å; V591-V593 VanDerWaalsContact C-N 3.34Å; V591-E594 PolarHBondContact O-N 2.99Å; V591-S595 WeakPolarHBondContact O-CB 3.16Å; V591-S595 PolarHBondContact O-N 3.43Å; V591-S595 PolarHBondContact O-OG 2.93Å; V591-A630 HydrophobicContact CG2-CB 4.27Å; V591-L633 HydrophobicContact CB-CB 4.43Å; V591-L633 HydrophobicContact CG1-CB 4.38Å; V591-I634 HydrophobicContact CG1-CB 4.23Å; V591-I634 HydrophobicContact CG1-CG1 4.44Å; V591-I634 HydrophobicContact CG2-CB 4.12Å; V591-I634 HydrophobicContact CG2-CD1 4.27Å; V591-I634 HydrophobicContact CG2-CG1 4.31Å
592	A	93.3	Very high	91.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-34	174.5	0	0	0	0	0	111.8	I575 I588 T589 S595 G596 A597 H598 Y608	I575-A592 HydrophobicContact CD1-CB 4.38Å; I588-A592 VanDerWaalsContact O-CB 3.28Å; I588-A592 WeakPolarHBondContact O-CB 3.18Å; I588-A592 PolarHBondContact O-N 2.89Å; T589-A592 PolarHBondContact O-N 3.06Å; A592-S595 PolarHBondContact O-OG 3.45Å; A592-G596 CarbonylContact O-C 3.6Å; A592-G596 PolarHBondContact O-N 2.78Å; A592-A597 HydrophobicContact CB-CB 4.34Å; A592-A597 PolarHBondContact O-N 3.27Å; A592-H598 HydrophobicContact CB-CB 4.16Å; A592-H598 PolarHBondContact O-N 2.94Å; A592-Y608 HydrophobicContact CB-CE1 3.99Å; A592-Y608 WeakPolarHBondContact CB-OH 3.23Å
593	V	91.3	Very high	92	Very high	67 Å²	67	42.5 Å²	42.5	41%	0.406	25%	0.249	S	C	.	.	H	α-helix	trans	-68.6	-45.6	171.6	172.4	0	0	0	0	110.2	T589 A590 V591 S595 G596 H598	T589-V593 VanDerWaalsContact O-CG2 3.29Å; T589-V593 WeakPolarHBondContact O-CG2 3.42Å; T589-V593 PolarHBondContact O-N 3.49Å; A590-V593 PolarHBondContact O-N 3.05Å; V591-V593 VanDerWaalsContact C-N 3.34Å; V593-S595 VanDerWaalsContact C-N 3.28Å; V593-S595 PolarHBondContact O-N 2.71Å; V593-G596 PolarHBondContact O-N 3.44Å; V593-H598 HydrophobicContact CB-CB 4.38Å; V593-H598 HydrophobicContact CG2-CB 3.6Å
594	E	87.3	Confident	92	Very high	57 Å²	57	44.2 Å²	44.2	27%	0.266	26%	0.255	S	S	.	.	H	α-helix	trans	-59	-36	177.2	-77.9	-175.8	-172.5	0	0	112.5	A590 V591 L633 L660 K666	A590-E594 WeakPolarHBondContact O-CG 3.11Å; A590-E594 PolarHBondContact O-N 3.01Å; V591-E594 PolarHBondContact O-N 2.99Å; E594-L633 HydrophobicContact CB-CD1 4.32Å; E594-L660 HydrophobicContact CB-CD1 3.83Å; E594-L660 HydrophobicContact CG-CD1 4.46Å; E594-K666 IonicContact OE1-NZ 3.79Å; E594-K666 PolarHBondContact OE1-NZ 3.42Å; E594-K666 IonicContact OE2-NZ 3.85Å
595	S	87.9	Confident	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-5.6	179.3	78.4	0	0	0	0	115.2	V591 A592 V593 A597 A626 A630	V591-S595 WeakPolarHBondContact O-CB 3.16Å; V591-S595 PolarHBondContact O-N 3.43Å; V591-S595 PolarHBondContact O-OG 2.93Å; A592-S595 PolarHBondContact O-OG 3.45Å; V593-S595 VanDerWaalsContact C-N 3.28Å; V593-S595 PolarHBondContact O-N 2.71Å; S595-A597 VanDerWaalsContact C-N 3.29Å; S595-A597 WeakPolarHBondContact OG-CB 3.42Å; S595-A597 PolarHBondContact OG-N 2.93Å; S595-A626 WeakPolarHBondContact CB-O 3.48Å; S595-A626 PolarHBondContact OG-O 3.4Å; S595-A630 WeakPolarHBondContact OG-CB 3.46Å
596	G	87.7	Confident	91.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	6.5	-173.3	0	0	0	0	0	114.8	A592 V593 N653	A592-G596 CarbonylContact O-C 3.6Å; A592-G596 PolarHBondContact O-N 2.78Å; V593-G596 PolarHBondContact O-N 3.44Å; G596-N653 WeakPolarHBondContact CA-OD1 3.08Å
597	A	91.3	Very high	91.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.265	C	S	.	.			trans	-78.3	-25.6	179.7	0	0	0	0	0	114.3	A592 S595 D599 F600 I601 A626	A592-A597 HydrophobicContact CB-CB 4.34Å; A592-A597 PolarHBondContact O-N 3.27Å; S595-A597 VanDerWaalsContact C-N 3.29Å; S595-A597 WeakPolarHBondContact OG-CB 3.42Å; S595-A597 PolarHBondContact OG-N 2.93Å; A597-D599 VanDerWaalsContact C-N 3.31Å; A597-D599 PolarHBondContact O-N 3.04Å; A597-F600 VanDerWaalsContact CA-CE1 3.42Å; A597-F600 HydrophobicContact CB-CE1 3.82Å; A597-F600 HydrophobicContact CB-CZ 4.12Å; A597-F600 WeakPolarHBondContact O-CD1 3.49Å; A597-I601 HydrophobicContact CB-CD1 3.77Å; A597-I601 WeakPolarHBondContact O-CB 3.39Å; A597-I601 WeakPolarHBondContact O-CD1 3.32Å; A597-I601 WeakPolarHBondContact O-CG1 3.29Å; A597-I601 PolarHBondContact O-N 3.03Å; A597-I601 VanDerWaalsContact O-N 3.08Å; A597-A626 HydrophobicContact CB-CB 4.04Å
598	H	93.6	Very high	91.5	Very high	58 Å²	58	42.7 Å²	42.7	27%	0.269	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-40.3	-174.1	179.3	53.3	0	0	0	113.4	A592 V593 F600 I601 S602 Y608	A592-H598 HydrophobicContact CB-CB 4.16Å; A592-H598 PolarHBondContact O-N 2.94Å; V593-H598 HydrophobicContact CB-CB 4.38Å; V593-H598 HydrophobicContact CG2-CB 3.6Å; H598-F600 PolarHBondContact O-N 2.86Å; H598-I601 PolarHBondContact O-N 3.34Å; H598-S602 PolarHBondContact CE1-OG 3.36Å; H598-S602 PolarHBondContact ND1-OG 2.92Å; H598-S602 VanDerWaalsContact ND1-OG 3.1Å; H598-S602 WeakPolarHBondContact O-CB 3.46Å; H598-S602 PolarHBondContact O-N 3.39Å; H598-S602 PolarHBondContact O-OG 3.49Å; H598-Y608 AromaticContact ND1-CE2 3.96Å; H598-Y608 AromaticContact ND1-CZ 3.87Å; H598-Y608 PolarHBondContact ND1-OH 3.06Å
599	D	90	Very high	91.5	Very high	84 Å²	84	46.4 Å²	46.4	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-64.4	-43.1	-170.8	-61.9	-8.4	0	0	0	110.9	A597 R656	A597-D599 VanDerWaalsContact C-N 3.31Å; A597-D599 PolarHBondContact O-N 3.04Å; D599-R656 IonicContact OD1-NH1 3.88Å; D599-R656 IonicContact OD2-CZ 2.8Å; D599-R656 VanDerWaalsContact OD2-CZ 3.26Å; D599-R656 IonicContact OD2-NH1 2.88Å; D599-R656 PolarHBondContact OD2-NH1 3.23Å; D599-R656 VanDerWaalsContact OD2-NH1 3.16Å; D599-R656 IonicContact OD2-NH2 3.26Å; D599-R656 PolarHBondContact OD2-NH2 3.44Å
600	F	90.4	Very high	91.3	Very high	34 Å²	34	45 Å²	45	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-82.6	-35.4	177.5	78	-102	0	0	0	112.7	F571 A597 H598 S602 G603 F604 Q623 A626 V627	F571-F600 AromaticContact CE1-CE2 3.88Å; F571-F600 HydrophobicContact CE1-CE2 3.88Å; F571-F600 HydrophobicContact CZ-CE2 4.02Å; A597-F600 VanDerWaalsContact CA-CE1 3.42Å; A597-F600 HydrophobicContact CB-CE1 3.82Å; A597-F600 HydrophobicContact CB-CZ 4.12Å; A597-F600 WeakPolarHBondContact O-CD1 3.49Å; H598-F600 PolarHBondContact O-N 2.86Å; F600-S602 VanDerWaalsContact C-N 3.26Å; F600-S602 PolarHBondContact O-N 3.17Å; F600-G603 PolarHBondContact O-N 3.43Å; F600-F604 AromaticContact CD2-CE2 4Å; F600-F604 HydrophobicContact CD2-CE2 4Å; F600-F604 VanDerWaalsContact O-CD2 3.3Å; F600-F604 WeakPolarHBondContact O-CD2 3.37Å; F600-Q623 HydrophobicContact CD1-CG 4Å; F600-Q623 HydrophobicContact CD2-CG 4.06Å; F600-Q623 HydrophobicContact CE1-CB 4.1Å; F600-Q623 HydrophobicContact CE1-CG 3.93Å; F600-Q623 HydrophobicContact CE2-CB 4.09Å; F600-Q623 HydrophobicContact CE2-CG 4.05Å; F600-Q623 HydrophobicContact CG-CG 4.04Å; F600-Q623 HydrophobicContact CZ-CB 3.81Å; F600-Q623 HydrophobicContact CZ-CG 3.98Å; F600-A626 HydrophobicContact CE1-CB 4.05Å; F600-V627 HydrophobicContact CE2-CG2 4.47Å; F600-V627 HydrophobicContact CZ-CG2 3.78Å
601	I	93.8	Very high	91.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-41.5	178.3	-69.3	169.5	0	0	0	110	F571 I575 A597 H598 G603 F604 G607 Y608	F571-I601 HydrophobicContact CB-CD1 4.28Å; F571-I601 HydrophobicContact CB-CG2 4.35Å; F571-I601 HydrophobicContact CD1-CD1 4.03Å; F571-I601 HydrophobicContact CD1-CG1 3.95Å; F571-I601 HydrophobicContact CD2-CG1 4.27Å; F571-I601 HydrophobicContact CD2-CG2 4.06Å; F571-I601 HydrophobicContact CE1-CG1 4.1Å; F571-I601 HydrophobicContact CE2-CG1 4.41Å; F571-I601 HydrophobicContact CG-CD1 4.18Å; F571-I601 HydrophobicContact CG-CG1 4.03Å; F571-I601 HydrophobicContact CG-CG2 4.25Å; F571-I601 HydrophobicContact CZ-CG1 4.32Å; I575-I601 HydrophobicContact CD1-CD1 4.24Å; A597-I601 HydrophobicContact CB-CD1 3.77Å; A597-I601 WeakPolarHBondContact O-CB 3.39Å; A597-I601 WeakPolarHBondContact O-CD1 3.32Å; A597-I601 WeakPolarHBondContact O-CG1 3.29Å; A597-I601 PolarHBondContact O-N 3.03Å; A597-I601 VanDerWaalsContact O-N 3.08Å; H598-I601 PolarHBondContact O-N 3.34Å; I601-G603 PolarHBondContact O-N 3.22Å; I601-F604 PolarHBondContact O-N 3.29Å; I601-G607 WeakPolarHBondContact O-CA 3.46Å; I601-Y608 HydrophobicContact CD1-CD1 4.47Å; I601-Y608 HydrophobicContact CD1-CE1 4.05Å; I601-Y608 HydrophobicContact CG2-CD1 3.75Å; I601-Y608 HydrophobicContact CG2-CD2 3.98Å; I601-Y608 HydrophobicContact CG2-CE1 3.89Å; I601-Y608 HydrophobicContact CG2-CE2 4.11Å; I601-Y608 HydrophobicContact CG2-CG 3.79Å
602	S	92.2	Very high	91	Very high	62 Å²	62	48.8 Å²	48.8	43%	0.434	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.5	178.5	-51.7	0	0	0	0	113.2	H598 F600 F604	H598-S602 PolarHBondContact CE1-OG 3.36Å; H598-S602 PolarHBondContact ND1-OG 2.92Å; H598-S602 VanDerWaalsContact ND1-OG 3.1Å; H598-S602 WeakPolarHBondContact O-CB 3.46Å; H598-S602 PolarHBondContact O-N 3.39Å; H598-S602 PolarHBondContact O-OG 3.49Å; F600-S602 VanDerWaalsContact C-N 3.26Å; F600-S602 PolarHBondContact O-N 3.17Å; S602-F604 VanDerWaalsContact C-N 3.32Å
603	G	90.4	Very high	90.4	Very high	66 Å²	66	49.6 Å²	49.6	68%	0.68	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.8	174.6	0	0	0	0	0	114.1	F600 I601	F600-G603 PolarHBondContact O-N 3.43Å; I601-G603 PolarHBondContact O-N 3.22Å
604	F	91.4	Very high	89.7	Confident	58 Å²	58	54.4 Å²	54.4	25%	0.254	30%	0.304	S	S	.	.	S	Bend	trans	-78.1	147.5	176.2	-78.7	-90.1	0	0	0	112	F571 F600 I601 S602 Q606 G607 T610 L619	F571-F604 AromaticContact CE2-CD2 3.91Å; F571-F604 HydrophobicContact CE2-CD2 3.91Å; F571-F604 HydrophobicContact CE2-CE2 4.08Å; F571-F604 HydrophobicContact CE2-CG 4.3Å; F571-F604 HydrophobicContact CZ-CD2 4.2Å; F571-F604 AromaticContact CZ-CE2 3.91Å; F571-F604 HydrophobicContact CZ-CE2 3.91Å; F571-F604 HydrophobicContact CZ-CZ 4.36Å; F600-F604 AromaticContact CD2-CE2 4Å; F600-F604 HydrophobicContact CD2-CE2 4Å; F600-F604 VanDerWaalsContact O-CD2 3.3Å; F600-F604 WeakPolarHBondContact O-CD2 3.37Å; I601-F604 PolarHBondContact O-N 3.29Å; S602-F604 VanDerWaalsContact C-N 3.32Å; F604-Q606 PolarHBondContact O-N 3.39Å; F604-Q606 VanDerWaalsContact O-N 3.12Å; F604-G607 PolarHBondContact O-N 3.25Å; F604-T610 HydrophobicContact CB-CG2 4.16Å; F604-T610 WeakPolarHBondContact CB-OG1 3.33Å; F604-T610 HydrophobicContact CD1-CG2 3.75Å; F604-T610 HydrophobicContact CE1-CG2 4.43Å; F604-T610 HydrophobicContact CG-CG2 4.12Å; F604-L619 HydrophobicContact CE2-CD2 4.33Å; F604-L619 HydrophobicContact CZ-CD2 3.94Å
605	P	86.7	Confident	88.9	Confident	133 Å²	133	54.8 Å²	54.8	86%	0.864	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.6	-177.2	-26.4	34.1	0	0	0	115.2
606	Q	91.7	Very high	88	Confident	130 Å²	130	54.8 Å²	54.8	61%	0.607	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	10.1	178.6	-64.4	178.4	-11	0	0	112.4	F604 Y608 D609 T610	F604-Q606 PolarHBondContact O-N 3.39Å; F604-Q606 VanDerWaalsContact O-N 3.12Å; Q606-Y608 PolarHBondContact O-N 3.39Å; Q606-D609 PolarHBondContact O-N 3.3Å; Q606-T610 WeakPolarHBondContact CB-OG1 3.48Å
607	G	93.4	Very high	87.3	Confident	17 Å²	17	60.5 Å²	60.5	18%	0.175	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	51.4	-124.3	-179.2	0	0	0	0	0	112.5	I601 F604 D609 T610	I601-G607 WeakPolarHBondContact O-CA 3.46Å; F604-G607 PolarHBondContact O-N 3.25Å; G607-D609 PolarHBondContact O-N 2.91Å; G607-T610 PolarHBondContact N-OG1 3.41Å; G607-T610 WeakPolarHBondContact O-CB 3.37Å; G607-T610 PolarHBondContact O-N 2.84Å; G607-T610 PolarHBondContact O-OG1 3.46Å
608	Y	94	Very high	86.7	Confident	21 Å²	21	67 Å²	67	8%	0.082	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-68	-18.2	180	-74.8	-87.7	0	0	0	115.1	F571 R572 I575 M585 I588 T589 A592 H598 I601 Q606 T610	F571-Y608 WeakPolarHBondContact CB-O 3.44Å; F571-Y608 PolarHBondContact N-O 3.45Å; R572-Y608 PolarHBondContact N-O 3.48Å; I575-Y608 HydrophobicContact CD1-CD1 4.4Å; I575-Y608 HydrophobicContact CD1-CE1 4.13Å; M585-Y608 HydrophobicContact CE-CD1 4.47Å; M585-Y608 HydrophobicContact CE-CD2 3.86Å; M585-Y608 HydrophobicContact CE-CE2 4.49Å; M585-Y608 HydrophobicContact CE-CG 3.85Å; I588-Y608 HydrophobicContact CG2-CD1 3.88Å; I588-Y608 HydrophobicContact CG2-CE1 3.8Å; T589-Y608 HydrophobicContact CG2-CE2 3.81Å; A592-Y608 HydrophobicContact CB-CE1 3.99Å; A592-Y608 WeakPolarHBondContact CB-OH 3.23Å; H598-Y608 AromaticContact ND1-CE2 3.96Å; H598-Y608 AromaticContact ND1-CZ 3.87Å; H598-Y608 PolarHBondContact ND1-OH 3.06Å; I601-Y608 HydrophobicContact CD1-CD1 4.47Å; I601-Y608 HydrophobicContact CD1-CE1 4.05Å; I601-Y608 HydrophobicContact CG2-CD1 3.75Å; I601-Y608 HydrophobicContact CG2-CD2 3.98Å; I601-Y608 HydrophobicContact CG2-CE1 3.89Å; I601-Y608 HydrophobicContact CG2-CE2 4.11Å; I601-Y608 HydrophobicContact CG2-CG 3.79Å; Q606-Y608 PolarHBondContact O-N 3.39Å; Y608-T610 VanDerWaalsContact C-N 3.33Å
609	D	94.3	Very high	86.2	Confident	80 Å²	80	64.9 Å²	64.9	43%	0.428	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-90.4	-3.4	-179.3	-60	-38.7	0	0	0	111.9	R572 Q606 G607 E611	R572-D609 IonicContact CZ-OD1 2.74Å; R572-D609 VanDerWaalsContact CZ-OD1 3.27Å; R572-D609 IonicContact NE-OD1 3.82Å; R572-D609 PolarHBondContact NE-OD1 2.88Å; R572-D609 IonicContact NH2-OD1 2.7Å; R572-D609 PolarHBondContact NH2-OD1 3.13Å; R572-D609 IonicContact NH2-OD2 3.59Å; R572-D609 PolarHBondContact NH2-OD2 2.98Å; Q606-D609 PolarHBondContact O-N 3.3Å; G607-D609 PolarHBondContact O-N 2.91Å; D609-E611 PolarHBondContact O-N 2.97Å
610	T	92.6	Very high	86.1	Confident	17 Å²	17	63.8 Å²	63.8	10%	0.104	36%	0.361	C	S	.	.	S	Bend	trans	-61	128.8	173.4	-47.9	0	0	0	0	111.2	S570 F571 F604 Q606 G607 Y608	S570-T610 VanDerWaalsContact CA-O 3.27Å; S570-T610 WeakPolarHBondContact CA-O 3.23Å; F571-T610 HydrophobicContact CE2-CG2 4.27Å; F571-T610 PolarHBondContact N-O 3.15Å; F571-T610 VanDerWaalsContact N-O 3.16Å; F604-T610 HydrophobicContact CB-CG2 4.16Å; F604-T610 WeakPolarHBondContact CB-OG1 3.33Å; F604-T610 HydrophobicContact CD1-CG2 3.75Å; F604-T610 HydrophobicContact CE1-CG2 4.43Å; F604-T610 HydrophobicContact CG-CG2 4.12Å; Q606-T610 WeakPolarHBondContact CB-OG1 3.48Å; G607-T610 PolarHBondContact N-OG1 3.41Å; G607-T610 WeakPolarHBondContact O-CB 3.37Å; G607-T610 PolarHBondContact O-N 2.84Å; G607-T610 PolarHBondContact O-OG1 3.46Å; Y608-T610 VanDerWaalsContact C-N 3.33Å
611	E	90.9	Very high	85.9	Confident	140 Å²	140	63.6 Å²	63.6	65%	0.654	37%	0.368	S	S	*	.	B	Isolated β-bridge	trans	-73.2	132.9	174.1	-65.3	-171.8	168.8	0	0	111.9	D609 G613	D609-E611 PolarHBondContact O-N 2.97Å; E611-G613 VanDerWaalsContact C-N 3.35Å
612	V	86.6	Confident	85.6	Confident	1 Å²	1	64 Å²	64	1%	0.006	37%	0.372	C	S	.	.			trans	-83.2	-12.2	-173.8	174.2	0	0	0	0	113.1	L566 R569 F571 L619	L566-V612 HydrophobicContact CB-CG1 3.97Å; L566-V612 HydrophobicContact CD1-CG1 3.66Å; L566-V612 HydrophobicContact CG-CG1 4.49Å; R569-V612 WeakPolarHBondContact O-CG2 3.47Å; R569-V612 PolarHBondContact O-N 2.93Å; F571-V612 HydrophobicContact CD1-CG2 3.6Å; F571-V612 HydrophobicContact CD2-CG2 4.28Å; F571-V612 HydrophobicContact CE1-CG2 3.64Å; F571-V612 HydrophobicContact CE2-CG2 4.32Å; F571-V612 HydrophobicContact CG-CG2 3.94Å; F571-V612 HydrophobicContact CZ-CG2 4.02Å; V612-L619 HydrophobicContact CG1-CD1 3.6Å; V612-L619 HydrophobicContact CG1-CG 4.23Å
613	G	80.9	Confident	85.5	Confident	17 Å²	17	63.5 Å²	63.5	18%	0.175	36%	0.363	C	S	.	.			trans	75	172.5	-175.6	0	0	0	0	0	114.2	G568 E611 T615 G616	G568-G613 WeakPolarHBondContact CA-O 3.34Å; E611-G613 VanDerWaalsContact C-N 3.35Å; G613-T615 PolarHBondContact O-N 3.28Å; G613-G616 PolarHBondContact O-N 2.88Å
614	E	76.4	Confident	85.5	Confident	167 Å²	167	63.4 Å²	63.4	78%	0.78	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-58.6	129.4	179.5	-65.3	-174.8	169.6	0	0	111.1	G616 N617	E614-G616 PolarHBondContact O-N 2.91Å; E614-N617 PolarHBondContact O-N 3.38Å; E614-N617 VanDerWaalsContact O-N 3.13Å
615	T	70.6	Confident	85.5	Confident	65 Å²	65	60.9 Å²	60.9	40%	0.399	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	52.1	11.2	-177.4	56.9	0	0	0	0	116.3	L566 G613 N617	L566-T615 CarbonylContact O-C 3.55Å; L566-T615 WeakPolarHBondContact O-CA 3.44Å; G613-T615 PolarHBondContact O-N 3.28Å; T615-N617 VanDerWaalsContact C-N 3.34Å; T615-N617 VanDerWaalsContact OG1-CG 3.28Å; T615-N617 PolarHBondContact OG1-ND2 2.95Å; T615-N617 PolarHBondContact OG1-OD1 2.97Å
616	G	69	Low	85.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	67.7	28.7	-174.2	0	0	0	0	0	114.6	G613 E614 Q618 L619	G613-G616 PolarHBondContact O-N 2.88Å; E614-G616 PolarHBondContact O-N 2.91Å; G616-Q618 PolarHBondContact O-N 3.43Å; G616-Q618 VanDerWaalsContact O-N 3.08Å; G616-L619 PolarHBondContact O-N 3.15Å
617	N	73.9	Confident	85.8	Confident	121 Å²	121	48.4 Å²	48.4	65%	0.647	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.6	-179.8	-70.6	-9.1	0	0	0	114	E614 T615 L619	E614-N617 PolarHBondContact O-N 3.38Å; E614-N617 VanDerWaalsContact O-N 3.13Å; T615-N617 VanDerWaalsContact C-N 3.34Å; T615-N617 VanDerWaalsContact OG1-CG 3.28Å; T615-N617 PolarHBondContact OG1-ND2 2.95Å; T615-N617 PolarHBondContact OG1-OD1 2.97Å; N617-L619 VanDerWaalsContact C-N 3.27Å
618	Q	76.9	Confident	85.8	Confident	136 Å²	136	48 Å²	48	64%	0.636	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-9.6	175.4	-60.5	-177.2	3.1	0	0	113.3	G616	G616-Q618 PolarHBondContact O-N 3.43Å; G616-Q618 VanDerWaalsContact O-N 3.08Å
619	L	85.1	Confident	85.7	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.073	25%	0.254	C	S	.	.	S	Bend	trans	-109.5	147.3	-174.9	-60.9	179.7	0	0	0	112.1	L566 F571 F604 V612 G616 N617 Q623 R624	L566-L619 HydrophobicContact CD1-CD1 3.57Å; F571-L619 HydrophobicContact CE1-CD1 3.69Å; F571-L619 HydrophobicContact CE1-CD2 4.26Å; F571-L619 HydrophobicContact CZ-CD1 4.12Å; F571-L619 HydrophobicContact CZ-CD2 3.88Å; F604-L619 HydrophobicContact CE2-CD2 4.33Å; F604-L619 HydrophobicContact CZ-CD2 3.94Å; V612-L619 HydrophobicContact CG1-CD1 3.6Å; V612-L619 HydrophobicContact CG1-CG 4.23Å; G616-L619 PolarHBondContact O-N 3.15Å; N617-L619 VanDerWaalsContact C-N 3.27Å; L619-Q623 HydrophobicContact CB-CB 4.03Å; L619-Q623 HydrophobicContact CD2-CB 4.49Å; L619-R624 HydrophobicContact CB-CG 3.77Å; L619-R624 HydrophobicContact CD1-CG 4.39Å
620	S	87.8	Confident	85.6	Confident	61 Å²	61	43.5 Å²	43.5	43%	0.427	23%	0.233	S	C	.	.			trans	-65.1	160.8	171.2	77	0	0	0	0	111.3	G622 Q623 R624	S620-G622 VanDerWaalsContact C-N 3.32Å; S620-G622 PolarHBondContact O-N 3.37Å; S620-Q623 PolarHBondContact O-N 3.39Å; S620-Q623 VanDerWaalsContact OG-CG 3.28Å; S620-Q623 WeakPolarHBondContact OG-CG 3.41Å; S620-Q623 PolarHBondContact OG-N 3.12Å; S620-R624 WeakPolarHBondContact O-CG 3.11Å; S620-R624 PolarHBondContact O-N 3.4Å
621	G	86.3	Confident	85.7	Confident	29 Å²	29	44.3 Å²	44.3	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-53	-47.5	175.9	0	0	0	0	0	112.8	R624 Q625	G621-R624 PolarHBondContact O-N 2.85Å; G621-Q625 PolarHBondContact O-N 2.78Å
622	G	87.3	Confident	85.8	Confident	8 Å²	8	37.9 Å²	37.9	8%	0.082	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-41	177.1	0	0	0	0	0	113.8	S620 R624 Q625 A626 A648 L649	S620-G622 VanDerWaalsContact C-N 3.32Å; S620-G622 PolarHBondContact O-N 3.37Å; G622-R624 VanDerWaalsContact C-N 3.33Å; G622-R624 PolarHBondContact O-N 2.82Å; G622-Q625 PolarHBondContact O-N 3.26Å; G622-A626 PolarHBondContact O-N 3.46Å; G622-A648 WeakPolarHBondContact CA-O 3.41Å; G622-A648 PolarHBondContact N-O 3.43Å; G622-L649 WeakPolarHBondContact O-CD2 3.48Å
623	Q	89.4	Confident	86	Confident	53 Å²	53	38 Å²	38	25%	0.248	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.7	-74.5	169.7	-14.6	0	0	111.5	F600 L619 S620 Q625 A626 V627	F600-Q623 HydrophobicContact CD1-CG 4Å; F600-Q623 HydrophobicContact CD2-CG 4.06Å; F600-Q623 HydrophobicContact CE1-CB 4.1Å; F600-Q623 HydrophobicContact CE1-CG 3.93Å; F600-Q623 HydrophobicContact CE2-CB 4.09Å; F600-Q623 HydrophobicContact CE2-CG 4.05Å; F600-Q623 HydrophobicContact CG-CG 4.04Å; F600-Q623 HydrophobicContact CZ-CB 3.81Å; F600-Q623 HydrophobicContact CZ-CG 3.98Å; L619-Q623 HydrophobicContact CB-CB 4.03Å; L619-Q623 HydrophobicContact CD2-CB 4.49Å; S620-Q623 PolarHBondContact O-N 3.39Å; S620-Q623 VanDerWaalsContact OG-CG 3.28Å; S620-Q623 WeakPolarHBondContact OG-CG 3.41Å; S620-Q623 PolarHBondContact OG-N 3.12Å; Q623-Q625 VanDerWaalsContact C-N 3.35Å; Q623-Q625 PolarHBondContact O-N 2.78Å; Q623-A626 PolarHBondContact O-N 2.93Å; Q623-V627 WeakPolarHBondContact O-CG2 3.37Å; Q623-V627 PolarHBondContact O-N 2.95Å; Q623-V627 VanDerWaalsContact O-N 3.09Å
624	R	90.9	Very high	86.6	Confident	64 Å²	64	37.5 Å²	37.5	24%	0.242	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-42	175.7	-68.2	-174.6	-73.6	171.4	3	112	P564 L566 L619 S620 G621 G622 V627 A628	P564-R624 HydrophobicContact CG-CB 4.28Å; L566-R624 HydrophobicContact CD1-CB 4.32Å; L566-R624 HydrophobicContact CD1-CG 3.93Å; L566-R624 HydrophobicContact CG-CG 4.38Å; L619-R624 HydrophobicContact CB-CG 3.77Å; L619-R624 HydrophobicContact CD1-CG 4.39Å; S620-R624 WeakPolarHBondContact O-CG 3.11Å; S620-R624 PolarHBondContact O-N 3.4Å; G621-R624 PolarHBondContact O-N 2.85Å; G622-R624 VanDerWaalsContact C-N 3.33Å; G622-R624 PolarHBondContact O-N 2.82Å; R624-V627 PolarHBondContact O-N 3.25Å; R624-A628 WeakPolarHBondContact O-CB 3.33Å; R624-A628 PolarHBondContact O-N 2.8Å
625	Q	90.4	Very high	87.2	Confident	5 Å²	5	32.3 Å²	32.3	2%	0.023	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-44.6	175.1	-73.3	-178.7	-18.8	0	0	112.3	Q562 P564 G621 G622 Q623 V627 A628 L629 D644 A645 L649	Q562-Q625 PolarHBondContact O-NE2 3.3Å; Q562-Q625 VanDerWaalsContact O-NE2 3.14Å; P564-Q625 HydrophobicContact CG-CB 4.44Å; P564-Q625 HydrophobicContact CG-CG 3.87Å; G621-Q625 PolarHBondContact O-N 2.78Å; G622-Q625 PolarHBondContact O-N 3.26Å; Q623-Q625 VanDerWaalsContact C-N 3.35Å; Q623-Q625 PolarHBondContact O-N 2.78Å; Q625-V627 PolarHBondContact O-N 2.96Å; Q625-A628 PolarHBondContact O-N 3.42Å; Q625-L629 WeakPolarHBondContact O-CB 3.46Å; Q625-L629 PolarHBondContact O-N 3.45Å; Q625-D644 PolarHBondContact NE2-O 2.8Å; Q625-A645 PolarHBondContact OE1-O 3.36Å; Q625-L649 HydrophobicContact CB-CD2 4.22Å; Q625-L649 HydrophobicContact CB-CG 4.46Å
626	A	91.3	Very high	88.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-39.5	178.6	0	0	0	0	0	113.2	S595 A597 F600 G622 Q623 A630 L649	S595-A626 WeakPolarHBondContact CB-O 3.48Å; S595-A626 PolarHBondContact OG-O 3.4Å; A597-A626 HydrophobicContact CB-CB 4.04Å; F600-A626 HydrophobicContact CE1-CB 4.05Å; G622-A626 PolarHBondContact O-N 3.46Å; Q623-A626 PolarHBondContact O-N 2.93Å; A626-A630 PolarHBondContact O-N 3.5Å; A626-L649 HydrophobicContact CB-CD2 4.19Å
627	V	93.3	Very high	89.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.6	-42.3	173.9	178.8	0	0	0	0	111.1	L566 F571 N574 I575 F600 Q623 R624 Q625 L629 A630 R631	L566-V627 HydrophobicContact CD1-CB 4.28Å; L566-V627 HydrophobicContact CD1-CG1 4.32Å; L566-V627 HydrophobicContact CD2-CB 4.13Å; L566-V627 HydrophobicContact CD2-CG1 3.87Å; F571-V627 HydrophobicContact CD1-CG2 3.94Å; F571-V627 HydrophobicContact CE1-CG2 3.98Å; N574-V627 HydrophobicContact CB-CG1 4.21Å; I575-V627 HydrophobicContact CG1-CG1 4.17Å; F600-V627 HydrophobicContact CE2-CG2 4.47Å; F600-V627 HydrophobicContact CZ-CG2 3.78Å; Q623-V627 WeakPolarHBondContact O-CG2 3.37Å; Q623-V627 PolarHBondContact O-N 2.95Å; Q623-V627 VanDerWaalsContact O-N 3.09Å; R624-V627 PolarHBondContact O-N 3.25Å; Q625-V627 PolarHBondContact O-N 2.96Å; V627-L629 VanDerWaalsContact C-N 3.3Å; V627-L629 PolarHBondContact O-N 3.29Å; V627-A630 WeakPolarHBondContact O-CB 3.37Å; V627-A630 PolarHBondContact O-N 3.47Å; V627-R631 WeakPolarHBondContact O-CB 3.04Å; V627-R631 PolarHBondContact O-N 3.46Å
628	A	92.9	Very high	90	Very high	8 Å²	8	31.6 Å²	31.6	7%	0.066	16%	0.159	C	C	.	.	H	α-helix	trans	-64.9	-36.2	178	0	0	0	0	0	112.1	V560 P564 R624 Q625 R631 A632	V560-A628 HydrophobicContact CG1-CB 3.92Å; P564-A628 HydrophobicContact CB-CB 3.38Å; P564-A628 HydrophobicContact CG-CB 3.82Å; R624-A628 WeakPolarHBondContact O-CB 3.33Å; R624-A628 PolarHBondContact O-N 2.8Å; Q625-A628 PolarHBondContact O-N 3.42Å; A628-R631 WeakPolarHBondContact O-CB 3.23Å; A628-R631 PolarHBondContact O-N 3.22Å; A628-A632 PolarHBondContact O-N 3.42Å
629	L	92.5	Very high	90.8	Very high	8 Å²	8	25.3 Å²	25.3	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-44.3	172.6	-176.2	62.7	0	0	0	111.5	V560 Q625 V627 R631 A632 L633 L642 V657	V560-L629 HydrophobicContact CG2-CD1 4.18Å; Q625-L629 WeakPolarHBondContact O-CB 3.46Å; Q625-L629 PolarHBondContact O-N 3.45Å; V627-L629 VanDerWaalsContact C-N 3.3Å; V627-L629 PolarHBondContact O-N 3.29Å; L629-R631 VanDerWaalsContact C-N 3.29Å; L629-R631 PolarHBondContact O-N 3.22Å; L629-A632 PolarHBondContact O-N 2.85Å; L629-A632 VanDerWaalsContact O-N 3.12Å; L629-L633 HydrophobicContact CD1-CD1 4.32Å; L629-L633 HydrophobicContact CD1-CG 4.27Å; L629-L633 HydrophobicContact CG-CD1 3.98Å; L629-L633 HydrophobicContact CG-CG 4.36Å; L629-L633 VanDerWaalsContact O-CG 3.29Å; L629-L633 WeakPolarHBondContact O-CG 3.48Å; L629-L633 PolarHBondContact O-N 2.9Å; L629-L642 HydrophobicContact CD1-CD2 3.88Å; L629-V657 HydrophobicContact CD2-CB 4.48Å; L629-V657 HydrophobicContact CD2-CG1 4.15Å; L629-V657 HydrophobicContact CD2-CG2 3.54Å
630	A	93.2	Very high	91.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57	-43.3	172.3	0	0	0	0	0	111.9	I575 V591 S595 A626 V627 A632 L633 I634	I575-A630 HydrophobicContact CD1-CB 4.25Å; I575-A630 HydrophobicContact CG1-CB 4.06Å; I575-A630 HydrophobicContact CG2-CB 4.17Å; V591-A630 HydrophobicContact CG2-CB 4.27Å; S595-A630 WeakPolarHBondContact OG-CB 3.46Å; A626-A630 PolarHBondContact O-N 3.5Å; V627-A630 WeakPolarHBondContact O-CB 3.37Å; V627-A630 PolarHBondContact O-N 3.47Å; A630-A632 VanDerWaalsContact C-N 3.3Å; A630-A632 PolarHBondContact O-N 3.35Å; A630-L633 PolarHBondContact O-N 3.35Å; A630-I634 PolarHBondContact O-N 3.13Å
631	R	94	Very high	91.5	Very high	34 Å²	34	21.9 Å²	21.9	13%	0.128	11%	0.107	C	C	.	.	H	α-helix	trans	-61.5	-34.8	176	-176.8	-166.3	-61.3	165.3	0.8	112.6	L565 N574 V627 A628 L629 I634	L565-R631 PolarHBondContact O-NH1 3.23Å; N574-R631 WeakPolarHBondContact O-CG 3.43Å; N574-R631 PolarHBondContact O-NE 2.79Å; N574-R631 PolarHBondContact OD1-NH2 3.41Å; V627-R631 WeakPolarHBondContact O-CB 3.04Å; V627-R631 PolarHBondContact O-N 3.46Å; A628-R631 WeakPolarHBondContact O-CB 3.23Å; A628-R631 PolarHBondContact O-N 3.22Å; L629-R631 VanDerWaalsContact C-N 3.29Å; L629-R631 PolarHBondContact O-N 3.22Å; R631-I634 WeakPolarHBondContact O-CG2 3.44Å
632	A	92.7	Very high	91.8	Very high	5 Å²	5	20.6 Å²	20.6	4%	0.041	9%	0.094	C	C	.	.	H	α-helix	trans	-72.9	-44.4	173.7	0	0	0	0	0	111.6	A558 V560 A628 L629 A630 I634 R635 P637 L640	A558-A632 HydrophobicContact CB-CB 3.85Å; V560-A632 HydrophobicContact CG2-CB 3.75Å; A628-A632 PolarHBondContact O-N 3.42Å; L629-A632 PolarHBondContact O-N 2.85Å; L629-A632 VanDerWaalsContact O-N 3.12Å; A630-A632 VanDerWaalsContact C-N 3.3Å; A630-A632 PolarHBondContact O-N 3.35Å; A632-I634 PolarHBondContact O-N 3.28Å; A632-R635 PolarHBondContact O-N 3.35Å; A632-P637 WeakPolarHBondContact O-CD 3.44Å; A632-L640 HydrophobicContact CB-CD1 4.14Å
633	L	91.3	Very high	92.1	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-69.3	-33.3	-174.6	-69.2	173.8	0	0	0	113.8	V591 E594 L629 A630 R635 K636 L640 L660	V591-L633 HydrophobicContact CB-CB 4.43Å; V591-L633 HydrophobicContact CG1-CB 4.38Å; E594-L633 HydrophobicContact CB-CD1 4.32Å; L629-L633 HydrophobicContact CD1-CD1 4.32Å; L629-L633 HydrophobicContact CD1-CG 4.27Å; L629-L633 HydrophobicContact CG-CD1 3.98Å; L629-L633 HydrophobicContact CG-CG 4.36Å; L629-L633 VanDerWaalsContact O-CG 3.29Å; L629-L633 WeakPolarHBondContact O-CG 3.48Å; L629-L633 PolarHBondContact O-N 2.9Å; A630-L633 PolarHBondContact O-N 3.35Å; L633-R635 PolarHBondContact O-N 3.48Å; L633-K636 PolarHBondContact O-N 3.48Å; L633-L640 HydrophobicContact CD2-CD2 4.49Å; L633-L660 HydrophobicContact CD1-CD1 3.64Å; L633-L660 HydrophobicContact CD1-CD2 4.45Å; L633-L660 HydrophobicContact CD2-CD1 4.38Å; L633-L660 HydrophobicContact CD2-CD2 4.2Å
634	I	92.7	Very high	91.8	Very high	8 Å²	8	19.2 Å²	19.2	4%	0.041	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.2	179.5	-158.8	166.4	0	0	0	113.2	I575 L579 P583 I588 V591 A630 R631 A632 K636	I575-I634 HydrophobicContact CG2-CD1 3.9Å; I575-I634 WeakPolarHBondContact O-CG2 3.39Å; L579-I634 HydrophobicContact CD1-CD1 3.93Å; L579-I634 HydrophobicContact CD1-CG1 4.01Å; L579-I634 HydrophobicContact CD1-CG2 4Å; L579-I634 HydrophobicContact CG-CG2 4.47Å; P583-I634 HydrophobicContact CB-CD1 3.84Å; P583-I634 HydrophobicContact CG-CD1 3.87Å; I588-I634 HydrophobicContact CG1-CD1 4.04Å; V591-I634 HydrophobicContact CG1-CB 4.23Å; V591-I634 HydrophobicContact CG1-CG1 4.44Å; V591-I634 HydrophobicContact CG2-CB 4.12Å; V591-I634 HydrophobicContact CG2-CD1 4.27Å; V591-I634 HydrophobicContact CG2-CG1 4.31Å; A630-I634 PolarHBondContact O-N 3.13Å; R631-I634 WeakPolarHBondContact O-CG2 3.44Å; A632-I634 PolarHBondContact O-N 3.28Å; I634-K636 PolarHBondContact O-N 2.91Å
635	R	90.3	Very high	91.1	Very high	58 Å²	58	16.4 Å²	16.4	22%	0.219	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.6	176.9	-60.6	-176.2	-176.9	-172.9	2.4	113.1	H554 Y577 L579 A632 L633	H554-R635 PolarHBondContact O-NH1 3.33Å; H554-R635 VanDerWaalsContact O-NH1 3.16Å; Y577-R635 PolarHBondContact O-NH2 2.95Å; L579-R635 HydrophobicContact CD2-CG 4.1Å; A632-R635 PolarHBondContact O-N 3.35Å; L633-R635 PolarHBondContact O-N 3.48Å
636	K	89.4	Confident	90.5	Very high	135 Å²	135	16.3 Å²	16.3	59%	0.587	8%	0.076	S	C	*	.			trans	51.5	55	-174.2	-57.6	174.4	-176.7	173.4	0	111.7	L633 I634	L633-K636 PolarHBondContact O-N 3.48Å; I634-K636 PolarHBondContact O-N 2.91Å
637	P	91.4	Very high	89.9	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.006	9%	0.094	C	C	.	.			trans	-65	148.9	-175.3	31.3	-38.9	0	0	0	111.7	Q556 A558 A632 L640 R670	Q556-P637 CarbonylContact O-C 3.57Å; Q556-P637 WeakPolarHBondContact O-CA 3.19Å; Q556-P637 WeakPolarHBondContact O-CB 3.33Å; A558-P637 HydrophobicContact CB-CB 3.69Å; A558-P637 HydrophobicContact CB-CG 3.67Å; A632-P637 WeakPolarHBondContact O-CD 3.44Å; P637-L640 HydrophobicContact CG-CB 4.49Å; P637-L640 HydrophobicContact CG-CD1 4.33Å; P637-R670 WeakPolarHBondContact O-CG 3.37Å
638	L	90.9	Very high	89.2	Confident	34 Å²	34	21.1 Å²	21.1	18%	0.178	11%	0.113	C	C	.	.	S	Bend	trans	-81.1	-32.8	168.5	-69.4	175.5	0	0	0	111.5	M475 Q556 R670 T671	M475-L638 HydrophobicContact CB-CD1 3.65Å; Q556-L638 PolarHBondContact O-N 2.93Å; Q556-L638 VanDerWaalsContact OE1-CD1 3.24Å; L638-R670 CarbonylContact O-C 3.57Å; L638-R670 WeakPolarHBondContact O-CA 3.34Å; L638-T671 PolarHBondContact O-N 3Å
639	L	92.9	Very high	88.5	Confident	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.5	174.3	-179.5	63.3	0	0	0	109.6	V479 L504 L527 Q556 V557 A558 I641 T671	V479-L639 HydrophobicContact CG2-CD1 4.23Å; V479-L639 HydrophobicContact CG2-CD2 3.95Å; L504-L639 HydrophobicContact CD1-CD1 4.47Å; L527-L639 HydrophobicContact CD2-CD2 4.38Å; Q556-L639 PolarHBondContact O-N 3.47Å; V557-L639 WeakPolarHBondContact CA-O 3.34Å; V557-L639 HydrophobicContact CG1-CB 4.43Å; V557-L639 HydrophobicContact CG1-CD2 3.97Å; V557-L639 HydrophobicContact CG1-CG 4.27Å; V557-L639 HydrophobicContact CG2-CB 4.16Å; V557-L639 HydrophobicContact CG2-CD2 4.01Å; A558-L639 PolarHBondContact N-O 2.93Å; L639-I641 HydrophobicContact CD2-CD1 4.48Å; L639-I641 HydrophobicContact CG-CG1 4.29Å; L639-T671 WeakPolarHBondContact CA-O 3.33Å; L639-T671 HydrophobicContact CD1-CG2 3.67Å
640	L	93.8	Very high	88	Confident	3 Å²	3	25 Å²	25	2%	0.016	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.8	176.4	-179.1	64.7	0	0	0	109.9	A558 A632 L633 P637 L642 L661 T671 V672 L673	A558-L640 HydrophobicContact CB-CD1 4.37Å; A558-L640 WeakPolarHBondContact O-CA 3.24Å; A632-L640 HydrophobicContact CB-CD1 4.14Å; L633-L640 HydrophobicContact CD2-CD2 4.49Å; P637-L640 HydrophobicContact CG-CB 4.49Å; P637-L640 HydrophobicContact CG-CD1 4.33Å; L640-L642 HydrophobicContact CD1-CD2 4.18Å; L640-L642 HydrophobicContact CD2-CD1 4.42Å; L640-L642 HydrophobicContact CD2-CD2 4.42Å; L640-L642 HydrophobicContact CD2-CG 4.45Å; L640-L642 HydrophobicContact CG-CD2 4.19Å; L640-L642 HydrophobicContact CG-CG 4.22Å; L640-L661 HydrophobicContact CD2-CD2 4.15Å; L640-T671 PolarHBondContact N-O 3.37Å; L640-V672 HydrophobicContact CB-CG2 4.42Å; L640-V672 CarbonylContact O-C 3.57Å; L640-V672 WeakPolarHBondContact O-CA 3.47Å; L640-L673 PolarHBondContact O-N 3.44Å
641	I	94.8	Very high	87.4	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.8	178.4	-54	166.3	0	0	0	108.3	A524 L527 Q528 V557 A558 A559 V560 L639 L673	A524-I641 HydrophobicContact CB-CG2 3.73Å; L527-I641 HydrophobicContact CB-CD1 3.57Å; L527-I641 HydrophobicContact CD1-CD1 3.93Å; L527-I641 HydrophobicContact CD1-CG1 4.35Å; L527-I641 HydrophobicContact CG-CD1 4.4Å; Q528-I641 HydrophobicContact CG-CD1 4.13Å; V557-I641 HydrophobicContact CG1-CD1 3.89Å; A558-I641 PolarHBondContact O-N 3.37Å; A559-I641 CarbonylContact C-O 3.55Å; A559-I641 VanDerWaalsContact CA-O 3.27Å; A559-I641 WeakPolarHBondContact CA-O 3.43Å; A559-I641 HydrophobicContact CB-CB 3.97Å; A559-I641 HydrophobicContact CB-CD1 4.45Å; A559-I641 HydrophobicContact CB-CG2 4.49Å; V560-I641 PolarHBondContact N-O 3.29Å; L639-I641 HydrophobicContact CD2-CD1 4.48Å; L639-I641 HydrophobicContact CG-CG1 4.29Å; I641-L673 WeakPolarHBondContact CA-O 3.48Å; I641-L673 HydrophobicContact CG1-CB 4.44Å; I641-L673 HydrophobicContact CG2-CD2 4.32Å
642	L	93.3	Very high	86.8	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.9	177.5	-61	178.3	0	0	0	108.2	V560 L629 L640 A645 L661 L673 L674 I675	V560-L642 HydrophobicContact CB-CD2 3.87Å; V560-L642 HydrophobicContact CG2-CD2 3.74Å; L629-L642 HydrophobicContact CD1-CD2 3.88Å; L640-L642 HydrophobicContact CD1-CD2 4.18Å; L640-L642 HydrophobicContact CD2-CD1 4.42Å; L640-L642 HydrophobicContact CD2-CD2 4.42Å; L640-L642 HydrophobicContact CD2-CG 4.45Å; L640-L642 HydrophobicContact CG-CD2 4.19Å; L640-L642 HydrophobicContact CG-CG 4.22Å; L642-A645 HydrophobicContact CB-CB 4.26Å; L642-A645 HydrophobicContact CD2-CB 4.23Å; L642-L661 HydrophobicContact CD1-CD1 3.72Å; L642-L661 HydrophobicContact CD1-CD2 3.62Å; L642-L661 HydrophobicContact CD1-CG 4.27Å; L642-L673 PolarHBondContact N-O 3.03Å; L642-L674 HydrophobicContact CB-CD1 3.84Å; L642-L674 HydrophobicContact CD1-CD1 4.21Å; L642-I675 PolarHBondContact O-N 3.28Å
643	D	91.8	Very high	86.2	Confident	18 Å²	18	30 Å²	30	10%	0.096	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	94.1	176.9	-164.3	7.7	0	0	0	110.4	S521 V560 G561 Q562 A645 I675	S521-D643 VanDerWaalsContact CB-OD2 3.29Å; S521-D643 WeakPolarHBondContact CB-OD2 3.49Å; S521-D643 PolarHBondContact OG-OD2 2.98Å; V560-D643 PolarHBondContact O-N 3.48Å; G561-D643 CarbonylContact C-O 3.47Å; Q562-D643 WeakPolarHBondContact CA-O 3.43Å; Q562-D643 PolarHBondContact N-O 3.35Å; D643-A645 PolarHBondContact O-N 3.1Å; D643-I675 HydrophobicContact CB-CD1 4.09Å; D643-I675 VanDerWaalsContact OD1-CG2 3.26Å; D643-I675 WeakPolarHBondContact OD1-CG2 3.2Å
644	D	84.5	Confident	85.8	Confident	13 Å²	13	32.4 Å²	32.4	7%	0.07	19%	0.193	C	C	.	.	S	Bend	trans	50.2	28.9	-177.4	-159	44.1	0	0	0	114	Q562 Q625 T646 S647 I675	Q562-D644 HydrophobicContact CB-CB 4.45Å; Q562-D644 HydrophobicContact CG-CB 4.12Å; Q625-D644 PolarHBondContact NE2-O 2.8Å; D644-T646 PolarHBondContact O-N 3.37Å; D644-S647 PolarHBondContact O-N 2.96Å; D644-S647 PolarHBondContact O-OG 3.43Å; D644-S647 WeakPolarHBondContact OD1-CB 3.23Å; D644-S647 VanDerWaalsContact OD2-CB 3.25Å; D644-S647 WeakPolarHBondContact OD2-CB 3.44Å; D644-S647 PolarHBondContact OD2-OG 2.97Å; D644-I675 WeakPolarHBondContact CA-O 3.37Å; D644-I675 PolarHBondContact N-O 3.03Å
645	A	76.8	Confident	85.4	Confident	6 Å²	6	35.5 Å²	35.5	5%	0.05	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	4.3	-171.2	0	0	0	0	0	114.6	V560 Q625 L642 D643	V560-A645 HydrophobicContact CB-CB 3.86Å; V560-A645 HydrophobicContact CG1-CB 3.54Å; Q625-A645 PolarHBondContact OE1-O 3.36Å; L642-A645 HydrophobicContact CB-CB 4.26Å; L642-A645 HydrophobicContact CD2-CB 4.23Å; D643-A645 PolarHBondContact O-N 3.1Å
646	T	77.9	Confident	85.1	Confident	3 Å²	3	37 Å²	37	2%	0.018	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-4.8	-179.7	58.7	0	0	0	0	113.4	D644 A648 L649 Q654 V657 Q678 L681	D644-T646 PolarHBondContact O-N 3.37Å; T646-A648 PolarHBondContact O-N 2.85Å; T646-L649 HydrophobicContact CG2-CD1 4.24Å; T646-L649 PolarHBondContact O-N 3.25Å; T646-Q654 PolarHBondContact O-NE2 2.97Å; T646-V657 HydrophobicContact CG2-CB 4.29Å; T646-V657 HydrophobicContact CG2-CG1 3.72Å; T646-Q678 PolarHBondContact O-NE2 2.88Å; T646-Q678 PolarHBondContact OG1-OE1 3.24Å; T646-L681 HydrophobicContact CG2-CD1 4.2Å; T646-L681 VanDerWaalsContact OG1-CD1 3.26Å; T646-L681 WeakPolarHBondContact OG1-CD1 3.33Å
647	S	77.9	Confident	84.9	Confident	52 Å²	52	30.7 Å²	30.7	36%	0.364	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.5	-173.5	57.3	0	0	0	0	113.6	D644	D644-S647 PolarHBondContact O-N 2.96Å; D644-S647 PolarHBondContact O-OG 3.43Å; D644-S647 WeakPolarHBondContact OD1-CB 3.23Å; D644-S647 VanDerWaalsContact OD2-CB 3.25Å; D644-S647 WeakPolarHBondContact OD2-CB 3.44Å; D644-S647 PolarHBondContact OD2-OG 2.97Å
648	A	77.4	Confident	84.6	Confident	49 Å²	49	32.7 Å²	32.7	41%	0.405	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	0.8	-179.3	0	0	0	0	0	113.8	G622 T646	G622-A648 WeakPolarHBondContact CA-O 3.41Å; G622-A648 PolarHBondContact N-O 3.43Å; T646-A648 PolarHBondContact O-N 2.85Å
649	L	79.9	Confident	84.4	Confident	9 Å²	9	37.4 Å²	37.4	5%	0.047	21%	0.213	C	C	.	.	S	Bend	trans	-76.6	144.8	175.3	-67.6	176.4	0	0	0	110.9	G622 Q625 A626 T646 N653 Q654 V657	G622-L649 WeakPolarHBondContact O-CD2 3.48Å; Q625-L649 HydrophobicContact CB-CD2 4.22Å; Q625-L649 HydrophobicContact CB-CG 4.46Å; A626-L649 HydrophobicContact CB-CD2 4.19Å; T646-L649 HydrophobicContact CG2-CD1 4.24Å; T646-L649 PolarHBondContact O-N 3.25Å; L649-N653 HydrophobicContact CB-CB 4.32Å; L649-N653 HydrophobicContact CD2-CB 4.24Å; L649-Q654 HydrophobicContact CB-CG 3.63Å; L649-Q654 PolarHBondContact O-NE2 3.5Å; L649-V657 HydrophobicContact CD1-CG2 3.82Å
650	D	82.3	Confident	84.1	Confident	89 Å²	89	38.1 Å²	38.1	48%	0.476	22%	0.217	S	C	.	.			trans	-66.6	157.3	168.6	61.1	-65.9	0	0	0	111.3	G652 N653 Q654	D650-G652 PolarHBondContact O-N 3.05Å; D650-G652 VanDerWaalsContact O-N 3.11Å; D650-G652 PolarHBondContact OD2-N 3.05Å; D650-N653 PolarHBondContact O-N 2.96Å; D650-N653 VanDerWaalsContact O-N 3.08Å; D650-N653 VanDerWaalsContact OD1-CB 3.32Å; D650-N653 WeakPolarHBondContact OD1-CB 3.41Å; D650-N653 VanDerWaalsContact OD1-CG 3.32Å; D650-N653 PolarHBondContact OD1-ND2 3.18Å; D650-N653 PolarHBondContact OD2-N 2.69Å; D650-Q654 WeakPolarHBondContact O-CG 3.16Å; D650-Q654 PolarHBondContact O-N 3.37Å
651	A	80.6	Confident	83.7	Confident	77 Å²	77	38.2 Å²	38.2	64%	0.636	22%	0.217	S	C	*	.	H	α-helix	trans	-55.6	-34.3	-174.8	0	0	0	0	0	113.5	L655	A651-L655 WeakPolarHBondContact O-CB 3.31Å; A651-L655 PolarHBondContact O-N 2.88Å; A651-L655 VanDerWaalsContact O-N 3.15Å
652	G	79.5	Confident	83.2	Confident	44 Å²	44	39.8 Å²	39.8	45%	0.454	22%	0.223	S	C	.	.	H	α-helix	trans	-65.4	-48.7	177.1	0	0	0	0	0	112.3	D650 L655 R656	D650-G652 PolarHBondContact O-N 3.05Å; D650-G652 VanDerWaalsContact O-N 3.11Å; D650-G652 PolarHBondContact OD2-N 3.05Å; G652-L655 PolarHBondContact O-N 3.13Å; G652-R656 PolarHBondContact O-N 2.99Å
653	N	80.6	Confident	82.7	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-70.1	-36.6	177	-74.9	-33.3	0	0	0	112.9	G596 L649 D650 L655 R656 V657	G596-N653 WeakPolarHBondContact CA-OD1 3.08Å; L649-N653 HydrophobicContact CB-CB 4.32Å; L649-N653 HydrophobicContact CD2-CB 4.24Å; D650-N653 PolarHBondContact O-N 2.96Å; D650-N653 VanDerWaalsContact O-N 3.08Å; D650-N653 VanDerWaalsContact OD1-CB 3.32Å; D650-N653 WeakPolarHBondContact OD1-CB 3.41Å; D650-N653 VanDerWaalsContact OD1-CG 3.32Å; D650-N653 PolarHBondContact OD1-ND2 3.18Å; D650-N653 PolarHBondContact OD2-N 2.69Å; N653-L655 VanDerWaalsContact C-N 3.28Å; N653-L655 PolarHBondContact O-N 3.4Å; N653-R656 WeakPolarHBondContact O-CB 3.48Å; N653-R656 PolarHBondContact O-N 3Å; N653-R656 VanDerWaalsContact O-N 3.16Å; N653-V657 WeakPolarHBondContact O-CG2 3.4Å; N653-V657 PolarHBondContact O-N 2.86Å
654	Q	82.4	Confident	82.1	Confident	53 Å²	53	46.6 Å²	46.6	25%	0.248	26%	0.257	C	S	.	.	H	α-helix	trans	-55.9	-44.9	173.2	-74.9	178.9	-17.2	0	0	111.6	T646 L649 D650 R656 V657 Q658	T646-Q654 PolarHBondContact O-NE2 2.97Å; L649-Q654 HydrophobicContact CB-CG 3.63Å; L649-Q654 PolarHBondContact O-NE2 3.5Å; D650-Q654 WeakPolarHBondContact O-CG 3.16Å; D650-Q654 PolarHBondContact O-N 3.37Å; Q654-R656 VanDerWaalsContact C-N 3.34Å; Q654-R656 PolarHBondContact O-N 3.03Å; Q654-V657 PolarHBondContact O-N 3.44Å; Q654-Q658 WeakPolarHBondContact O-CB 3.33Å; Q654-Q658 PolarHBondContact O-N 2.8Å
655	L	84.5	Confident	81.5	Confident	74 Å²	74	51.6 Å²	51.6	39%	0.387	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-35.2	179.5	-164.3	139.4	0	0	0	112	A651 G652 N653 Q658 R659	A651-L655 WeakPolarHBondContact O-CB 3.31Å; A651-L655 PolarHBondContact O-N 2.88Å; A651-L655 VanDerWaalsContact O-N 3.15Å; G652-L655 PolarHBondContact O-N 3.13Å; N653-L655 VanDerWaalsContact C-N 3.28Å; N653-L655 PolarHBondContact O-N 3.4Å; L655-Q658 PolarHBondContact O-N 2.95Å; L655-R659 HydrophobicContact CD2-CG 4.46Å; L655-R659 WeakPolarHBondContact O-CG 3.29Å; L655-R659 PolarHBondContact O-N 3.01Å
656	R	84.1	Confident	81.2	Confident	90 Å²	90	55.8 Å²	55.8	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-45.8	171.7	-69.3	-174	-176.9	-167.8	13.6	111.9	D599 G652 N653 Q654 Q658 R659 L660	D599-R656 IonicContact OD1-NH1 3.88Å; D599-R656 IonicContact OD2-CZ 2.8Å; D599-R656 VanDerWaalsContact OD2-CZ 3.26Å; D599-R656 IonicContact OD2-NH1 2.88Å; D599-R656 PolarHBondContact OD2-NH1 3.23Å; D599-R656 VanDerWaalsContact OD2-NH1 3.16Å; D599-R656 IonicContact OD2-NH2 3.26Å; D599-R656 PolarHBondContact OD2-NH2 3.44Å; G652-R656 PolarHBondContact O-N 2.99Å; N653-R656 WeakPolarHBondContact O-CB 3.48Å; N653-R656 PolarHBondContact O-N 3Å; N653-R656 VanDerWaalsContact O-N 3.16Å; Q654-R656 VanDerWaalsContact C-N 3.34Å; Q654-R656 PolarHBondContact O-N 3.03Å; R656-Q658 VanDerWaalsContact C-N 3.34Å; R656-Q658 PolarHBondContact O-N 3.37Å; R656-R659 PolarHBondContact O-N 3.49Å; R656-L660 WeakPolarHBondContact O-CB 3.29Å; R656-L660 PolarHBondContact O-N 3.35Å
657	V	85.3	Confident	81	Confident	1 Å²	1	59 Å²	59	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-41.9	177.3	177.6	0	0	0	0	110.8	L629 T646 L649 N653 Q654 R659 L660 L661	L629-V657 HydrophobicContact CD2-CB 4.48Å; L629-V657 HydrophobicContact CD2-CG1 4.15Å; L629-V657 HydrophobicContact CD2-CG2 3.54Å; T646-V657 HydrophobicContact CG2-CB 4.29Å; T646-V657 HydrophobicContact CG2-CG1 3.72Å; L649-V657 HydrophobicContact CD1-CG2 3.82Å; N653-V657 WeakPolarHBondContact O-CG2 3.4Å; N653-V657 PolarHBondContact O-N 2.86Å; Q654-V657 PolarHBondContact O-N 3.44Å; V657-R659 PolarHBondContact O-N 3.06Å; V657-L660 WeakPolarHBondContact O-CB 3.33Å; V657-L660 PolarHBondContact O-N 3.24Å; V657-L660 VanDerWaalsContact O-N 3.12Å; V657-L661 HydrophobicContact CG1-CD1 4Å; V657-L661 HydrophobicContact CG1-CG 4.28Å; V657-L661 WeakPolarHBondContact O-CG 3.45Å; V657-L661 PolarHBondContact O-N 2.91Å
658	Q	86.5	Confident	80.6	Confident	44 Å²	44	60.4 Å²	60.4	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-57.2	-49.1	175.4	-176.1	179.6	15.9	0	0	112	Q654 L655 R656 L660 L661 Y662 L681	Q654-Q658 WeakPolarHBondContact O-CB 3.33Å; Q654-Q658 PolarHBondContact O-N 2.8Å; L655-Q658 PolarHBondContact O-N 2.95Å; R656-Q658 VanDerWaalsContact C-N 3.34Å; R656-Q658 PolarHBondContact O-N 3.37Å; Q658-L660 VanDerWaalsContact C-N 3.29Å; Q658-L660 PolarHBondContact O-N 3.02Å; Q658-L661 PolarHBondContact O-N 3.39Å; Q658-Y662 HydrophobicContact CG-CD2 3.96Å; Q658-Y662 HydrophobicContact CG-CE2 4.42Å; Q658-Y662 WeakPolarHBondContact O-CD2 3.41Å; Q658-Y662 PolarHBondContact O-N 2.94Å; Q658-L681 HydrophobicContact CB-CD2 4Å; Q658-L681 HydrophobicContact CG-CD2 3.9Å
659	R	86.2	Confident	80.5	Confident	132 Å²	132	61.4 Å²	61.4	50%	0.498	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-39.2	174.8	-68	-175.2	178.4	152	-0.9	111.9	L655 R656 V657 L661 E663 S664	L655-R659 HydrophobicContact CD2-CG 4.46Å; L655-R659 WeakPolarHBondContact O-CG 3.29Å; L655-R659 PolarHBondContact O-N 3.01Å; R656-R659 PolarHBondContact O-N 3.49Å; V657-R659 PolarHBondContact O-N 3.06Å; R659-L661 VanDerWaalsContact C-N 3.32Å; R659-L661 PolarHBondContact O-N 2.93Å; R659-E663 VanDerWaalsContact CG-OE2 3.28Å; R659-E663 WeakPolarHBondContact CG-OE2 3.46Å; R659-E663 WeakPolarHBondContact O-CA 3.29Å; R659-E663 VanDerWaalsContact O-CB 3.31Å; R659-E663 WeakPolarHBondContact O-CB 3.5Å; R659-E663 PolarHBondContact O-N 3.12Å; R659-S664 PolarHBondContact O-N 3.19Å; R659-S664 VanDerWaalsContact O-N 3.13Å
660	L	85.5	Confident	80.9	Confident	20 Å²	20	62.2 Å²	62.2	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-38.3	176.4	178	137.7	0	0	0	112.5	E594 L633 R656 V657 Q658 S664	E594-L660 HydrophobicContact CB-CD1 3.83Å; E594-L660 HydrophobicContact CG-CD1 4.46Å; L633-L660 HydrophobicContact CD1-CD1 3.64Å; L633-L660 HydrophobicContact CD1-CD2 4.45Å; L633-L660 HydrophobicContact CD2-CD1 4.38Å; L633-L660 HydrophobicContact CD2-CD2 4.2Å; R656-L660 WeakPolarHBondContact O-CB 3.29Å; R656-L660 PolarHBondContact O-N 3.35Å; V657-L660 WeakPolarHBondContact O-CB 3.33Å; V657-L660 PolarHBondContact O-N 3.24Å; V657-L660 VanDerWaalsContact O-N 3.12Å; Q658-L660 VanDerWaalsContact C-N 3.29Å; Q658-L660 PolarHBondContact O-N 3.02Å; L660-S664 WeakPolarHBondContact O-CB 3.34Å
661	L	85.7	Confident	81.4	Confident	4 Å²	4	58 Å²	58	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-78.5	-37.9	-179.1	-63	174.2	0	0	0	113.1	L640 L642 V657 Q658 R659 R667 V672	L640-L661 HydrophobicContact CD2-CD2 4.15Å; L642-L661 HydrophobicContact CD1-CD1 3.72Å; L642-L661 HydrophobicContact CD1-CD2 3.62Å; L642-L661 HydrophobicContact CD1-CG 4.27Å; V657-L661 HydrophobicContact CG1-CD1 4Å; V657-L661 HydrophobicContact CG1-CG 4.28Å; V657-L661 WeakPolarHBondContact O-CG 3.45Å; V657-L661 PolarHBondContact O-N 2.91Å; Q658-L661 PolarHBondContact O-N 3.39Å; R659-L661 VanDerWaalsContact C-N 3.32Å; R659-L661 PolarHBondContact O-N 2.93Å; L661-R667 WeakPolarHBondContact O-CD 3.32Å; L661-V672 HydrophobicContact CD2-CG1 4.04Å
662	Y	85.7	Confident	82	Confident	34 Å²	34	54.5 Å²	54.5	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-105	-36.3	-170.8	-67.3	-67.3	0	0	0	114.4	V509 Q658 L681 Q684 A685	V509-Y662 HydrophobicContact CB-CE1 3.88Å; V509-Y662 HydrophobicContact CG1-CE1 3.87Å; V509-Y662 HydrophobicContact CG2-CD1 4.2Å; V509-Y662 HydrophobicContact CG2-CE1 3.95Å; Q658-Y662 HydrophobicContact CG-CD2 3.96Å; Q658-Y662 HydrophobicContact CG-CE2 4.42Å; Q658-Y662 WeakPolarHBondContact O-CD2 3.41Å; Q658-Y662 PolarHBondContact O-N 2.94Å; Y662-L681 HydrophobicContact CE2-CD2 4.39Å; Y662-L681 PolarHBondContact OH-O 2.99Å; Y662-Q684 HydrophobicContact CD1-CB 4.48Å; Y662-Q684 HydrophobicContact CD2-CB 4.38Å; Y662-Q684 HydrophobicContact CE1-CB 4.04Å; Y662-Q684 WeakPolarHBondContact CE1-O 3.17Å; Y662-Q684 HydrophobicContact CE2-CB 3.91Å; Y662-A685 PolarHBondContact OH-N 3.3Å
663	E	81.9	Confident	82.8	Confident	139 Å²	139	52.4 Å²	52.4	65%	0.65	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-19.5	-172.9	-58.1	177.1	-178.1	0	0	113.3	R659	R659-E663 VanDerWaalsContact CG-OE2 3.28Å; R659-E663 WeakPolarHBondContact CG-OE2 3.46Å; R659-E663 WeakPolarHBondContact O-CA 3.29Å; R659-E663 VanDerWaalsContact O-CB 3.31Å; R659-E663 WeakPolarHBondContact O-CB 3.5Å; R659-E663 PolarHBondContact O-N 3.12Å
664	S	78.9	Confident	83.4	Confident	25 Å²	25	51.4 Å²	51.4	18%	0.175	26%	0.261	C	S	.	.			trans	-64.4	132	-174.4	-172.5	0	0	0	0	112.6	R659 L660 K666 R667	R659-S664 PolarHBondContact O-N 3.19Å; R659-S664 VanDerWaalsContact O-N 3.13Å; L660-S664 WeakPolarHBondContact O-CB 3.34Å; S664-K666 PolarHBondContact O-N 3.44Å; S664-K666 PolarHBondContact OG-N 3.42Å; S664-R667 WeakPolarHBondContact O-CB 3.45Å; S664-R667 PolarHBondContact O-N 2.98Å
665	P	71.4	Confident	83.9	Confident	118 Å²	118	49 Å²	49	77%	0.766	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-63.6	-24.4	175.7	24.5	-32.6	0	0	0	112.3	R667 A668	P665-R667 PolarHBondContact O-N 3.33Å; P665-A668 PolarHBondContact O-N 2.84Å
666	K	71.5	Confident	84	Confident	94 Å²	94	45.7 Å²	45.7	41%	0.409	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-68.5	-9.6	175	-61.8	176.5	-175.6	168.8	0	112.9	E594 S664 A668 R670	E594-K666 IonicContact OE1-NZ 3.79Å; E594-K666 PolarHBondContact OE1-NZ 3.42Å; E594-K666 IonicContact OE2-NZ 3.85Å; S664-K666 PolarHBondContact O-N 3.44Å; S664-K666 PolarHBondContact OG-N 3.42Å; K666-A668 VanDerWaalsContact C-N 3.34Å; K666-R670 WeakPolarHBondContact O-CD 3.43Å; K666-R670 WeakPolarHBondContact O-CG 3.36Å
667	R	72.4	Confident	83.9	Confident	70 Å²	70	46.2 Å²	46.2	26%	0.264	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-65.8	-34.1	175.2	-176.4	-169	66.6	100.5	-10.2	112.4	G507 L661 S664 P665 S669 R670 H686	G507-R667 WeakPolarHBondContact CA-O 3.5Å; G507-R667 PolarHBondContact O-NH1 3.14Å; L661-R667 WeakPolarHBondContact O-CD 3.32Å; S664-R667 WeakPolarHBondContact O-CB 3.45Å; S664-R667 PolarHBondContact O-N 2.98Å; P665-R667 PolarHBondContact O-N 3.33Å; R667-S669 PolarHBondContact O-N 3.29Å; R667-R670 PolarHBondContact O-N 3.11Å; R667-H686 PolarHBondContact NH1-CE1 3.31Å; R667-H686 PolarHBondContact NH1-NE2 2.76Å; R667-H686 VanDerWaalsContact NH1-NE2 3.19Å
668	A	70.6	Confident	83.7	Confident	81 Å²	81	48 Å²	48	67%	0.669	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-57.7	-22.9	-171.1	0	0	0	0	0	113.9	P665 K666	P665-A668 PolarHBondContact O-N 2.84Å; K666-A668 VanDerWaalsContact C-N 3.34Å
669	S	75.7	Confident	83.4	Confident	71 Å²	71	48.1 Å²	48.1	50%	0.497	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-107.9	4.1	177.3	57	0	0	0	0	114.7	R667	R667-S669 PolarHBondContact O-N 3.29Å
670	R	87.8	Confident	83.3	Confident	25 Å²	25	45 Å²	45	9%	0.094	25%	0.248	C	C	.	.			trans	-114.7	131.8	-174.7	-66.8	-179.4	179.8	173	-0.2	112	G507 P637 L638 K666 R667	G507-R670 VanDerWaalsContact CA-O 3.24Å; G507-R670 WeakPolarHBondContact CA-O 3.21Å; G507-R670 PolarHBondContact N-O 3.39Å; G507-R670 VanDerWaalsContact N-O 3.1Å; P637-R670 WeakPolarHBondContact O-CG 3.37Å; L638-R670 CarbonylContact O-C 3.57Å; L638-R670 WeakPolarHBondContact O-CA 3.34Å; K666-R670 WeakPolarHBondContact O-CD 3.43Å; K666-R670 WeakPolarHBondContact O-CG 3.36Å; R667-R670 PolarHBondContact O-N 3.11Å
671	T	92.8	Very high	83.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	125.8	166	-54	0	0	0	0	108	G477 L504 P506 L638 L639 L640	G477-T671 PolarHBondContact O-OG1 3.24Å; L504-T671 HydrophobicContact CB-CG2 3.65Å; P506-T671 VanDerWaalsContact CA-OG1 3.32Å; P506-T671 WeakPolarHBondContact CA-OG1 3.3Å; L638-T671 PolarHBondContact O-N 3Å; L639-T671 WeakPolarHBondContact CA-O 3.33Å; L639-T671 HydrophobicContact CD1-CG2 3.67Å; L640-T671 PolarHBondContact N-O 3.37Å
672	V	93.6	Very high	83.3	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.024	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.4	180	-178.6	0	0	0	0	109.6	T508 V509 T510 L640 L661	T508-V672 PolarHBondContact O-N 2.97Å; T508-V672 VanDerWaalsContact O-N 3.13Å; V509-V672 HydrophobicContact CB-CB 4.44Å; V509-V672 HydrophobicContact CG1-CB 4.32Å; V509-V672 HydrophobicContact CG1-CG1 4.17Å; V509-V672 HydrophobicContact CG2-CB 4.13Å; V509-V672 HydrophobicContact CG2-CG2 4.41Å; T510-V672 PolarHBondContact N-O 3.35Å; L640-V672 HydrophobicContact CB-CG2 4.42Å; L640-V672 CarbonylContact O-C 3.57Å; L640-V672 WeakPolarHBondContact O-CA 3.47Å; L661-V672 HydrophobicContact CD2-CG1 4.04Å
673	L	95.1	Very high	83.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.1	167.3	-179	67.3	0	0	0	108.9	L504 T510 L512 V523 L527 L640 I641 L642	L504-L673 HydrophobicContact CD1-CB 4.3Å; L504-L673 HydrophobicContact CD1-CD1 4.39Å; L504-L673 HydrophobicContact CD2-CD1 4.16Å; T510-L673 HydrophobicContact CG2-CD1 4.46Å; L512-L673 HydrophobicContact CB-CD1 4.03Å; V523-L673 HydrophobicContact CG1-CD2 4.2Å; L527-L673 HydrophobicContact CD1-CD2 3.34Å; L640-L673 PolarHBondContact O-N 3.44Å; I641-L673 WeakPolarHBondContact CA-O 3.48Å; I641-L673 HydrophobicContact CG1-CB 4.44Å; I641-L673 HydrophobicContact CG2-CD2 4.32Å; L642-L673 PolarHBondContact N-O 3.03Å
674	L	94.1	Very high	83.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.6	179.2	177.7	65.7	0	0	0	109.8	V509 T510 A511 L512 L642 T676 L681	V509-L674 HydrophobicContact CG1-CB 4.48Å; T510-L674 PolarHBondContact O-N 3.18Å; A511-L674 CarbonylContact C-O 3.49Å; A511-L674 VanDerWaalsContact CA-O 3.23Å; A511-L674 WeakPolarHBondContact CA-O 3.41Å; L512-L674 PolarHBondContact N-O 2.92Å; L642-L674 HydrophobicContact CB-CD1 3.84Å; L642-L674 HydrophobicContact CD1-CD1 4.21Å; L674-T676 HydrophobicContact CD2-CG2 3.93Å; L674-T676 HydrophobicContact CG-CG2 3.94Å; L674-L681 HydrophobicContact CD2-CB 3.92Å
675	I	93.4	Very high	84.3	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.2	166.7	-54.7	163.4	0	0	0	106.2	L512 K520 A524 L642 D643 D644	L512-I675 HydrophobicContact CB-CG1 3.98Å; L512-I675 HydrophobicContact CD2-CD1 4.34Å; L512-I675 HydrophobicContact CD2-CG1 3.93Å; L512-I675 HydrophobicContact CG-CG1 4.46Å; K520-I675 HydrophobicContact CB-CD1 4.32Å; K520-I675 HydrophobicContact CB-CG1 4.49Å; K520-I675 HydrophobicContact CB-CG2 3.73Å; K520-I675 HydrophobicContact CD-CG2 3.89Å; K520-I675 HydrophobicContact CG-CG2 4.35Å; K520-I675 WeakPolarHBondContact O-CD1 3.37Å; A524-I675 HydrophobicContact CB-CD1 3.84Å; L642-I675 PolarHBondContact O-N 3.28Å; D643-I675 HydrophobicContact CB-CD1 4.09Å; D643-I675 VanDerWaalsContact OD1-CG2 3.26Å; D643-I675 WeakPolarHBondContact OD1-CG2 3.2Å; D644-I675 WeakPolarHBondContact CA-O 3.37Å; D644-I675 PolarHBondContact N-O 3.03Å
676	T	86.3	Confident	85.3	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.018	22%	0.223	C	C	.	.			trans	-146.3	146.2	-177.1	-171.2	0	0	0	0	111.2	L674 Q678 L681 A682	L674-T676 HydrophobicContact CD2-CG2 3.93Å; L674-T676 HydrophobicContact CG-CG2 3.94Å; T676-Q678 WeakPolarHBondContact OG1-CB 3.41Å; T676-Q678 PolarHBondContact OG1-N 3.08Å; T676-L681 HydrophobicContact CG2-CB 4.29Å; T676-A682 HydrophobicContact CG2-CB 4.03Å
677	Q	81.9	Confident	86.3	Confident	101 Å²	101	40 Å²	40	47%	0.472	22%	0.215	S	C	.	.	S	Bend	trans	-93.8	-9.4	165.7	-57.5	-171.4	5.1	0	0	111.8	N516 L679	N516-Q677 PolarHBondContact OD1-NE2 2.65Å; Q677-L679 PolarHBondContact O-N 3.36Å
678	Q	80.8	Confident	87.4	Confident	40 Å²	40	36.7 Å²	36.7	19%	0.187	20%	0.203	C	C	.	.			trans	-78.9	113	-179.4	-62.3	-177.7	-31.9	0	0	110	T646 T676 S680 L681 A682	T646-Q678 PolarHBondContact O-NE2 2.88Å; T646-Q678 PolarHBondContact OG1-OE1 3.24Å; T676-Q678 WeakPolarHBondContact OG1-CB 3.41Å; T676-Q678 PolarHBondContact OG1-N 3.08Å; Q678-S680 VanDerWaalsContact C-N 3.32Å; Q678-S680 PolarHBondContact O-N 3.29Å; Q678-L681 HydrophobicContact CB-CD1 4.41Å; Q678-L681 HydrophobicContact CB-CG 4.49Å; Q678-L681 PolarHBondContact O-N 3.16Å; Q678-A682 PolarHBondContact O-N 3.01Å
679	L	80.5	Confident	88.5	Confident	45 Å²	45	32.9 Å²	32.9	24%	0.236	17%	0.171	C	C	.	.	H	α-helix	trans	-58.6	-43.4	-177.8	-175.2	66.6	0	0	0	112.1	Q677 L681 A682 E683 V716	Q677-L679 PolarHBondContact O-N 3.36Å; L679-L681 VanDerWaalsContact C-N 3.28Å; L679-L681 PolarHBondContact O-N 3.32Å; L679-A682 PolarHBondContact O-N 2.97Å; L679-E683 HydrophobicContact CD1-CG 4.15Å; L679-E683 WeakPolarHBondContact CD2-OE1 3.48Å; L679-E683 HydrophobicContact CG-CG 4.03Å; L679-E683 WeakPolarHBondContact CG-OE1 3.37Å; L679-E683 WeakPolarHBondContact O-CB 3.4Å; L679-E683 VanDerWaalsContact O-CG 3.28Å; L679-E683 WeakPolarHBondContact O-CG 3.3Å; L679-E683 PolarHBondContact O-N 3.44Å; L679-V716 HydrophobicContact CD1-CB 4.28Å; L679-V716 HydrophobicContact CD1-CG1 3.96Å; L679-V716 HydrophobicContact CD1-CG2 3.61Å; L679-V716 HydrophobicContact CD2-CG1 3.88Å
680	S	83.3	Confident	89.3	Confident	66 Å²	66	30 Å²	30	46%	0.462	15%	0.15	S	C	.	.	H	α-helix	trans	-57.7	-36.8	-178.3	54	0	0	0	0	113.8	Q678	Q678-S680 VanDerWaalsContact C-N 3.32Å; Q678-S680 PolarHBondContact O-N 3.29Å
681	L	85	Confident	89.5	Confident	8 Å²	8	28.8 Å²	28.8	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-79	-36.1	176.3	-67.5	178.9	0	0	0	112	T646 Q658 Y662 L674 T676 Q678 L679	T646-L681 HydrophobicContact CG2-CD1 4.2Å; T646-L681 VanDerWaalsContact OG1-CD1 3.26Å; T646-L681 WeakPolarHBondContact OG1-CD1 3.33Å; Q658-L681 HydrophobicContact CB-CD2 4Å; Q658-L681 HydrophobicContact CG-CD2 3.9Å; Y662-L681 HydrophobicContact CE2-CD2 4.39Å; Y662-L681 PolarHBondContact OH-O 2.99Å; L674-L681 HydrophobicContact CD2-CB 3.92Å; T676-L681 HydrophobicContact CG2-CB 4.29Å; Q678-L681 HydrophobicContact CB-CD1 4.41Å; Q678-L681 HydrophobicContact CB-CG 4.49Å; Q678-L681 PolarHBondContact O-N 3.16Å; L679-L681 VanDerWaalsContact C-N 3.28Å; L679-L681 PolarHBondContact O-N 3.32Å
682	A	86.9	Confident	89.4	Confident	3 Å²	3	34.5 Å²	34.5	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-68.4	-37.2	177.5	0	0	0	0	0	112.3	A511 V513 T676 Q678 L679 Q684 A685 I688	A511-A682 HydrophobicContact CB-CB 4.35Å; V513-A682 HydrophobicContact CG2-CB 4.12Å; T676-A682 HydrophobicContact CG2-CB 4.03Å; Q678-A682 PolarHBondContact O-N 3.01Å; L679-A682 PolarHBondContact O-N 2.97Å; A682-Q684 VanDerWaalsContact C-N 3.29Å; A682-Q684 PolarHBondContact O-N 3.1Å; A682-A685 VanDerWaalsContact O-CB 3.25Å; A682-A685 WeakPolarHBondContact O-CB 3.36Å; A682-A685 PolarHBondContact O-N 3.41Å; A682-I688 VanDerWaalsContact O-CD1 3.27Å; A682-I688 WeakPolarHBondContact O-CD1 3.31Å
683	E	88.1	Confident	89	Confident	82 Å²	82	40.8 Å²	40.8	38%	0.383	20%	0.196	S	C	.	.	H	α-helix	trans	-61	-36.1	179	-78.2	179.4	173	0	0	113.2	L679 A685 H702	L679-E683 HydrophobicContact CD1-CG 4.15Å; L679-E683 WeakPolarHBondContact CD2-OE1 3.48Å; L679-E683 HydrophobicContact CG-CG 4.03Å; L679-E683 WeakPolarHBondContact CG-OE1 3.37Å; L679-E683 WeakPolarHBondContact O-CB 3.4Å; L679-E683 VanDerWaalsContact O-CG 3.28Å; L679-E683 WeakPolarHBondContact O-CG 3.3Å; L679-E683 PolarHBondContact O-N 3.44Å; E683-A685 VanDerWaalsContact C-N 3.29Å; E683-A685 PolarHBondContact O-N 2.85Å; E683-H702 IonicContact OE1-CE1 2.72Å
684	Q	88.6	Confident	88.6	Confident	94 Å²	94	40.8 Å²	40.8	44%	0.439	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-5.5	-179.7	-64.8	-176.8	-2	0	0	113.5	Y662 A682	Y662-Q684 HydrophobicContact CD1-CB 4.48Å; Y662-Q684 HydrophobicContact CD2-CB 4.38Å; Y662-Q684 HydrophobicContact CE1-CB 4.04Å; Y662-Q684 WeakPolarHBondContact CE1-O 3.17Å; Y662-Q684 HydrophobicContact CE2-CB 3.91Å; A682-Q684 VanDerWaalsContact C-N 3.29Å; A682-Q684 PolarHBondContact O-N 3.1Å
685	A	90.8	Very high	88.4	Confident	8 Å²	8	43 Å²	43	7%	0.066	21%	0.212	C	C	.	.			trans	-66.7	143.9	-179.3	0	0	0	0	0	111.6	A511 Y662 A682 E683 H687 I688	A511-A685 HydrophobicContact CB-CB 3.48Å; A511-A685 VanDerWaalsContact CB-CB 3.48Å; Y662-A685 PolarHBondContact OH-N 3.3Å; A682-A685 VanDerWaalsContact O-CB 3.25Å; A682-A685 WeakPolarHBondContact O-CB 3.36Å; A682-A685 PolarHBondContact O-N 3.41Å; E683-A685 VanDerWaalsContact C-N 3.29Å; E683-A685 PolarHBondContact O-N 2.85Å; A685-H687 VanDerWaalsContact C-N 3.28Å; A685-H687 PolarHBondContact O-N 3.47Å; A685-I688 HydrophobicContact CB-CG1 4.16Å
686	H	91.6	Very high	88.2	Confident	81 Å²	81	44.7 Å²	44.7	38%	0.375	22%	0.222	S	C	.	.	S	Bend	trans	-71.4	-31.6	179.2	-62.1	75.7	0	0	0	111	V509 R667	V509-H686 PolarHBondContact N-ND1 2.88Å; V509-H686 PolarHBondContact O-N 3.31Å; R667-H686 PolarHBondContact NH1-CE1 3.31Å; R667-H686 PolarHBondContact NH1-NE2 2.76Å; R667-H686 VanDerWaalsContact NH1-NE2 3.19Å
687	H	93.7	Very high	88.2	Confident	54 Å²	54	46.8 Å²	46.8	25%	0.25	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	138.7	177.9	-166	59.2	0	0	0	109.5	V509 T510 A511 A685 L689	V509-H687 PolarHBondContact O-N 3.06Å; T510-H687 CarbonylContact C-O 3.57Å; T510-H687 VanDerWaalsContact CA-O 3.26Å; T510-H687 WeakPolarHBondContact CA-O 3.37Å; T510-H687 HydrophobicContact CG2-CB 4.28Å; A511-H687 PolarHBondContact N-O 3.33Å; A685-H687 VanDerWaalsContact C-N 3.28Å; A685-H687 PolarHBondContact O-N 3.47Å; H687-L689 WeakPolarHBondContact NE2-CD2 3.38Å
688	I	94.6	Very high	88.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.4	178.8	-56.2	179.9	0	0	0	108.3	A511 V513 A682 A685 Q699 G700 H702 L705 Y712	A511-I688 HydrophobicContact CB-CG1 4.37Å; A511-I688 CarbonylContact O-C 3.55Å; A511-I688 WeakPolarHBondContact O-CA 3.19Å; V513-I688 HydrophobicContact CG2-CG2 4.21Å; A682-I688 VanDerWaalsContact O-CD1 3.27Å; A682-I688 WeakPolarHBondContact O-CD1 3.31Å; A685-I688 HydrophobicContact CB-CG1 4.16Å; I688-Q699 VanDerWaalsContact O-CA 3.28Å; I688-Q699 WeakPolarHBondContact O-CA 3.37Å; I688-G700 PolarHBondContact N-O 2.93Å; I688-G700 PolarHBondContact O-N 3.39Å; I688-G700 VanDerWaalsContact O-N 3.12Å; I688-H702 HydrophobicContact CD1-CB 3.84Å; I688-L705 HydrophobicContact CB-CD1 3.78Å; I688-L705 HydrophobicContact CG2-CD1 3.82Å; I688-Y712 HydrophobicContact CD1-CE2 4.21Å; I688-Y712 WeakPolarHBondContact CD1-OH 3.37Å; I688-Y712 HydrophobicContact CG2-CD2 4.16Å; I688-Y712 HydrophobicContact CG2-CE2 3.81Å
689	L	94	Very high	89.2	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.6	174.2	-64.9	174.4	0	0	0	108.6	F502 L504 T510 A511 L512 V513 H687 V696 Q699	F502-L689 HydrophobicContact CB-CD1 4.16Å; F502-L689 HydrophobicContact CB-CD2 4.14Å; F502-L689 HydrophobicContact CD1-CD1 4.3Å; F502-L689 HydrophobicContact CD2-CD1 3.43Å; F502-L689 VanDerWaalsContact CD2-CD1 3.43Å; F502-L689 HydrophobicContact CE2-CD1 3.81Å; F502-L689 HydrophobicContact CG-CD1 3.71Å; F502-L689 HydrophobicContact CZ-CD1 4.38Å; L504-L689 HydrophobicContact CD2-CD1 4.48Å; T510-L689 HydrophobicContact CG2-CD1 3.66Å; T510-L689 HydrophobicContact CG2-CG 3.87Å; A511-L689 PolarHBondContact O-N 3Å; L512-L689 HydrophobicContact CD1-CB 3.53Å; L512-L689 HydrophobicContact CD1-CD1 4.1Å; L512-L689 HydrophobicContact CD1-CG 4.47Å; V513-L689 PolarHBondContact N-O 2.77Å; H687-L689 WeakPolarHBondContact NE2-CD2 3.38Å; L689-V696 HydrophobicContact CD2-CG1 4.37Å; L689-Q699 HydrophobicContact CD2-CB 3.7Å
690	F	92.9	Very high	89.8	Confident	10 Å²	10	44 Å²	44	4%	0.044	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.6	175.4	-173	-94.6	0	0	0	110.3	V513 R692 G697 E698 C711 Y712 M715	V513-F690 CarbonylContact O-C 3.58Å; V513-F690 WeakPolarHBondContact O-CA 3.38Å; F690-R692 HydrophobicContact CE1-CB 4.19Å; F690-G697 PolarHBondContact O-N 3.17Å; F690-E698 HydrophobicContact CB-CB 4.11Å; F690-E698 PolarHBondContact N-O 3.24Å; F690-E698 PolarHBondContact O-N 3.04Å; F690-C711 HydrophobicContact CD1-CB 3.94Å; F690-C711 HydrophobicContact CE1-CB 3.32Å; F690-C711 HydrophobicContact CZ-CB 3.72Å; F690-Y712 HydrophobicContact CD2-CD2 4.21Å; F690-M715 HydrophobicContact CD2-SD 4.39Å; F690-M715 HydrophobicContact CE2-CB 4.24Å; F690-M715 HydrophobicContact CE2-CE 4.39Å; F690-M715 HydrophobicContact CE2-SD 3.74Å
691	L	92.3	Very high	90.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	129.6	178.2	-94.5	154.9	0	0	0	111.3	L500 L512 V513 P515 S518 K520 V523 S695	L500-L691 HydrophobicContact CD1-CD2 3.6Å; L512-L691 HydrophobicContact CD1-CD1 3.32Å; L512-L691 HydrophobicContact CD1-CG 4.04Å; L512-L691 HydrophobicContact CD2-CD1 3.55Å; L512-L691 HydrophobicContact CG-CD1 3.49Å; L512-L691 VanDerWaalsContact CG-CD1 3.49Å; V513-L691 PolarHBondContact O-N 2.98Å; P515-L691 WeakPolarHBondContact CD-O 3.26Å; S518-L691 WeakPolarHBondContact CB-O 3.42Å; K520-L691 HydrophobicContact CG-CD1 3.98Å; V523-L691 HydrophobicContact CG2-CD1 4.29Å; L691-S695 WeakPolarHBondContact CA-O 3.43Å
692	R	89.4	Confident	90.6	Very high	120 Å²	120	44.5 Å²	44.5	45%	0.453	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.3	172.6	-177.1	177.5	174.5	171	-0.2	109.9	F690 G694 S695	F690-R692 HydrophobicContact CE1-CB 4.19Å; R692-G694 PolarHBondContact O-N 3.5Å; R692-S695 PolarHBondContact N-O 2.66Å; R692-S695 PolarHBondContact O-N 3.31Å; R692-S695 PolarHBondContact O-OG 3.26Å
693	E	86.8	Confident	90.8	Very high	135 Å²	135	50.2 Å²	50.2	63%	0.631	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	34.6	174.9	-65	165.2	-139.2	0	0	113.5
694	G	85.3	Confident	90.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.01	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	4.6	178.6	0	0	0	0	0	116.1	V496 L497 Q498 S518 R692	V496-G694 WeakPolarHBondContact O-CA 3.35Å; L497-G694 WeakPolarHBondContact CA-O 3.34Å; Q498-G694 PolarHBondContact N-O 3.19Å; S518-G694 PolarHBondContact O-N 2.96Å; R692-G694 PolarHBondContact O-N 3.5Å
695	S	90.1	Very high	91	Very high	46 Å²	46	46.7 Å²	46.7	32%	0.322	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	158.1	177.8	67.4	0	0	0	0	111.8	L691 R692 G697	L691-S695 WeakPolarHBondContact CA-O 3.43Å; R692-S695 PolarHBondContact N-O 2.66Å; R692-S695 PolarHBondContact O-N 3.31Å; R692-S695 PolarHBondContact O-OG 3.26Å; S695-G697 PolarHBondContact O-N 3.44Å
696	V	90.5	Very high	91	Very high	40 Å²	40	48.6 Å²	48.6	24%	0.242	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	108.7	172.8	-176.2	0	0	0	0	108.2	L500 F502 L689 Q699	L500-V696 HydrophobicContact CD1-CG2 3.49Å; L500-V696 VanDerWaalsContact CD1-CG2 3.49Å; L500-V696 HydrophobicContact CG-CG2 4.27Å; F502-V696 HydrophobicContact CD1-CG2 4.13Å; L689-V696 HydrophobicContact CD2-CG1 4.37Å; V696-Q699 HydrophobicContact CG1-CB 4.38Å
697	G	86.1	Confident	90.9	Very high	47 Å²	47	53.3 Å²	53.3	49%	0.485	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-47.6	177.2	0	0	0	0	0	112.1	F690 S695	F690-G697 PolarHBondContact O-N 3.17Å; S695-G697 PolarHBondContact O-N 3.44Å
698	E	90.9	Very high	90.7	Very high	32 Å²	32	58.5 Å²	58.5	15%	0.15	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.1	-178.4	-66.6	170.6	-152.6	0	0	111.2	F690 L705 G710 C711	F690-E698 HydrophobicContact CB-CB 4.11Å; F690-E698 PolarHBondContact N-O 3.24Å; F690-E698 PolarHBondContact O-N 3.04Å; E698-L705 HydrophobicContact CB-CD2 3.82Å; E698-G710 WeakPolarHBondContact OE1-CA 3.24Å; E698-C711 PolarHBondContact OE1-N 2.8Å
699	Q	92.6	Very high	90.2	Very high	90 Å²	90	60.7 Å²	60.7	42%	0.421	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.9	174.6	63.8	-177.7	6.9	0	0	111.7	I688 L689 V696 R708	I688-Q699 VanDerWaalsContact O-CA 3.28Å; I688-Q699 WeakPolarHBondContact O-CA 3.37Å; L689-Q699 HydrophobicContact CD2-CB 3.7Å; V696-Q699 HydrophobicContact CG1-CB 4.38Å; Q699-R708 PolarHBondContact O-NH1 3.48Å
700	G	92.4	Very high	89.9	Confident	5 Å²	5	61.8 Å²	61.8	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.4	-167.1	-179.5	0	0	0	0	0	113.1	I688	I688-G700 PolarHBondContact N-O 2.93Å; I688-G700 PolarHBondContact O-N 3.39Å; I688-G700 VanDerWaalsContact O-N 3.12Å
701	T	93.1	Very high	89.6	Confident	50 Å²	50	63.4 Å²	63.4	31%	0.307	33%	0.333	S	S	.	.			trans	-83.2	160.7	168.7	67.3	0	0	0	0	110.9	L703 Q704 L705	T701-L703 VanDerWaalsContact C-N 3.29Å; T701-L703 PolarHBondContact O-N 3.11Å; T701-Q704 WeakPolarHBondContact O-CB 3.44Å; T701-Q704 PolarHBondContact O-N 3.31Å; T701-Q704 VanDerWaalsContact OG1-CG 3.27Å; T701-Q704 WeakPolarHBondContact OG1-CG 3.45Å; T701-Q704 PolarHBondContact OG1-N 3.49Å; T701-L705 WeakPolarHBondContact O-CG 3.5Å; T701-L705 PolarHBondContact O-N 3.46Å
702	H	91.2	Very high	89.4	Confident	34 Å²	34	63.3 Å²	63.3	16%	0.157	33%	0.333	C	S	.	.	H	α-helix	trans	-48.8	-50.2	176.5	176.1	73.1	0	0	0	112.3	E683 I688 Q704 L705 M706 Y712	E683-H702 IonicContact OE1-CE1 2.72Å; I688-H702 HydrophobicContact CD1-CB 3.84Å; H702-Q704 VanDerWaalsContact C-N 3.32Å; H702-Q704 PolarHBondContact O-N 2.94Å; H702-L705 PolarHBondContact O-N 3.36Å; H702-M706 WeakPolarHBondContact O-CB 3.47Å; H702-M706 VanDerWaalsContact O-CG 3.3Å; H702-M706 WeakPolarHBondContact O-CG 3.28Å; H702-M706 PolarHBondContact O-N 3.01Å; H702-Y712 AromaticContact ND1-CE1 3.55Å; H702-Y712 AromaticContact ND1-CZ 3.68Å; H702-Y712 PolarHBondContact ND1-OH 3.07Å
703	L	90.9	Very high	89.3	Confident	124 Å²	124	62.5 Å²	62.5	65%	0.649	33%	0.33	S	S	*	.	H	α-helix	trans	-62.5	-35.9	179.3	-65.7	174.3	0	0	0	113.2	T701 K707	T701-L703 VanDerWaalsContact C-N 3.29Å; T701-L703 PolarHBondContact O-N 3.11Å; L703-K707 WeakPolarHBondContact O-CB 3.28Å; L703-K707 VanDerWaalsContact O-CG 3.26Å; L703-K707 WeakPolarHBondContact O-CG 3.45Å; L703-K707 PolarHBondContact O-N 3.29Å
704	Q	91.8	Very high	89.3	Confident	101 Å²	101	58.7 Å²	58.7	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-69.6	-42.8	177.6	-72.7	169.8	-6.8	0	0	111.4	T701 H702 K707 R708	T701-Q704 WeakPolarHBondContact O-CB 3.44Å; T701-Q704 PolarHBondContact O-N 3.31Å; T701-Q704 VanDerWaalsContact OG1-CG 3.27Å; T701-Q704 WeakPolarHBondContact OG1-CG 3.45Å; T701-Q704 PolarHBondContact OG1-N 3.49Å; H702-Q704 VanDerWaalsContact C-N 3.32Å; H702-Q704 PolarHBondContact O-N 2.94Å; Q704-K707 PolarHBondContact O-N 3.11Å; Q704-R708 WeakPolarHBondContact O-CG 3.44Å; Q704-R708 PolarHBondContact O-N 2.91Å; Q704-R708 VanDerWaalsContact O-N 3.09Å
705	L	90.3	Very high	89.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.6	-40.1	-179.7	-65.7	179.6	0	0	0	111.9	I688 E698 T701 H702 K707 R708 G709 Y712	I688-L705 HydrophobicContact CB-CD1 3.78Å; I688-L705 HydrophobicContact CG2-CD1 3.82Å; E698-L705 HydrophobicContact CB-CD2 3.82Å; T701-L705 WeakPolarHBondContact O-CG 3.5Å; T701-L705 PolarHBondContact O-N 3.46Å; H702-L705 PolarHBondContact O-N 3.36Å; L705-K707 VanDerWaalsContact C-N 3.33Å; L705-K707 PolarHBondContact O-N 3.37Å; L705-R708 PolarHBondContact O-N 3.4Å; L705-G709 PolarHBondContact O-N 3.21Å; L705-Y712 HydrophobicContact CB-CD1 3.41Å; L705-Y712 VanDerWaalsContact CB-CD1 3.41Å; L705-Y712 HydrophobicContact CB-CE1 4.01Å; L705-Y712 HydrophobicContact CB-CG 3.93Å; L705-Y712 HydrophobicContact CD1-CD1 4.02Å; L705-Y712 HydrophobicContact CD1-CD2 4.15Å; L705-Y712 HydrophobicContact CD1-CE1 4.41Å; L705-Y712 HydrophobicContact CD1-CG 3.86Å; L705-Y712 HydrophobicContact CG-CD1 4.36Å
706	M	90.3	Very high	89.2	Confident	48 Å²	48	58.7 Å²	58.7	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-63.1	-37.7	174.7	-69.9	-59.5	-74.8	0	0	112.5	H702 G709 Y712 R713 V716	H702-M706 WeakPolarHBondContact O-CB 3.47Å; H702-M706 VanDerWaalsContact O-CG 3.3Å; H702-M706 WeakPolarHBondContact O-CG 3.28Å; H702-M706 PolarHBondContact O-N 3.01Å; M706-G709 PolarHBondContact O-N 2.84Å; M706-Y712 HydrophobicContact CG-CE1 4.26Å; M706-Y712 HydrophobicContact SD-CD1 4.22Å; M706-Y712 HydrophobicContact SD-CE1 4.06Å; M706-R713 HydrophobicContact CE-CG 4.07Å; M706-R713 HydrophobicContact SD-CB 4.1Å; M706-R713 HydrophobicContact SD-CG 4.05Å; M706-V716 HydrophobicContact CE-CG1 4.14Å; M706-V716 HydrophobicContact SD-CB 4.15Å; M706-V716 HydrophobicContact SD-CG1 4.2Å; M706-V716 HydrophobicContact SD-CG2 4.13Å
707	K	90.4	Very high	89	Confident	181 Å²	181	61.3 Å²	61.3	79%	0.787	33%	0.327	S	S	*	.	H	α-helix	trans	-69.3	-34.2	175.4	-76.7	178.5	-178.2	-175.2	0	113.3	L703 Q704 L705 G709	L703-K707 WeakPolarHBondContact O-CB 3.28Å; L703-K707 VanDerWaalsContact O-CG 3.26Å; L703-K707 WeakPolarHBondContact O-CG 3.45Å; L703-K707 PolarHBondContact O-N 3.29Å; Q704-K707 PolarHBondContact O-N 3.11Å; L705-K707 VanDerWaalsContact C-N 3.33Å; L705-K707 PolarHBondContact O-N 3.37Å; K707-G709 PolarHBondContact O-N 3Å
708	R	89.6	Confident	88.8	Confident	163 Å²	163	62.6 Å²	62.6	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-66.5	-24.9	178	-80.5	-179.6	177.9	165.9	2.3	113.2	Q699 Q704 L705 G710	Q699-R708 PolarHBondContact O-NH1 3.48Å; Q704-R708 WeakPolarHBondContact O-CG 3.44Å; Q704-R708 PolarHBondContact O-N 2.91Å; Q704-R708 VanDerWaalsContact O-N 3.09Å; L705-R708 PolarHBondContact O-N 3.4Å; R708-G710 VanDerWaalsContact C-N 3.29Å; R708-G710 PolarHBondContact O-N 3.12Å
709	G	82.6	Confident	88.1	Confident	46 Å²	46	65.9 Å²	65.9	47%	0.474	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	25.7	178.4	0	0	0	0	0	114.3	L705 M706 K707	L705-G709 PolarHBondContact O-N 3.21Å; M706-G709 PolarHBondContact O-N 2.84Å; K707-G709 PolarHBondContact O-N 3Å
710	G	88.8	Confident	87	Confident	23 Å²	23	65.1 Å²	65.1	24%	0.237	36%	0.36	C	S	.	.	S	Bend	trans	-87.3	-159.1	-175.9	0	0	0	0	0	114.9	E698 R708 Y712 R713 A714	E698-G710 WeakPolarHBondContact OE1-CA 3.24Å; R708-G710 VanDerWaalsContact C-N 3.29Å; R708-G710 PolarHBondContact O-N 3.12Å; G710-Y712 VanDerWaalsContact C-N 3.26Å; G710-Y712 PolarHBondContact O-N 2.93Å; G710-R713 PolarHBondContact O-N 2.69Å; G710-A714 PolarHBondContact O-N 3.4Å
711	C	86.1	Confident	85.4	Confident	44 Å²	44	67.6 Å²	67.6	30%	0.297	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-34.4	-180	-60.3	0	0	0	0	112.5	F690 E698 A714 M715	F690-C711 HydrophobicContact CD1-CB 3.94Å; F690-C711 HydrophobicContact CE1-CB 3.32Å; F690-C711 HydrophobicContact CZ-CB 3.72Å; E698-C711 PolarHBondContact OE1-N 2.8Å; C711-A714 PolarHBondContact O-N 2.89Å; C711-M715 PolarHBondContact O-N 3.45Å
712	Y	87.8	Confident	83	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-61.8	-47.3	176.2	176.5	-98.9	0	0	0	111.1	I688 F690 H702 L705 M706 G710 A714 M715 V716	I688-Y712 HydrophobicContact CD1-CE2 4.21Å; I688-Y712 WeakPolarHBondContact CD1-OH 3.37Å; I688-Y712 HydrophobicContact CG2-CD2 4.16Å; I688-Y712 HydrophobicContact CG2-CE2 3.81Å; F690-Y712 HydrophobicContact CD2-CD2 4.21Å; H702-Y712 AromaticContact ND1-CE1 3.55Å; H702-Y712 AromaticContact ND1-CZ 3.68Å; H702-Y712 PolarHBondContact ND1-OH 3.07Å; L705-Y712 HydrophobicContact CB-CD1 3.41Å; L705-Y712 VanDerWaalsContact CB-CD1 3.41Å; L705-Y712 HydrophobicContact CB-CE1 4.01Å; L705-Y712 HydrophobicContact CB-CG 3.93Å; L705-Y712 HydrophobicContact CD1-CD1 4.02Å; L705-Y712 HydrophobicContact CD1-CD2 4.15Å; L705-Y712 HydrophobicContact CD1-CE1 4.41Å; L705-Y712 HydrophobicContact CD1-CG 3.86Å; L705-Y712 HydrophobicContact CG-CD1 4.36Å; M706-Y712 HydrophobicContact CG-CE1 4.26Å; M706-Y712 HydrophobicContact SD-CD1 4.22Å; M706-Y712 HydrophobicContact SD-CE1 4.06Å; G710-Y712 VanDerWaalsContact C-N 3.26Å; G710-Y712 PolarHBondContact O-N 2.93Å; Y712-A714 PolarHBondContact O-N 3.35Å; Y712-M715 HydrophobicContact CD2-CE 3.88Å; Y712-M715 HydrophobicContact CE2-CE 3.91Å; Y712-M715 WeakPolarHBondContact O-CB 3.43Å; Y712-M715 PolarHBondContact O-N 2.98Å; Y712-V716 HydrophobicContact CD1-CG2 4.12Å; Y712-V716 HydrophobicContact CE1-CG2 3.71Å; Y712-V716 HydrophobicContact CE2-CG2 4.25Å; Y712-V716 WeakPolarHBondContact O-CG2 3.45Å; Y712-V716 PolarHBondContact O-N 3.29Å
713	R	88.4	Confident	80.7	Confident	102 Å²	102	73.7 Å²	73.7	39%	0.385	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-44.3	178.2	-179.5	-179.3	175.2	159.4	-6.7	111.5	M706 G710 M715 V716 E717	M706-R713 HydrophobicContact CE-CG 4.07Å; M706-R713 HydrophobicContact SD-CB 4.1Å; M706-R713 HydrophobicContact SD-CG 4.05Å; G710-R713 PolarHBondContact O-N 2.69Å; R713-M715 VanDerWaalsContact C-N 3.26Å; R713-M715 PolarHBondContact O-N 3.27Å; R713-V716 PolarHBondContact O-N 2.97Å; R713-V716 VanDerWaalsContact O-N 3.1Å; R713-E717 HydrophobicContact CG-CG 4.26Å; R713-E717 IonicContact CZ-OE1 3.32Å; R713-E717 VanDerWaalsContact CZ-OE1 3.32Å; R713-E717 IonicContact NE-OE1 2.69Å; R713-E717 PolarHBondContact NE-OE1 3.36Å; R713-E717 IonicContact NH2-OE1 2.99Å; R713-E717 PolarHBondContact NH2-OE1 3.4Å; R713-E717 WeakPolarHBondContact O-CG 3.28Å; R713-E717 PolarHBondContact O-N 3.25Å
714	A	86.9	Confident	78	Confident	56 Å²	56	78.4 Å²	78.4	46%	0.463	46%	0.459	S	S	.	.	H	α-helix	trans	-58.6	-39.1	177.3	0	0	0	0	0	112.1	G710 C711 Y712 A718	G710-A714 PolarHBondContact O-N 3.4Å; C711-A714 PolarHBondContact O-N 2.89Å; Y712-A714 PolarHBondContact O-N 3.35Å; A714-A718 VanDerWaalsContact O-CB 3.26Å; A714-A718 WeakPolarHBondContact O-CB 3.32Å; A714-A718 PolarHBondContact O-N 3.49Å
715	M	86.2	Confident	77.3	Confident	37 Å²	37	77.3 Å²	77.3	18%	0.182	46%	0.458	C	S	.	.	H	α-helix	trans	-66.8	-42.1	174.1	179.1	-164.6	74.6	0	0	112	V513 F690 C711 Y712 R713 A718 L719	V513-M715 HydrophobicContact CB-CE 4.15Å; V513-M715 HydrophobicContact CG1-CE 3.32Å; V513-M715 HydrophobicContact CG1-SD 3.54Å; V513-M715 VanDerWaalsContact CG1-SD 3.54Å; F690-M715 HydrophobicContact CD2-SD 4.39Å; F690-M715 HydrophobicContact CE2-CB 4.24Å; F690-M715 HydrophobicContact CE2-CE 4.39Å; F690-M715 HydrophobicContact CE2-SD 3.74Å; C711-M715 PolarHBondContact O-N 3.45Å; Y712-M715 HydrophobicContact CD2-CE 3.88Å; Y712-M715 HydrophobicContact CE2-CE 3.91Å; Y712-M715 WeakPolarHBondContact O-CB 3.43Å; Y712-M715 PolarHBondContact O-N 2.98Å; R713-M715 VanDerWaalsContact C-N 3.26Å; R713-M715 PolarHBondContact O-N 3.27Å; M715-A718 PolarHBondContact O-N 3.4Å; M715-L719 HydrophobicContact CG-CD1 3.95Å; M715-L719 WeakPolarHBondContact O-CB 3.14Å; M715-L719 VanDerWaalsContact O-CG 3.3Å; M715-L719 WeakPolarHBondContact O-CG 3.5Å; M715-L719 PolarHBondContact O-N 3.11Å
716	V	86.8	Confident	76.6	Confident	10 Å²	10	81.4 Å²	81.4	6%	0.061	48%	0.482	C	S	.	.	H	α-helix	trans	-62.5	-45.7	176.7	175.3	0	0	0	0	111.1	L679 M706 Y712 R713 L719 A720	L679-V716 HydrophobicContact CD1-CB 4.28Å; L679-V716 HydrophobicContact CD1-CG1 3.96Å; L679-V716 HydrophobicContact CD1-CG2 3.61Å; L679-V716 HydrophobicContact CD2-CG1 3.88Å; M706-V716 HydrophobicContact CE-CG1 4.14Å; M706-V716 HydrophobicContact SD-CB 4.15Å; M706-V716 HydrophobicContact SD-CG1 4.2Å; M706-V716 HydrophobicContact SD-CG2 4.13Å; Y712-V716 HydrophobicContact CD1-CG2 4.12Å; Y712-V716 HydrophobicContact CE1-CG2 3.71Å; Y712-V716 HydrophobicContact CE2-CG2 4.25Å; Y712-V716 WeakPolarHBondContact O-CG2 3.45Å; Y712-V716 PolarHBondContact O-N 3.29Å; R713-V716 PolarHBondContact O-N 2.97Å; R713-V716 VanDerWaalsContact O-N 3.1Å; V716-L719 PolarHBondContact O-N 3.24Å; V716-A720 VanDerWaalsContact O-CB 3.28Å; V716-A720 WeakPolarHBondContact O-CB 3.38Å; V716-A720 PolarHBondContact O-N 3.41Å
717	E	86.1	Confident	75.9	Confident	95 Å²	95	83.2 Å²	83.2	44%	0.444	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-40.2	177.9	-72.1	175.9	168.9	0	0	111.7	R713 L719 A720 A721	R713-E717 HydrophobicContact CG-CG 4.26Å; R713-E717 IonicContact CZ-OE1 3.32Å; R713-E717 VanDerWaalsContact CZ-OE1 3.32Å; R713-E717 IonicContact NE-OE1 2.69Å; R713-E717 PolarHBondContact NE-OE1 3.36Å; R713-E717 IonicContact NH2-OE1 2.99Å; R713-E717 PolarHBondContact NH2-OE1 3.4Å; R713-E717 WeakPolarHBondContact O-CG 3.28Å; R713-E717 PolarHBondContact O-N 3.25Å; E717-L719 VanDerWaalsContact C-N 3.35Å; E717-L719 PolarHBondContact O-N 3.2Å; E717-A720 PolarHBondContact O-N 2.88Å; E717-A721 PolarHBondContact O-N 3.31Å
718	A	82.7	Confident	75	Confident	73 Å²	73	77.5 Å²	77.5	60%	0.603	48%	0.479	S	S	*	.	H	α-helix	trans	-66.1	-34.4	175.6	0	0	0	0	0	113.1	A714 M715	A714-A718 VanDerWaalsContact O-CB 3.26Å; A714-A718 WeakPolarHBondContact O-CB 3.32Å; A714-A718 PolarHBondContact O-N 3.49Å; M715-A718 PolarHBondContact O-N 3.4Å
719	L	75.2	Confident	74.1	Confident	102 Å²	102	72.1 Å²	72.1	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-78	-24.2	175.4	-72.7	167.6	0	0	0	112.9	M715 V716 E717	M715-L719 HydrophobicContact CG-CD1 3.95Å; M715-L719 WeakPolarHBondContact O-CB 3.14Å; M715-L719 VanDerWaalsContact O-CG 3.3Å; M715-L719 WeakPolarHBondContact O-CG 3.5Å; M715-L719 PolarHBondContact O-N 3.11Å; V716-L719 PolarHBondContact O-N 3.24Å; E717-L719 VanDerWaalsContact C-N 3.35Å; E717-L719 PolarHBondContact O-N 3.2Å
720	A	69.9	Low	73.5	Confident	74 Å²	74	73.9 Å²	73.9	61%	0.612	47%	0.47	S	S	*	.	H	α-helix	trans	-88.6	-18.1	177.6	0	0	0	0	0	113.2	V716 E717	V716-A720 VanDerWaalsContact O-CB 3.28Å; V716-A720 WeakPolarHBondContact O-CB 3.38Å; V716-A720 PolarHBondContact O-N 3.41Å; E717-A720 PolarHBondContact O-N 2.88Å
721	A	58.8	Low	72.5	Confident	57 Å²	57	77.5 Å²	77.5	47%	0.471	49%	0.486	S	S	.	.	S	Bend	trans	-66.3	132.3	173.4	0	0	0	0	0	109.9	E717 A723	E717-A721 PolarHBondContact O-N 3.31Å; A721-A723 PolarHBondContact O-N 3.27Å
722	P	41.9	Very low	71.4	Confident	106 Å²	106	80.1 Å²	80.1	69%	0.688	50%	0.501	S	S	*	.			trans	-58.5	133.8	173.2	24.8	-31.6	0	0	0	109	D724	P722-D724 PolarHBondContact O-N 2.95Å
723	A	42.5	Very low	70	Confident	106 Å²	106	86.8 Å²	86.8	88%	0.876	54%	0.543	S	S	*	.			trans	-67.7	101.7	168.6	0	0	0	0	0	107.4	A721	A721-A723 PolarHBondContact O-N 3.27Å
724	D	35.3	Very low	68.4	Low	223 Å²	223	85.4 Å²	85.4	100%	1.193	56%	0.557	S	S	*	*			trans	-63.8	0	173.2	-76.6	-23	0	0	0	112.2	P722	P722-D724 PolarHBondContact O-N 2.95Å

Retrieved 724 of 724 residues in 261.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).