A0A023IKJ0_RAT 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 A0A023IKJ0, Species RAT (Rattus norvegicus, Rat), Gene Tap2, Length 725 aa.

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(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	33.1	Very low	47.9	Very low	231 Å²	231	87.2 Å²	87.2	100%	1.138	51%	0.509	S	S	*	.				0	-23	0	-75.7	175.4	112.1	0	0	114.6	A3	M1-A3 PolarHBondContact O-N 2.94Å
2	A	37	Very low	49.1	Very low	58 Å²	58	89.3 Å²	89.3	48%	0.479	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-62.6	-39	178.8	0	0	0	0	0	114	H4 A5 W69	A2-H4 PolarHBondContact O-N 3.3Å; A2-A5 WeakPolarHBondContact O-CB 3.5Å; A2-A5 PolarHBondContact O-N 3.2Å; A2-W69 HydrophobicContact CB-CE3 4.33Å; A2-W69 HydrophobicContact CB-CH2 3.49Å; A2-W69 VanDerWaalsContact CB-CH2 3.49Å; A2-W69 HydrophobicContact CB-CZ2 4Å; A2-W69 HydrophobicContact CB-CZ3 3.75Å; A2-W69 WeakPolarHBondContact O-CZ3 3.27Å
3	A	37.3	Very low	50.3	Low	69 Å²	69	84.7 Å²	84.7	57%	0.57	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-51.9	-26.2	-171.1	0	0	0	0	0	116.8	M1 W69	M1-A3 PolarHBondContact O-N 2.94Å; A3-W69 VanDerWaalsContact CA-CH2 3.43Å; A3-W69 HydrophobicContact CB-CH2 4.27Å; A3-W69 VanDerWaalsContact N-CH2 3.31Å; A3-W69 VanDerWaalsContact N-CZ3 3.34Å
4	H	39.3	Very low	51.1	Low	154 Å²	154	81.6 Å²	81.6	71%	0.713	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-97.9	-3.6	-178.5	-66	-61.4	0	0	0	114.4	A2 T8	A2-H4 PolarHBondContact O-N 3.3Å; H4-T8 PolarHBondContact O-OG1 3.2Å
5	A	47.8	Very low	51.9	Low	53 Å²	53	81 Å²	81	44%	0.438	46%	0.462	S	S	.	.	H	α-helix	trans	-81.4	-26.9	-178.8	0	0	0	0	0	113.7	A2 T8 A9	A2-A5 WeakPolarHBondContact O-CB 3.5Å; A2-A5 PolarHBondContact O-N 3.2Å; A5-T8 WeakPolarHBondContact CA-OG1 3.12Å; A5-T8 PolarHBondContact O-OG1 3Å; A5-A9 VanDerWaalsContact O-CB 3.31Å; A5-A9 WeakPolarHBondContact O-CB 3.25Å; A5-A9 PolarHBondContact O-N 3.35Å; A5-A9 VanDerWaalsContact O-N 3.08Å
6	W	51.6	Low	52.7	Low	82 Å²	82	79.5 Å²	79.5	31%	0.311	46%	0.455	S	S	.	.	H	α-helix	trans	-67.5	-49.8	178.4	-175.7	67.6	0	0	0	114.1	T8 A9 A10 W69	W6-T8 VanDerWaalsContact C-N 3.3Å; W6-T8 PolarHBondContact O-N 3.47Å; W6-A9 PolarHBondContact O-N 3.32Å; W6-A10 WeakPolarHBondContact O-CB 3.47Å; W6-A10 PolarHBondContact O-N 3.2Å; W6-W69 HydrophobicContact CB-CE3 4.28Å
7	P	53.1	Low	53.4	Low	62 Å²	62	74.8 Å²	74.8	40%	0.403	43%	0.428	S	S	.	.	H	α-helix	trans	-65.8	-34.9	179.5	24.2	-33.2	0	0	0	112	L11	P7-L11 VanDerWaalsContact O-CB 3.24Å; P7-L11 WeakPolarHBondContact O-CB 3.27Å; P7-L11 PolarHBondContact O-N 2.99Å
8	T	53	Low	53.8	Low	89 Å²	89	78.2 Å²	78.2	55%	0.546	43%	0.433	S	S	.	.	H	α-helix	trans	-69.9	-43.2	179	46.2	0	0	0	0	112.1	H4 A5 W6 L11 L12	H4-T8 PolarHBondContact O-OG1 3.2Å; A5-T8 WeakPolarHBondContact CA-OG1 3.12Å; A5-T8 PolarHBondContact O-OG1 3Å; W6-T8 VanDerWaalsContact C-N 3.3Å; W6-T8 PolarHBondContact O-N 3.47Å; T8-L11 PolarHBondContact O-N 3Å; T8-L12 WeakPolarHBondContact O-CB 3.36Å; T8-L12 PolarHBondContact O-N 3.31Å
9	A	57.5	Low	54.1	Low	38 Å²	38	80.1 Å²	80.1	31%	0.314	44%	0.442	S	S	.	.	H	α-helix	trans	-67.4	-38.6	175.1	0	0	0	0	0	113	A5 W6 L12 L13 L73	A5-A9 VanDerWaalsContact O-CB 3.31Å; A5-A9 WeakPolarHBondContact O-CB 3.25Å; A5-A9 PolarHBondContact O-N 3.35Å; A5-A9 VanDerWaalsContact O-N 3.08Å; W6-A9 PolarHBondContact O-N 3.32Å; A9-L12 PolarHBondContact O-N 2.89Å; A9-L13 PolarHBondContact O-N 3.13Å; A9-L73 HydrophobicContact CB-CD1 4.31Å
10	A	57.5	Low	54.4	Low	13 Å²	13	81.8 Å²	81.8	11%	0.107	45%	0.449	C	S	.	.	H	α-helix	trans	-63.8	-42.7	173.7	0	0	0	0	0	111.5	W6 L12 L13 L14 L73	W6-A10 WeakPolarHBondContact O-CB 3.47Å; W6-A10 PolarHBondContact O-N 3.2Å; A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 2.81Å; A10-L13 PolarHBondContact O-N 3Å; A10-L14 WeakPolarHBondContact O-CD1 3.35Å; A10-L14 WeakPolarHBondContact O-CG 3.5Å; A10-L14 PolarHBondContact O-N 3.49Å; A10-L73 HydrophobicContact CB-CD2 4.06Å
11	L	59.3	Low	54.7	Low	110 Å²	110	78.8 Å²	78.8	58%	0.576	43%	0.433	S	S	*	.	H	α-helix	trans	-65.7	-36	178.6	-150.7	126	0	0	0	112.1	P7 T8 L14 L15	P7-L11 VanDerWaalsContact O-CB 3.24Å; P7-L11 WeakPolarHBondContact O-CB 3.27Å; P7-L11 PolarHBondContact O-N 2.99Å; T8-L11 PolarHBondContact O-N 3Å; L11-L14 PolarHBondContact O-N 2.95Å; L11-L15 HydrophobicContact CD2-CD1 3.94Å; L11-L15 WeakPolarHBondContact O-CB 3.27Å; L11-L15 PolarHBondContact O-N 3.22Å
12	L	62.7	Low	56	Low	113 Å²	113	72.4 Å²	72.4	59%	0.592	40%	0.396	S	S	*	.	H	α-helix	trans	-70.3	-39.4	177.1	-147.5	149.1	0	0	0	111.7	T8 A9 A10 L15 V16	T8-L12 WeakPolarHBondContact O-CB 3.36Å; T8-L12 PolarHBondContact O-N 3.31Å; A9-L12 PolarHBondContact O-N 2.89Å; A10-L12 VanDerWaalsContact C-N 3.32Å; A10-L12 PolarHBondContact O-N 2.81Å; L12-L15 PolarHBondContact O-N 3.46Å; L12-V16 HydrophobicContact CD2-CG2 4.17Å; L12-V16 VanDerWaalsContact O-CG2 3.29Å; L12-V16 WeakPolarHBondContact O-CG2 3.25Å; L12-V16 PolarHBondContact O-N 3.41Å
13	L	64.3	Low	57	Low	29 Å²	29	73.6 Å²	73.6	15%	0.152	40%	0.399	C	S	.	.	H	α-helix	trans	-62.4	-42.9	170.7	-93.1	155.8	0	0	0	112.5	A9 A10 L15 V16 D17 L52 V56 L73	A9-L13 PolarHBondContact O-N 3.13Å; A10-L13 PolarHBondContact O-N 3Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-V16 PolarHBondContact O-N 3.42Å; L13-D17 VanDerWaalsContact O-CB 3.27Å; L13-D17 WeakPolarHBondContact O-CB 3.4Å; L13-D17 PolarHBondContact O-N 2.86Å; L13-L52 HydrophobicContact CD2-CD2 3.87Å; L13-V56 HydrophobicContact CD1-CG2 3.8Å; L13-V56 HydrophobicContact CD2-CG2 3.98Å; L13-V56 HydrophobicContact CG-CG2 4.5Å; L13-L73 HydrophobicContact CD1-CD1 4.11Å; L13-L73 HydrophobicContact CD1-CD2 4.22Å
14	L	61.5	Low	58.1	Low	42 Å²	42	74 Å²	74	22%	0.22	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-37.4	176.7	-65	165	0	0	0	111.2	A10 L11 W18 L80 Y121	A10-L14 WeakPolarHBondContact O-CD1 3.35Å; A10-L14 WeakPolarHBondContact O-CG 3.5Å; A10-L14 PolarHBondContact O-N 3.49Å; L11-L14 PolarHBondContact O-N 2.95Å; L14-W18 WeakPolarHBondContact O-CB 3.26Å; L14-W18 PolarHBondContact O-N 3.36Å; L14-L80 HydrophobicContact CD2-CD1 3.91Å; L14-L80 HydrophobicContact CD2-CD2 4.35Å; L14-Y121 HydrophobicContact CB-CE1 4.38Å; L14-Y121 HydrophobicContact CD2-CD1 3.81Å; L14-Y121 HydrophobicContact CD2-CE1 3.26Å; L14-Y121 HydrophobicContact CG-CE1 4.31Å
15	L	64.3	Low	59.3	Low	72 Å²	72	67.4 Å²	67.4	38%	0.377	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-45.3	174.5	-91.2	159.8	0	0	0	112.7	L11 L12 L13 D17 W18 L19	L11-L15 HydrophobicContact CD2-CD1 3.94Å; L11-L15 WeakPolarHBondContact O-CB 3.27Å; L11-L15 PolarHBondContact O-N 3.22Å; L12-L15 PolarHBondContact O-N 3.46Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L15-D17 VanDerWaalsContact C-N 3.35Å; L15-W18 HydrophobicContact CD2-CE3 4.3Å; L15-W18 PolarHBondContact O-N 3.36Å; L15-L19 HydrophobicContact CD2-CD1 3.85Å; L15-L19 WeakPolarHBondContact O-CB 3.43Å; L15-L19 PolarHBondContact O-N 3.19Å
16	V	64.6	Low	59.9	Low	57 Å²	57	66.7 Å²	66.7	35%	0.345	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-41.8	178	169.3	0	0	0	0	111.1	L12 L13 W18 L20	L12-V16 HydrophobicContact CD2-CG2 4.17Å; L12-V16 VanDerWaalsContact O-CG2 3.29Å; L12-V16 WeakPolarHBondContact O-CG2 3.25Å; L12-V16 PolarHBondContact O-N 3.41Å; L13-V16 PolarHBondContact O-N 3.42Å; V16-W18 VanDerWaalsContact C-N 3.3Å; V16-W18 PolarHBondContact O-N 3.33Å; V16-L20 HydrophobicContact CG1-CD1 4.42Å; V16-L20 PolarHBondContact O-N 3.34Å; V16-L20 VanDerWaalsContact O-N 3.09Å
17	D	64.7	Low	60.2	Low	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.358	C	S	.	.	I	π-helix	trans	-63.2	-37.2	174.6	-171.7	42.3	0	0	0	112.2	L13 L15 R22 R48 L52 Y121	L13-D17 VanDerWaalsContact O-CB 3.27Å; L13-D17 WeakPolarHBondContact O-CB 3.4Å; L13-D17 PolarHBondContact O-N 2.86Å; L15-D17 VanDerWaalsContact C-N 3.35Å; D17-R22 WeakPolarHBondContact O-CB 3.47Å; D17-R22 PolarHBondContact O-N 2.84Å; D17-R48 IonicContact OD1-CZ 3.55Å; D17-R48 IonicContact OD1-NE 3.32Å; D17-R48 PolarHBondContact OD1-NE 2.83Å; D17-R48 IonicContact OD1-NH2 2.69Å; D17-R48 PolarHBondContact OD1-NH2 3.32Å; D17-R48 IonicContact OD2-CZ 3.71Å; D17-R48 IonicContact OD2-NE 3.18Å; D17-R48 IonicContact OD2-NH2 3.76Å; D17-R48 PolarHBondContact OD2-NH2 2.79Å; D17-L52 HydrophobicContact CB-CD1 4.46Å; D17-L52 HydrophobicContact CB-CD2 4.3Å; D17-Y121 PolarHBondContact OD2-OH 2.92Å
18	W	60.3	Low	60.7	Low	136 Å²	136	65.8 Å²	65.8	52%	0.515	36%	0.36	S	S	.	.	I	π-helix	trans	-78.8	-35.1	-177.7	-169.6	50.3	0	0	0	114.4	L14 L15 V16 R22	L14-W18 WeakPolarHBondContact O-CB 3.26Å; L14-W18 PolarHBondContact O-N 3.36Å; L15-W18 HydrophobicContact CD2-CE3 4.3Å; L15-W18 PolarHBondContact O-N 3.36Å; V16-W18 VanDerWaalsContact C-N 3.3Å; V16-W18 PolarHBondContact O-N 3.33Å; W18-R22 WeakPolarHBondContact O-CB 3.36Å; W18-R22 VanDerWaalsContact O-CD 3.28Å; W18-R22 WeakPolarHBondContact O-CD 3.23Å
19	L	59.6	Low	61	Low	114 Å²	114	63.8 Å²	63.8	60%	0.597	34%	0.344	S	S	*	.	I	π-helix	trans	-91.8	-40.7	-176.6	-93.4	141.3	0	0	0	114.1	L15 P23	L15-L19 HydrophobicContact CD2-CD1 3.85Å; L15-L19 WeakPolarHBondContact O-CB 3.43Å; L15-L19 PolarHBondContact O-N 3.19Å; L19-P23 WeakPolarHBondContact O-CD 3.48Å; L19-P23 WeakPolarHBondContact O-CG 3.27Å
20	L	58.8	Low	61	Low	114 Å²	114	64.6 Å²	64.6	60%	0.597	35%	0.347	S	S	*	.	I	π-helix	trans	-105.1	-49.5	-168.9	-78.7	160.7	0	0	0	113.3	V16 V24	V16-L20 HydrophobicContact CG1-CD1 4.42Å; V16-L20 PolarHBondContact O-N 3.34Å; V16-L20 VanDerWaalsContact O-N 3.09Å; L20-V24 WeakPolarHBondContact O-CB 3.48Å; L20-V24 WeakPolarHBondContact O-CG2 3.32Å
21	L	62.1	Low	61	Low	18 Å²	18	71.1 Å²	71.1	9%	0.094	38%	0.38	C	S	.	.	I	π-helix	trans	-76.8	-31.2	-174.6	-75.4	152	0	0	0	112.2	L25 I51 L52	L21-L25 HydrophobicContact CB-CD1 4.15Å; L21-L25 HydrophobicContact CD2-CD1 3.32Å; L21-L25 HydrophobicContact CD2-CG 4.22Å; L21-L25 HydrophobicContact CG-CD1 4.37Å; L21-L25 PolarHBondContact O-N 2.83Å; L21-I51 HydrophobicContact CD1-CG2 4.36Å; L21-I51 HydrophobicContact CD2-CB 4.07Å; L21-I51 HydrophobicContact CD2-CD1 3.71Å; L21-I51 HydrophobicContact CD2-CG2 3.85Å; L21-L52 HydrophobicContact CD1-CD2 3.64Å; L21-L52 HydrophobicContact CD1-CG 3.88Å
22	R	59.3	Low	61	Low	98 Å²	98	71.9 Å²	71.9	37%	0.37	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-48	-178.5	179.6	-176.1	-173.4	-150.9	-1.2	115	D17 W18	D17-R22 WeakPolarHBondContact O-CB 3.47Å; D17-R22 PolarHBondContact O-N 2.84Å; W18-R22 WeakPolarHBondContact O-CB 3.36Å; W18-R22 VanDerWaalsContact O-CD 3.28Å; W18-R22 WeakPolarHBondContact O-CD 3.23Å
23	P	59	Low	60.7	Low	83 Å²	83	68.3 Å²	68.3	54%	0.539	37%	0.367	S	S	.	.	H	α-helix	trans	-86.4	-30.5	-179.5	28.4	-31.4	0	0	0	114.1	L19	L19-P23 WeakPolarHBondContact O-CD 3.48Å; L19-P23 WeakPolarHBondContact O-CG 3.27Å
24	V	59.7	Low	60.2	Low	78 Å²	78	72 Å²	72	47%	0.473	39%	0.392	S	S	.	.	H	α-helix	trans	-85.5	-43.7	-166.1	179	0	0	0	0	113	L20 G27 I28	L20-V24 WeakPolarHBondContact O-CB 3.48Å; L20-V24 WeakPolarHBondContact O-CG2 3.32Å; V24-G27 PolarHBondContact O-N 2.82Å; V24-I28 HydrophobicContact CG1-CD1 3.57Å; V24-I28 HydrophobicContact CG1-CG1 4.32Å; V24-I28 WeakPolarHBondContact O-CG1 3.29Å; V24-I28 PolarHBondContact O-N 2.95Å
25	L	64.8	Low	59.8	Low	15 Å²	15	78.5 Å²	78.5	8%	0.079	42%	0.421	C	S	.	.	H	α-helix	trans	-64.2	-43.1	-174.7	-84.7	165.2	0	0	0	114.6	L21 G27 I28 F29 V44 R48 I51	L21-L25 HydrophobicContact CB-CD1 4.15Å; L21-L25 HydrophobicContact CD2-CD1 3.32Å; L21-L25 HydrophobicContact CD2-CG 4.22Å; L21-L25 HydrophobicContact CG-CD1 4.37Å; L21-L25 PolarHBondContact O-N 2.83Å; L25-G27 VanDerWaalsContact C-N 3.29Å; L25-G27 PolarHBondContact O-N 3.03Å; L25-I28 PolarHBondContact O-N 2.65Å; L25-F29 HydrophobicContact CD2-CD2 4.17Å; L25-F29 HydrophobicContact CD2-CE2 3.87Å; L25-F29 WeakPolarHBondContact O-CD2 3.27Å; L25-F29 PolarHBondContact O-N 2.76Å; L25-F29 VanDerWaalsContact O-N 3.12Å; L25-V44 HydrophobicContact CB-CG1 4.33Å; L25-R48 HydrophobicContact CD1-CB 4.17Å; L25-I51 HydrophobicContact CD1-CD1 4.3Å; L25-I51 HydrophobicContact CD2-CD1 4.24Å
26	P	59.9	Low	59.7	Low	38 Å²	38	78.4 Å²	78.4	25%	0.247	42%	0.424	C	S	.	.	H	α-helix	trans	-65	-34.2	178.5	-20.2	33	0	0	0	112.5	S30	P26-S30 VanDerWaalsContact O-CB 3.26Å; P26-S30 WeakPolarHBondContact O-CB 3.06Å; P26-S30 PolarHBondContact O-N 2.79Å
27	G	59	Low	59.5	Low	37 Å²	37	78.1 Å²	78.1	38%	0.381	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-46.1	176.5	0	0	0	0	0	112.3	V24 L25 S30	V24-G27 PolarHBondContact O-N 2.82Å; L25-G27 VanDerWaalsContact C-N 3.29Å; L25-G27 PolarHBondContact O-N 3.03Å; G27-S30 PolarHBondContact O-N 2.83Å; G27-S30 PolarHBondContact O-OG 3.44Å
28	I	61.9	Low	59.4	Low	87 Å²	87	80.5 Å²	80.5	45%	0.446	44%	0.435	S	S	.	.	H	α-helix	trans	-64.9	-46.7	179.3	-64.4	170.4	0	0	0	111.6	V24 L25 S30 L31 L32	V24-I28 HydrophobicContact CG1-CD1 3.57Å; V24-I28 HydrophobicContact CG1-CG1 4.32Å; V24-I28 WeakPolarHBondContact O-CG1 3.29Å; V24-I28 PolarHBondContact O-N 2.95Å; L25-I28 PolarHBondContact O-N 2.65Å; I28-S30 PolarHBondContact O-N 3.29Å; I28-L31 PolarHBondContact O-N 3.27Å; I28-L32 HydrophobicContact CG2-CD1 4.31Å
29	F	59.6	Low	59.5	Low	48 Å²	48	79.1 Å²	79.1	21%	0.211	44%	0.438	C	S	.	.	H	α-helix	trans	-76.3	-11.7	-179.7	-81.1	-81.2	0	0	0	113.7	L25 L31 V33 R40 A43 V44	L25-F29 HydrophobicContact CD2-CD2 4.17Å; L25-F29 HydrophobicContact CD2-CE2 3.87Å; L25-F29 WeakPolarHBondContact O-CD2 3.27Å; L25-F29 PolarHBondContact O-N 2.76Å; L25-F29 VanDerWaalsContact O-N 3.12Å; F29-L31 VanDerWaalsContact C-N 3.32Å; F29-V33 PolarHBondContact O-N 3Å; F29-R40 HydrophobicContact CB-CG 4.46Å; F29-R40 PolarHBondContact O-NE 3.35Å; F29-A43 HydrophobicContact CD1-CB 4.04Å; F29-A43 HydrophobicContact CE1-CB 3.98Å; F29-V44 HydrophobicContact CB-CG2 3.86Å; F29-V44 HydrophobicContact CD2-CG2 4.05Å; F29-V44 HydrophobicContact CG-CG2 4.09Å
30	S	58.4	Low	59.8	Low	54 Å²	54	76 Å²	76	38%	0.378	42%	0.418	S	S	.	.	H	α-helix	trans	-71.8	-26.1	171.5	75.4	0	0	0	0	113.7	P26 G27 I28 R40	P26-S30 VanDerWaalsContact O-CB 3.26Å; P26-S30 WeakPolarHBondContact O-CB 3.06Å; P26-S30 PolarHBondContact O-N 2.79Å; G27-S30 PolarHBondContact O-N 2.83Å; G27-S30 PolarHBondContact O-OG 3.44Å; I28-S30 PolarHBondContact O-N 3.29Å; S30-R40 PolarHBondContact O-NH2 3.04Å
31	L	58.2	Low	60.1	Low	151 Å²	151	72.4 Å²	72.4	79%	0.791	40%	0.401	S	S	*	.	H	α-helix	trans	-85.2	-29.8	176.2	-98	139.5	0	0	0	113.3	I28 F29	I28-L31 PolarHBondContact O-N 3.27Å; F29-L31 VanDerWaalsContact C-N 3.32Å
32	L	57.6	Low	60.4	Low	126 Å²	126	76.2 Å²	76.2	66%	0.66	41%	0.414	S	S	*	.	H	α-helix	trans	-89.6	-26.6	-171.7	-105.1	123.2	0	0	0	115.3	I28	I28-L32 HydrophobicContact CG2-CD1 4.31Å
33	V	56.8	Low	60.7	Low	38 Å²	38	72.9 Å²	72.9	23%	0.23	41%	0.408	C	S	.	.			trans	-136.3	91.4	-175.4	-175.3	0	0	0	0	109.9	F29 L39 R40	F29-V33 PolarHBondContact O-N 3Å; V33-L39 HydrophobicContact CG1-CD2 4.13Å; V33-R40 PolarHBondContact O-NE 3.14Å; V33-R40 PolarHBondContact O-NH2 2.74Å
34	P	54.4	Low	61.2	Low	105 Å²	105	69.9 Å²	69.9	68%	0.682	39%	0.388	S	S	*	.			trans	-81.2	-28.7	-172.3	23.8	-26.5	0	0	0	115.1
35	E	51.8	Low	61.6	Low	179 Å²	179	66.4 Å²	66.4	84%	0.836	37%	0.368	S	S	*	.	S	Bend	trans	-102.2	-11.2	-161	-62.3	-160.7	159.7	0	0	117.2
36	V	63.5	Low	61.8	Low	70 Å²	70	69.4 Å²	69.4	42%	0.424	38%	0.383	S	S	.	.			trans	-131.8	106.5	-176.8	-166.4	0	0	0	0	113.1	L38 L39 R40	V36-L38 PolarHBondContact O-N 2.61Å; V36-L39 HydrophobicContact CB-CB 4.07Å; V36-L39 HydrophobicContact CG1-CB 4.1Å; V36-L39 PolarHBondContact O-N 3.03Å; V36-R40 PolarHBondContact O-N 3.22Å
37	P	60.8	Low	62.2	Low	52 Å²	52	68.6 Å²	68.6	34%	0.338	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-28.8	-172.8	23.9	-32.6	0	0	0	114.2	V41	P37-V41 WeakPolarHBondContact O-CG2 3.21Å; P37-V41 PolarHBondContact O-N 3.3Å
38	L	61	Low	62.8	Low	49 Å²	49	67.9 Å²	67.9	26%	0.257	36%	0.364	S	S	.	.	H	α-helix	trans	-72.6	-40.4	179.7	-129.7	173.6	0	0	0	111.5	V36 R40 V41 W42 S89 K92	V36-L38 PolarHBondContact O-N 2.61Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.32Å; L38-V41 PolarHBondContact O-N 3.37Å; L38-W42 PolarHBondContact O-N 3.13Å; L38-W42 VanDerWaalsContact O-N 3.17Å; L38-S89 WeakPolarHBondContact CD2-OG 3.3Å; L38-K92 HydrophobicContact CD1-CB 4.12Å; L38-K92 HydrophobicContact CD1-CD 3.42Å; L38-K92 VanDerWaalsContact CD1-CD 3.42Å; L38-K92 HydrophobicContact CD1-CG 3.95Å; L38-K92 HydrophobicContact CG-CD 3.91Å
39	L	63.2	Low	63.3	Low	107 Å²	107	69.2 Å²	69.2	56%	0.56	36%	0.364	S	S	*	.	H	α-helix	trans	-64.2	-37.8	176.9	-157.3	88.9	0	0	0	110.6	V33 V36 V41 W42 A43	V33-L39 HydrophobicContact CG1-CD2 4.13Å; V36-L39 HydrophobicContact CB-CB 4.07Å; V36-L39 HydrophobicContact CG1-CB 4.1Å; V36-L39 PolarHBondContact O-N 3.03Å; L39-V41 PolarHBondContact O-N 3.16Å; L39-W42 PolarHBondContact O-N 3.28Å; L39-A43 VanDerWaalsContact O-CB 3.32Å; L39-A43 WeakPolarHBondContact O-CB 3.46Å; L39-A43 PolarHBondContact O-N 2.74Å
40	R	65.8	Low	63.7	Low	48 Å²	48	69 Å²	69	18%	0.181	37%	0.371	C	S	.	.	H	α-helix	trans	-61.8	-42.4	176.1	-167.3	-176.8	-79.1	-171	-7.4	112.1	F29 S30 V33 V36 L38 A43 V44	F29-R40 HydrophobicContact CB-CG 4.46Å; F29-R40 PolarHBondContact O-NE 3.35Å; S30-R40 PolarHBondContact O-NH2 3.04Å; V33-R40 PolarHBondContact O-NE 3.14Å; V33-R40 PolarHBondContact O-NH2 2.74Å; V36-R40 PolarHBondContact O-N 3.22Å; L38-R40 VanDerWaalsContact C-N 3.29Å; L38-R40 PolarHBondContact O-N 3.32Å; R40-A43 PolarHBondContact O-N 3.32Å; R40-V44 WeakPolarHBondContact O-CB 3.11Å; R40-V44 VanDerWaalsContact O-CG2 3.26Å; R40-V44 WeakPolarHBondContact O-CG2 3.29Å; R40-V44 PolarHBondContact O-N 3.27Å
41	V	65.8	Low	64.4	Low	39 Å²	39	70.3 Å²	70.3	24%	0.236	37%	0.373	C	S	.	.	H	α-helix	trans	-68	-39.9	178.3	-179.4	0	0	0	0	111.5	P37 L38 L39 G45 P85 A88	P37-V41 WeakPolarHBondContact O-CG2 3.21Å; P37-V41 PolarHBondContact O-N 3.3Å; L38-V41 PolarHBondContact O-N 3.37Å; L39-V41 PolarHBondContact O-N 3.16Å; V41-G45 PolarHBondContact O-N 3.1Å; V41-P85 HydrophobicContact CG1-CB 4.3Å; V41-P85 HydrophobicContact CG1-CG 4.45Å; V41-A88 HydrophobicContact CG1-CB 3.87Å
42	W	66.8	Low	64.9	Low	98 Å²	98	63.4 Å²	63.4	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-42.2	174.5	-86.9	95.4	0	0	0	112.9	L38 L39 V44 G45 L46 L82 P85 S89	L38-W42 PolarHBondContact O-N 3.13Å; L38-W42 VanDerWaalsContact O-N 3.17Å; L39-W42 PolarHBondContact O-N 3.28Å; W42-V44 VanDerWaalsContact C-N 3.34Å; W42-V44 PolarHBondContact O-N 3.25Å; W42-G45 PolarHBondContact O-N 2.89Å; W42-L46 HydrophobicContact CE3-CD1 4.14Å; W42-L46 HydrophobicContact CE3-CG 4.27Å; W42-L46 VanDerWaalsContact O-CB 3.3Å; W42-L46 WeakPolarHBondContact O-CB 3.39Å; W42-L46 WeakPolarHBondContact O-CG 3.46Å; W42-L46 PolarHBondContact O-N 3.34Å; W42-L82 HydrophobicContact CZ3-CD2 4.11Å; W42-P85 HydrophobicContact CD2-CB 3.76Å; W42-P85 HydrophobicContact CE3-CB 4.07Å; W42-P85 HydrophobicContact CG-CB 4.09Å; W42-P85 HydrophobicContact CZ2-CB 4.3Å; W42-P85 HydrophobicContact CZ3-CB 4.47Å; W42-S89 PolarHBondContact NE1-OG 3.13Å
43	A	66.6	Low	65.2	Low	29 Å²	29	58.4 Å²	58.4	24%	0.24	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-41.8	176.9	0	0	0	0	0	111.7	F29 L39 R40 S47	F29-A43 HydrophobicContact CD1-CB 4.04Å; F29-A43 HydrophobicContact CE1-CB 3.98Å; L39-A43 VanDerWaalsContact O-CB 3.32Å; L39-A43 WeakPolarHBondContact O-CB 3.46Å; L39-A43 PolarHBondContact O-N 2.74Å; R40-A43 PolarHBondContact O-N 3.32Å; A43-S47 VanDerWaalsContact O-CB 3.27Å; A43-S47 WeakPolarHBondContact O-CB 3.38Å; A43-S47 PolarHBondContact O-N 2.85Å; A43-S47 PolarHBondContact O-OG 3.09Å
44	V	69.5	Low	65.8	Low	20 Å²	20	62.5 Å²	62.5	12%	0.121	34%	0.336	C	S	.	.	H	α-helix	trans	-67.5	-40.8	175.1	172.8	0	0	0	0	111.5	L25 F29 R40 W42 S47 R48	L25-V44 HydrophobicContact CB-CG1 4.33Å; F29-V44 HydrophobicContact CB-CG2 3.86Å; F29-V44 HydrophobicContact CD2-CG2 4.05Å; F29-V44 HydrophobicContact CG-CG2 4.09Å; R40-V44 WeakPolarHBondContact O-CB 3.11Å; R40-V44 VanDerWaalsContact O-CG2 3.26Å; R40-V44 WeakPolarHBondContact O-CG2 3.29Å; R40-V44 PolarHBondContact O-N 3.27Å; W42-V44 VanDerWaalsContact C-N 3.34Å; W42-V44 PolarHBondContact O-N 3.25Å; V44-S47 WeakPolarHBondContact CA-OG 3.37Å; V44-S47 PolarHBondContact O-OG 2.85Å; V44-R48 WeakPolarHBondContact O-CB 3.38Å; V44-R48 PolarHBondContact O-N 2.97Å
45	G	67.4	Low	66.4	Low	5 Å²	5	59.3 Å²	59.3	5%	0.052	32%	0.322	C	S	.	.	H	α-helix	trans	-67.7	-42.7	177.4	0	0	0	0	0	113.9	V41 W42 R48 W49 G81	V41-G45 PolarHBondContact O-N 3.1Å; W42-G45 PolarHBondContact O-N 2.89Å; G45-R48 PolarHBondContact O-N 3.3Å; G45-W49 WeakPolarHBondContact O-CB 3.49Å; G45-W49 PolarHBondContact O-N 2.91Å; G45-G81 CarbonylContact C-O 3.4Å; G45-G81 VanDerWaalsContact CA-O 3.31Å; G45-G81 WeakPolarHBondContact CA-O 3.5Å
46	L	69.8	Low	66.9	Low	77 Å²	77	51 Å²	51	40%	0.403	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-39.6	178.1	-74.9	166.5	0	0	0	112.2	W42 W49 A50 L82	W42-L46 HydrophobicContact CE3-CD1 4.14Å; W42-L46 HydrophobicContact CE3-CG 4.27Å; W42-L46 VanDerWaalsContact O-CB 3.3Å; W42-L46 WeakPolarHBondContact O-CB 3.39Å; W42-L46 WeakPolarHBondContact O-CG 3.46Å; W42-L46 PolarHBondContact O-N 3.34Å; L46-W49 HydrophobicContact CD2-CE3 4.43Å; L46-W49 PolarHBondContact O-N 2.94Å; L46-A50 WeakPolarHBondContact O-CB 3.25Å; L46-A50 PolarHBondContact O-N 3.07Å; L46-L82 HydrophobicContact CD2-CD2 4.31Å
47	S	68.7	Low	66.8	Low	22 Å²	22	55.8 Å²	55.8	15%	0.154	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-40.5	174.3	54.1	0	0	0	0	111.6	A43 V44 A50 I51	A43-S47 VanDerWaalsContact O-CB 3.27Å; A43-S47 WeakPolarHBondContact O-CB 3.38Å; A43-S47 PolarHBondContact O-N 2.85Å; A43-S47 PolarHBondContact O-OG 3.09Å; V44-S47 WeakPolarHBondContact CA-OG 3.37Å; V44-S47 PolarHBondContact O-OG 2.85Å; S47-A50 PolarHBondContact O-N 2.97Å; S47-I51 WeakPolarHBondContact O-CD1 3.3Å; S47-I51 WeakPolarHBondContact O-CG1 3.3Å; S47-I51 PolarHBondContact O-N 3.45Å
48	R	70.4	Confident	66.7	Low	21 Å²	21	55.4 Å²	55.4	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-43.1	174.1	-168.3	178.9	-174	-168.5	8.5	112.5	D17 L25 V44 G45 L52	D17-R48 IonicContact OD1-CZ 3.55Å; D17-R48 IonicContact OD1-NE 3.32Å; D17-R48 PolarHBondContact OD1-NE 2.83Å; D17-R48 IonicContact OD1-NH2 2.69Å; D17-R48 PolarHBondContact OD1-NH2 3.32Å; D17-R48 IonicContact OD2-CZ 3.71Å; D17-R48 IonicContact OD2-NE 3.18Å; D17-R48 IonicContact OD2-NH2 3.76Å; D17-R48 PolarHBondContact OD2-NH2 2.79Å; L25-R48 HydrophobicContact CD1-CB 4.17Å; V44-R48 WeakPolarHBondContact O-CB 3.38Å; V44-R48 PolarHBondContact O-N 2.97Å; G45-R48 PolarHBondContact O-N 3.3Å; R48-L52 HydrophobicContact CG-CD1 4.1Å; R48-L52 WeakPolarHBondContact O-CB 3.24Å; R48-L52 WeakPolarHBondContact O-CG 3.26Å; R48-L52 PolarHBondContact O-N 3.13Å; R48-L52 VanDerWaalsContact O-N 3.07Å
49	W	72.1	Confident	66.5	Low	116 Å²	116	57.1 Å²	57.1	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-45	172.4	177.4	63.8	0	0	0	112	G45 L46 G53	G45-W49 WeakPolarHBondContact O-CB 3.49Å; G45-W49 PolarHBondContact O-N 2.91Å; L46-W49 HydrophobicContact CD2-CE3 4.43Å; L46-W49 PolarHBondContact O-N 2.94Å; W49-G53 PolarHBondContact O-N 2.8Å
50	A	69	Low	66	Low	43 Å²	43	54 Å²	54	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-43.7	179.8	0	0	0	0	0	112.6	L46 S47 G53 L54	L46-A50 WeakPolarHBondContact O-CB 3.25Å; L46-A50 PolarHBondContact O-N 3.07Å; S47-A50 PolarHBondContact O-N 2.97Å; A50-G53 PolarHBondContact O-N 3.47Å; A50-L54 WeakPolarHBondContact O-CB 3.26Å; A50-L54 WeakPolarHBondContact O-CG 3.36Å; A50-L54 PolarHBondContact O-N 3.14Å
51	I	72.2	Confident	65.2	Low	81 Å²	81	54.7 Å²	54.7	42%	0.415	32%	0.318	S	S	.	.	H	α-helix	trans	-68.6	-45.1	-178.8	-64.7	161.2	0	0	0	111	L21 L25 S47 G53 L54 G55	L21-I51 HydrophobicContact CD1-CG2 4.36Å; L21-I51 HydrophobicContact CD2-CB 4.07Å; L21-I51 HydrophobicContact CD2-CD1 3.71Å; L21-I51 HydrophobicContact CD2-CG2 3.85Å; L25-I51 HydrophobicContact CD1-CD1 4.3Å; L25-I51 HydrophobicContact CD2-CD1 4.24Å; S47-I51 WeakPolarHBondContact O-CD1 3.3Å; S47-I51 WeakPolarHBondContact O-CG1 3.3Å; S47-I51 PolarHBondContact O-N 3.45Å; I51-G53 VanDerWaalsContact C-N 3.33Å; I51-G53 PolarHBondContact O-N 3.02Å; I51-L54 PolarHBondContact O-N 3.24Å; I51-G55 PolarHBondContact O-N 2.99Å
52	L	68.9	Low	64.5	Low	6 Å²	6	58.9 Å²	58.9	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-66.1	-36.8	175.4	-69.9	170.9	0	0	0	111.5	L13 D17 L21 R48 G55 V56 V77	L13-L52 HydrophobicContact CD2-CD2 3.87Å; D17-L52 HydrophobicContact CB-CD1 4.46Å; D17-L52 HydrophobicContact CB-CD2 4.3Å; L21-L52 HydrophobicContact CD1-CD2 3.64Å; L21-L52 HydrophobicContact CD1-CG 3.88Å; R48-L52 HydrophobicContact CG-CD1 4.1Å; R48-L52 WeakPolarHBondContact O-CB 3.24Å; R48-L52 WeakPolarHBondContact O-CG 3.26Å; R48-L52 PolarHBondContact O-N 3.13Å; R48-L52 VanDerWaalsContact O-N 3.07Å; L52-G55 PolarHBondContact O-N 2.85Å; L52-V56 WeakPolarHBondContact O-CG2 3.39Å; L52-V56 PolarHBondContact O-N 3.25Å; L52-V77 HydrophobicContact CB-CB 4.48Å; L52-V77 HydrophobicContact CB-CG1 3.56Å; L52-V77 HydrophobicContact CB-CG2 4.19Å
53	G	64.9	Low	63.6	Low	22 Å²	22	57.3 Å²	57.3	23%	0.227	34%	0.344	C	S	.	.	H	α-helix	trans	-66.7	-40.1	176.6	0	0	0	0	0	113.3	W49 A50 I51 R57	W49-G53 PolarHBondContact O-N 2.8Å; A50-G53 PolarHBondContact O-N 3.47Å; I51-G53 VanDerWaalsContact C-N 3.33Å; I51-G53 PolarHBondContact O-N 3.02Å; G53-R57 WeakPolarHBondContact O-CG 3.5Å; G53-R57 PolarHBondContact O-N 2.98Å; G53-R57 VanDerWaalsContact O-N 3.07Å
54	L	69.6	Low	62.4	Low	123 Å²	123	60.8 Å²	60.8	64%	0.644	37%	0.373	S	S	*	.	H	α-helix	trans	-68.1	-39.6	173.7	-81.2	160.9	0	0	0	111.8	A50 I51 R57 G58	A50-L54 WeakPolarHBondContact O-CB 3.26Å; A50-L54 WeakPolarHBondContact O-CG 3.36Å; A50-L54 PolarHBondContact O-N 3.14Å; I51-L54 PolarHBondContact O-N 3.24Å; L54-R57 PolarHBondContact O-N 3.22Å; L54-G58 PolarHBondContact O-N 3.32Å
55	G	65.8	Low	61.2	Low	39 Å²	39	63.7 Å²	63.7	40%	0.402	41%	0.408	S	S	.	.	H	α-helix	trans	-60.7	-45.4	174.3	0	0	0	0	0	112.7	I51 L52 R57 G58 V59	I51-G55 PolarHBondContact O-N 2.99Å; L52-G55 PolarHBondContact O-N 2.85Å; G55-R57 PolarHBondContact O-N 3.31Å; G55-G58 PolarHBondContact O-N 3.46Å; G55-V59 WeakPolarHBondContact O-CG2 3.36Å; G55-V59 PolarHBondContact O-N 2.92Å
56	V	63.1	Low	60	Low	5 Å²	5	65.5 Å²	65.5	3%	0.03	42%	0.422	C	S	.	.	H	α-helix	trans	-63.7	-41.5	175.9	171.8	0	0	0	0	111.6	L13 L52 L60 V77	L13-V56 HydrophobicContact CD1-CG2 3.8Å; L13-V56 HydrophobicContact CD2-CG2 3.98Å; L13-V56 HydrophobicContact CG-CG2 4.5Å; L52-V56 WeakPolarHBondContact O-CG2 3.39Å; L52-V56 PolarHBondContact O-N 3.25Å; V56-L60 HydrophobicContact CG1-CD1 3.89Å; V56-L60 WeakPolarHBondContact O-CB 3.36Å; V56-L60 WeakPolarHBondContact O-CD1 3.11Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 3.07Å; V56-V77 HydrophobicContact CG2-CG2 3.92Å
57	R	62	Low	59	Low	170 Å²	170	71.8 Å²	71.8	64%	0.642	44%	0.44	S	S	*	.	H	α-helix	trans	-68.9	-35.6	176.7	-77.8	-177.4	179.5	170.9	1.1	113.4	G53 L54 G55 L60 G61	G53-R57 WeakPolarHBondContact O-CG 3.5Å; G53-R57 PolarHBondContact O-N 2.98Å; G53-R57 VanDerWaalsContact O-N 3.07Å; L54-R57 PolarHBondContact O-N 3.22Å; G55-R57 PolarHBondContact O-N 3.31Å; R57-L60 WeakPolarHBondContact O-CB 3.45Å; R57-L60 PolarHBondContact O-N 3.01Å; R57-G61 PolarHBondContact O-N 3.41Å
58	G	57.7	Low	58	Low	44 Å²	44	73.6 Å²	73.6	45%	0.454	46%	0.462	S	S	.	.	H	α-helix	trans	-66.4	-43.7	175.6	0	0	0	0	0	112.3	L54 G55 G61 V62	L54-G58 PolarHBondContact O-N 3.32Å; G55-G58 PolarHBondContact O-N 3.46Å; G58-G61 PolarHBondContact O-N 2.91Å; G58-G61 VanDerWaalsContact O-N 3.17Å; G58-V62 PolarHBondContact O-N 3.37Å
59	V	57.3	Low	57.2	Low	84 Å²	84	78.1 Å²	78.1	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-39	173.9	175	0	0	0	0	111.4	G55 G61 V62 T63 L70	G55-V59 WeakPolarHBondContact O-CG2 3.36Å; G55-V59 PolarHBondContact O-N 2.92Å; V59-G61 VanDerWaalsContact C-N 3.25Å; V59-G61 PolarHBondContact O-N 2.88Å; V59-V62 PolarHBondContact O-N 3.34Å; V59-T63 PolarHBondContact O-N 3.09Å; V59-T63 PolarHBondContact O-OG1 3Å; V59-L70 HydrophobicContact CG1-CD2 4.18Å
60	L	52.3	Low	56.2	Low	41 Å²	41	74 Å²	74	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-59.7	-31.3	171.9	-92.8	154.7	0	0	0	113.5	V56 R57 L70	V56-L60 HydrophobicContact CG1-CD1 3.89Å; V56-L60 WeakPolarHBondContact O-CB 3.36Å; V56-L60 WeakPolarHBondContact O-CD1 3.11Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 3.07Å; R57-L60 WeakPolarHBondContact O-CB 3.45Å; R57-L60 PolarHBondContact O-N 3.01Å; L60-L70 HydrophobicContact CD1-CB 4.18Å; L60-L70 HydrophobicContact CD2-CB 3.68Å; L60-L70 HydrophobicContact CG-CB 3.79Å; L60-L70 HydrophobicContact CG-CD2 4.17Å; L60-L70 HydrophobicContact CG-CG 4.43Å
61	G	49.3	Very low	55.4	Low	64 Å²	64	74.2 Å²	74.2	66%	0.66	47%	0.468	S	S	*	.	H	α-helix	trans	-74.5	-27.6	178.3	0	0	0	0	0	113.9	R57 G58 V59	R57-G61 PolarHBondContact O-N 3.41Å; G58-G61 PolarHBondContact O-N 2.91Å; G58-G61 VanDerWaalsContact O-N 3.17Å; V59-G61 VanDerWaalsContact C-N 3.25Å; V59-G61 PolarHBondContact O-N 2.88Å
62	V	52.1	Low	54.5	Low	127 Å²	127	71.8 Å²	71.8	77%	0.77	46%	0.459	S	S	*	.	H	α-helix	trans	-87.1	-27.6	-177.6	178.4	0	0	0	0	112.1	G58 V59	G58-V62 PolarHBondContact O-N 3.37Å; V59-V62 PolarHBondContact O-N 3.34Å
63	T	47.5	Very low	53.9	Low	64 Å²	64	71.6 Å²	71.6	39%	0.393	46%	0.458	S	S	.	.			trans	-109.1	86	179.3	60.8	0	0	0	0	111.7	V59 G65 A66	V59-T63 PolarHBondContact O-N 3.09Å; V59-T63 PolarHBondContact O-OG1 3Å; T63-G65 PolarHBondContact O-N 3.25Å; T63-A66 PolarHBondContact O-N 3.21Å
64	A	41.3	Very low	53.7	Low	102 Å²	102	75 Å²	75	84%	0.843	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-0.9	-174.8	0	0	0	0	0	116.2
65	G	43.9	Very low	53.1	Low	82 Å²	82	70.9 Å²	70.9	85%	0.845	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-4.4	-176.9	0	0	0	0	0	117	T63	T63-G65 PolarHBondContact O-N 3.25Å
66	A	42.7	Very low	52.7	Low	42 Å²	42	69.5 Å²	69.5	35%	0.347	43%	0.432	S	S	.	.			trans	-116.2	38.7	-166.9	0	0	0	0	0	114.7	T63 G68 L70	T63-A66 PolarHBondContact O-N 3.21Å; A66-G68 VanDerWaalsContact C-N 3.33Å; A66-G68 PolarHBondContact O-N 2.81Å; A66-L70 HydrophobicContact CB-CD1 3.93Å
67	R	48.1	Very low	52.7	Low	210 Å²	210	69.5 Å²	69.5	79%	0.792	43%	0.432	S	S	*	.	H	α-helix	trans	-63.3	-30	-174.8	-81	-177.6	176.5	178	-0.5	114.9	A71	R67-A71 WeakPolarHBondContact O-CB 3.29Å
68	G	48.4	Very low	52.7	Low	59 Å²	59	62.8 Å²	62.8	61%	0.608	41%	0.413	S	S	*	.	H	α-helix	trans	-71.3	-43.6	-169.5	0	0	0	0	0	115.2	A66	A66-G68 VanDerWaalsContact C-N 3.33Å; A66-G68 PolarHBondContact O-N 2.81Å
69	W	54	Low	52.8	Low	117 Å²	117	62.2 Å²	62.2	44%	0.443	40%	0.404	S	S	.	.	H	α-helix	trans	-99.5	-23.2	-171.1	-57.6	-5.2	0	0	0	113.4	A2 A3 W6 A72	A2-W69 HydrophobicContact CB-CE3 4.33Å; A2-W69 HydrophobicContact CB-CH2 3.49Å; A2-W69 VanDerWaalsContact CB-CH2 3.49Å; A2-W69 HydrophobicContact CB-CZ2 4Å; A2-W69 HydrophobicContact CB-CZ3 3.75Å; A2-W69 WeakPolarHBondContact O-CZ3 3.27Å; A3-W69 VanDerWaalsContact CA-CH2 3.43Å; A3-W69 HydrophobicContact CB-CH2 4.27Å; A3-W69 VanDerWaalsContact N-CH2 3.31Å; A3-W69 VanDerWaalsContact N-CZ3 3.34Å; W6-W69 HydrophobicContact CB-CE3 4.28Å; W69-A72 WeakPolarHBondContact O-CB 3.12Å; W69-A72 PolarHBondContact O-N 2.97Å
70	L	50.1	Low	53	Low	29 Å²	29	58.8 Å²	58.8	15%	0.152	38%	0.383	C	S	.	.	H	α-helix	trans	-72	-28.2	171.8	-90.8	131.4	0	0	0	112.5	V59 L60 A66 A72 L73	V59-L70 HydrophobicContact CG1-CD2 4.18Å; L60-L70 HydrophobicContact CD1-CB 4.18Å; L60-L70 HydrophobicContact CD2-CB 3.68Å; L60-L70 HydrophobicContact CG-CB 3.79Å; L60-L70 HydrophobicContact CG-CD2 4.17Å; L60-L70 HydrophobicContact CG-CG 4.43Å; A66-L70 HydrophobicContact CB-CD1 3.93Å; L70-A72 PolarHBondContact O-N 3.06Å; L70-L73 HydrophobicContact CD2-CD1 4.21Å; L70-L73 HydrophobicContact CG-CD1 4.39Å; L70-L73 WeakPolarHBondContact O-CB 3.27Å; L70-L73 PolarHBondContact O-N 3.49Å
71	A	52.4	Low	53.3	Low	48 Å²	48	56.9 Å²	56.9	40%	0.397	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-63.2	-29.2	168.9	0	0	0	0	0	112.4	R67 L73 Q74	R67-A71 WeakPolarHBondContact O-CB 3.29Å; A71-L73 PolarHBondContact O-N 3Å; A71-Q74 PolarHBondContact O-N 3.26Å
72	A	52.4	Low	53.9	Low	29 Å²	29	57 Å²	57	24%	0.24	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-71.5	-10.7	176.3	0	0	0	0	0	113.9	W69 L70 P75	W69-A72 WeakPolarHBondContact O-CB 3.12Å; W69-A72 PolarHBondContact O-N 2.97Å; L70-A72 PolarHBondContact O-N 3.06Å; A72-P75 WeakPolarHBondContact O-CD 3.28Å; A72-P75 WeakPolarHBondContact O-CG 3.3Å
73	L	56.6	Low	54.3	Low	3 Å²	3	52.6 Å²	52.6	2%	0.016	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-86.8	-19.5	176.7	-71.4	163.9	0	0	0	113.4	A9 A10 L13 L70 A71 L76 V77	A9-L73 HydrophobicContact CB-CD1 4.31Å; A10-L73 HydrophobicContact CB-CD2 4.06Å; L13-L73 HydrophobicContact CD1-CD1 4.11Å; L13-L73 HydrophobicContact CD1-CD2 4.22Å; L70-L73 HydrophobicContact CD2-CD1 4.21Å; L70-L73 HydrophobicContact CG-CD1 4.39Å; L70-L73 WeakPolarHBondContact O-CB 3.27Å; L70-L73 PolarHBondContact O-N 3.49Å; A71-L73 PolarHBondContact O-N 3Å; L73-L76 WeakPolarHBondContact O-CB 3.34Å; L73-L76 PolarHBondContact O-N 3.05Å; L73-L76 VanDerWaalsContact O-N 3.16Å; L73-V77 WeakPolarHBondContact O-CG2 3.5Å; L73-V77 PolarHBondContact O-N 2.85Å
74	Q	60.5	Low	54.8	Low	94 Å²	94	51.4 Å²	51.4	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-56.1	-43.4	176.8	-70.9	-175.8	-27.3	0	0	115.1	A71 L76 V77 A78	A71-Q74 PolarHBondContact O-N 3.26Å; Q74-L76 VanDerWaalsContact C-N 3.32Å; Q74-L76 PolarHBondContact O-N 3.49Å; Q74-V77 PolarHBondContact O-N 3.41Å; Q74-A78 PolarHBondContact O-N 3.23Å
75	P	56.9	Low	55.8	Low	36 Å²	36	46.5 Å²	46.5	23%	0.234	29%	0.286	C	S	.	.	H	α-helix	trans	-69.2	-29.7	176	25	-34.8	0	0	0	112.7	A72 A78 A79 W131	A72-P75 WeakPolarHBondContact O-CD 3.28Å; A72-P75 WeakPolarHBondContact O-CG 3.3Å; P75-A78 PolarHBondContact O-N 3.01Å; P75-A79 VanDerWaalsContact O-CB 3.32Å; P75-A79 WeakPolarHBondContact O-CB 3.07Å; P75-A79 PolarHBondContact O-N 3.35Å; P75-W131 HydrophobicContact CB-CG 4.26Å; P75-W131 HydrophobicContact CG-CG 4.15Å
76	L	58.9	Low	56.4	Low	10 Å²	10	44.1 Å²	44.1	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-38.9	174.5	-168.9	148	0	0	0	110.6	L73 Q74 A79 L80 A128	L73-L76 WeakPolarHBondContact O-CB 3.34Å; L73-L76 PolarHBondContact O-N 3.05Å; L73-L76 VanDerWaalsContact O-N 3.16Å; Q74-L76 VanDerWaalsContact C-N 3.32Å; Q74-L76 PolarHBondContact O-N 3.49Å; L76-A79 PolarHBondContact O-N 3.45Å; L76-L80 HydrophobicContact CD2-CD1 3.57Å; L76-L80 HydrophobicContact CD2-CG 4.34Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 VanDerWaalsContact O-CG 3.28Å; L76-L80 WeakPolarHBondContact O-CG 3.27Å; L76-L80 PolarHBondContact O-N 3.17Å; L76-A128 HydrophobicContact CD1-CB 3.94Å; L76-A128 HydrophobicContact CG-CB 4.5Å
77	V	62.7	Low	57.1	Low	4 Å²	4	46.1 Å²	46.1	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-40.9	171.7	171.3	0	0	0	0	112.2	L52 V56 L73 Q74 G81	L52-V77 HydrophobicContact CB-CB 4.48Å; L52-V77 HydrophobicContact CB-CG1 3.56Å; L52-V77 HydrophobicContact CB-CG2 4.19Å; V56-V77 HydrophobicContact CG2-CG2 3.92Å; L73-V77 WeakPolarHBondContact O-CG2 3.5Å; L73-V77 PolarHBondContact O-N 2.85Å; Q74-V77 PolarHBondContact O-N 3.41Å; V77-G81 PolarHBondContact O-N 2.99Å
78	A	61.3	Low	57.5	Low	30 Å²	30	37.1 Å²	37.1	25%	0.248	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-42.7	175	0	0	0	0	0	112.2	Q74 P75 G81 L82	Q74-A78 PolarHBondContact O-N 3.23Å; P75-A78 PolarHBondContact O-N 3.01Å; A78-G81 PolarHBondContact O-N 3.02Å; A78-L82 WeakPolarHBondContact O-CB 3.46Å; A78-L82 PolarHBondContact O-N 3.18Å
79	A	59.6	Low	57.9	Low	32 Å²	32	35.3 Å²	35.3	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-44.7	176.1	0	0	0	0	0	111.8	P75 L76 G81 A83 A124	P75-A79 VanDerWaalsContact O-CB 3.32Å; P75-A79 WeakPolarHBondContact O-CB 3.07Å; P75-A79 PolarHBondContact O-N 3.35Å; L76-A79 PolarHBondContact O-N 3.45Å; A79-G81 PolarHBondContact O-N 3.08Å; A79-A83 WeakPolarHBondContact O-CB 3.07Å; A79-A83 PolarHBondContact O-N 2.83Å; A79-A83 VanDerWaalsContact O-N 3.12Å; A79-A124 HydrophobicContact CB-CB 4.24Å
80	L	61.7	Low	57.7	Low	12 Å²	12	36 Å²	36	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-67	-34.2	178.1	-72.9	172	0	0	0	113.4	L14 L76 Y121	L14-L80 HydrophobicContact CD2-CD1 3.91Å; L14-L80 HydrophobicContact CD2-CD2 4.35Å; L76-L80 HydrophobicContact CD2-CD1 3.57Å; L76-L80 HydrophobicContact CD2-CG 4.34Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 VanDerWaalsContact O-CG 3.28Å; L76-L80 WeakPolarHBondContact O-CG 3.27Å; L76-L80 PolarHBondContact O-N 3.17Å; L80-Y121 HydrophobicContact CD2-CD1 4.48Å; L80-Y121 HydrophobicContact CD2-CD2 4.09Å; L80-Y121 HydrophobicContact CD2-CE1 4.1Å; L80-Y121 HydrophobicContact CD2-CE2 3.57Å; L80-Y121 HydrophobicContact CD2-CG 4.49Å
81	G	58.5	Low	57.8	Low	1 Å²	1	41 Å²	41	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-79.8	-36.1	-179.8	0	0	0	0	0	114.6	G45 V77 A78 A79 P85	G45-G81 CarbonylContact C-O 3.4Å; G45-G81 VanDerWaalsContact CA-O 3.31Å; G45-G81 WeakPolarHBondContact CA-O 3.5Å; V77-G81 PolarHBondContact O-N 2.99Å; A78-G81 PolarHBondContact O-N 3.02Å; A79-G81 PolarHBondContact O-N 3.08Å; G81-P85 WeakPolarHBondContact O-CD 3.48Å
82	L	61.3	Low	57.7	Low	66 Å²	66	42.9 Å²	42.9	35%	0.346	24%	0.237	S	C	.	.	H	α-helix	trans	-105.8	-15.1	-169	-63.7	169	0	0	0	114.5	W42 L46 A78 L84 P85 G86	W42-L82 HydrophobicContact CZ3-CD2 4.11Å; L46-L82 HydrophobicContact CD2-CD2 4.31Å; A78-L82 WeakPolarHBondContact O-CB 3.46Å; A78-L82 PolarHBondContact O-N 3.18Å; L82-L84 PolarHBondContact O-N 3.31Å; L82-P85 WeakPolarHBondContact O-CD 3.45Å; L82-G86 PolarHBondContact O-N 2.89Å
83	A	60.9	Low	57.5	Low	35 Å²	35	46.9 Å²	46.9	29%	0.289	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-41.1	179.4	0	0	0	0	0	113	A79 L87	A79-A83 WeakPolarHBondContact O-CB 3.07Å; A79-A83 PolarHBondContact O-N 2.83Å; A79-A83 VanDerWaalsContact O-N 3.12Å; A83-L87 WeakPolarHBondContact O-CB 3.46Å; A83-L87 PolarHBondContact O-N 2.96Å
84	L	59.3	Low	56.8	Low	38 Å²	38	50.4 Å²	50.4	20%	0.199	28%	0.283	C	S	.	.	H	α-helix	trans	-69.7	-47.8	-178.7	-129.1	106	0	0	0	112.9	L82 G86 L87 A88 N111 F117	L82-L84 PolarHBondContact O-N 3.31Å; L84-G86 VanDerWaalsContact C-N 3.33Å; L84-G86 PolarHBondContact O-N 2.79Å; L84-L87 PolarHBondContact O-N 2.85Å; L84-A88 WeakPolarHBondContact O-CB 3.28Å; L84-A88 PolarHBondContact O-N 3.4Å; L84-N111 WeakPolarHBondContact CD2-OD1 3.46Å; L84-F117 HydrophobicContact CD1-CD2 4.01Å; L84-F117 HydrophobicContact CD1-CE2 4.26Å
85	P	60.6	Low	56.1	Low	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-37.9	172.8	-18.4	28.5	0	0	0	113.1	V41 W42 G81 L82 A88 S89	V41-P85 HydrophobicContact CG1-CB 4.3Å; V41-P85 HydrophobicContact CG1-CG 4.45Å; W42-P85 HydrophobicContact CD2-CB 3.76Å; W42-P85 HydrophobicContact CE3-CB 4.07Å; W42-P85 HydrophobicContact CG-CB 4.09Å; W42-P85 HydrophobicContact CZ2-CB 4.3Å; W42-P85 HydrophobicContact CZ3-CB 4.47Å; G81-P85 WeakPolarHBondContact O-CD 3.48Å; L82-P85 WeakPolarHBondContact O-CD 3.45Å; P85-A88 PolarHBondContact O-N 3Å; P85-S89 VanDerWaalsContact O-CB 3.31Å; P85-S89 WeakPolarHBondContact O-CB 3.29Å; P85-S89 PolarHBondContact O-N 2.78Å; P85-S89 PolarHBondContact O-OG 3.37Å
86	G	56.9	Low	55.4	Low	32 Å²	32	57.6 Å²	57.6	33%	0.33	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-50.3	175.3	0	0	0	0	0	112	L82 L84 A88 S89 F90	L82-G86 PolarHBondContact O-N 2.89Å; L84-G86 VanDerWaalsContact C-N 3.33Å; L84-G86 PolarHBondContact O-N 2.79Å; G86-A88 PolarHBondContact O-N 3.35Å; G86-S89 PolarHBondContact O-N 2.85Å; G86-F90 VanDerWaalsContact O-CB 3.29Å; G86-F90 WeakPolarHBondContact O-CB 3.38Å; G86-F90 PolarHBondContact O-N 3.08Å
87	L	57.9	Low	54.8	Low	84 Å²	84	60.7 Å²	60.7	44%	0.44	35%	0.349	S	S	.	.	H	α-helix	trans	-62.6	-41.1	176.6	-92.2	154.6	0	0	0	113	A83 L84 R91	A83-L87 WeakPolarHBondContact O-CB 3.46Å; A83-L87 PolarHBondContact O-N 2.96Å; L84-L87 PolarHBondContact O-N 2.85Å; L87-R91 WeakPolarHBondContact O-CB 3.39Å; L87-R91 PolarHBondContact O-N 3.22Å
88	A	56.3	Low	53.7	Low	20 Å²	20	64.6 Å²	64.6	17%	0.165	38%	0.382	C	S	.	.	H	α-helix	trans	-67.6	-38.7	178.4	0	0	0	0	0	112.6	V41 L84 P85 G86 K92	V41-A88 HydrophobicContact CG1-CB 3.87Å; L84-A88 WeakPolarHBondContact O-CB 3.28Å; L84-A88 PolarHBondContact O-N 3.4Å; P85-A88 PolarHBondContact O-N 3Å; G86-A88 PolarHBondContact O-N 3.35Å; A88-K92 PolarHBondContact O-N 3.41Å; A88-K92 VanDerWaalsContact O-N 3.14Å
89	S	56.6	Low	52.4	Low	22 Å²	22	71.5 Å²	71.5	15%	0.154	41%	0.414	C	S	.	.	H	α-helix	trans	-69	-42.5	176.5	-53.9	0	0	0	0	111.6	L38 W42 P85 G86 R91 K92 L93	L38-S89 WeakPolarHBondContact CD2-OG 3.3Å; W42-S89 PolarHBondContact NE1-OG 3.13Å; P85-S89 VanDerWaalsContact O-CB 3.31Å; P85-S89 WeakPolarHBondContact O-CB 3.29Å; P85-S89 PolarHBondContact O-N 2.78Å; P85-S89 PolarHBondContact O-OG 3.37Å; G86-S89 PolarHBondContact O-N 2.85Å; S89-R91 VanDerWaalsContact C-N 3.32Å; S89-R91 PolarHBondContact O-N 3.17Å; S89-K92 PolarHBondContact O-N 2.94Å; S89-L93 PolarHBondContact O-N 2.84Å
90	F	50.4	Low	51.2	Low	132 Å²	132	81.1 Å²	81.1	58%	0.579	44%	0.443	S	S	*	.	H	α-helix	trans	-63.4	-38.9	178.3	-160.3	-96.9	0	0	0	111.8	G86 L93 A94	G86-F90 VanDerWaalsContact O-CB 3.29Å; G86-F90 WeakPolarHBondContact O-CB 3.38Å; G86-F90 PolarHBondContact O-N 3.08Å; F90-L93 PolarHBondContact O-N 3.25Å; F90-A94 WeakPolarHBondContact O-CB 3.4Å; F90-A94 PolarHBondContact O-N 2.84Å
91	R	51.4	Low	50	Low	134 Å²	134	90.2 Å²	90.2	51%	0.506	49%	0.485	S	S	.	.	H	α-helix	trans	-71.2	-36	176.7	-167.2	176.6	179.7	180	-0.7	113.2	L87 S89 L93 A94 A95 W110	L87-R91 WeakPolarHBondContact O-CB 3.39Å; L87-R91 PolarHBondContact O-N 3.22Å; S89-R91 VanDerWaalsContact C-N 3.32Å; S89-R91 PolarHBondContact O-N 3.17Å; R91-L93 VanDerWaalsContact C-N 3.31Å; R91-A94 CarbonylContact O-C 3.59Å; R91-A94 PolarHBondContact O-N 2.86Å; R91-A95 WeakPolarHBondContact O-CB 3.29Å; R91-A95 PolarHBondContact O-N 2.89Å; R91-W110 VanDerWaalsContact NH1-CE3 3.29Å
92	K	50.1	Low	49.1	Very low	87 Å²	87	93.4 Å²	93.4	38%	0.378	52%	0.518	S	S	.	.	H	α-helix	trans	-70.8	-29.8	176.2	-169.6	153.5	161.9	-169.9	0	112.1	L38 A88 S89	L38-K92 HydrophobicContact CD1-CB 4.12Å; L38-K92 HydrophobicContact CD1-CD 3.42Å; L38-K92 VanDerWaalsContact CD1-CD 3.42Å; L38-K92 HydrophobicContact CD1-CG 3.95Å; L38-K92 HydrophobicContact CG-CD 3.91Å; A88-K92 PolarHBondContact O-N 3.41Å; A88-K92 VanDerWaalsContact O-N 3.14Å; S89-K92 PolarHBondContact O-N 2.94Å
93	L	48.8	Very low	48.2	Very low	113 Å²	113	96.4 Å²	96.4	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-68	-40.3	165.9	-84.2	155.9	0	0	0	112.3	S89 F90 R91 A95 W96	S89-L93 PolarHBondContact O-N 2.84Å; F90-L93 PolarHBondContact O-N 3.25Å; R91-L93 VanDerWaalsContact C-N 3.31Å; L93-A95 VanDerWaalsContact C-N 3.32Å; L93-A95 PolarHBondContact O-N 3.16Å; L93-W96 HydrophobicContact CD2-CE3 4.24Å; L93-W96 HydrophobicContact CD2-CZ3 4.4Å; L93-W96 WeakPolarHBondContact O-CB 3.49Å; L93-W96 PolarHBondContact O-N 3.36Å
94	A	42.8	Very low	47.3	Very low	77 Å²	77	101.3 Å²	101.3	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-69	-26	176.2	0	0	0	0	0	113.9	F90 R91 W96	F90-A94 WeakPolarHBondContact O-CB 3.4Å; F90-A94 PolarHBondContact O-N 2.84Å; R91-A94 CarbonylContact O-C 3.59Å; R91-A94 PolarHBondContact O-N 2.86Å; A94-W96 VanDerWaalsContact C-N 3.32Å
95	A	45.9	Very low	46.4	Very low	59 Å²	59	102.9 Å²	102.9	49%	0.488	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	-3.4	177.9	0	0	0	0	0	114.1	R91 L93 G97 A98	R91-A95 WeakPolarHBondContact O-CB 3.29Å; R91-A95 PolarHBondContact O-N 2.89Å; L93-A95 VanDerWaalsContact C-N 3.32Å; L93-A95 PolarHBondContact O-N 3.16Å; A95-G97 PolarHBondContact O-N 2.66Å; A95-A98 PolarHBondContact O-N 2.8Å
96	W	42.3	Very low	45.8	Very low	221 Å²	221	104.5 Å²	104.5	84%	0.837	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	19.9	179.7	-153.9	-16.3	0	0	0	113.9	L93 A94	L93-W96 HydrophobicContact CD2-CE3 4.24Å; L93-W96 HydrophobicContact CD2-CZ3 4.4Å; L93-W96 WeakPolarHBondContact O-CB 3.49Å; L93-W96 PolarHBondContact O-N 3.36Å; A94-W96 VanDerWaalsContact C-N 3.32Å
97	G	45.2	Very low	45.3	Very low	76 Å²	76	106.4 Å²	106.4	78%	0.784	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	-1.4	175.5	0	0	0	0	0	115.3	A95	A95-G97 PolarHBondContact O-N 2.66Å
98	A	38.9	Very low	44.6	Very low	86 Å²	86	107.5 Å²	107.5	71%	0.711	60%	0.599	S	S	*	*			trans	-136.3	91.6	-179.1	0	0	0	0	0	111.1	A95	A95-A98 PolarHBondContact O-N 2.8Å
99	L	34.8	Very low	44.2	Very low	175 Å²	175	113.1 Å²	113.1	92%	0.916	62%	0.621	S	S	*	*			trans	-78.9	115.7	170.4	-90.1	157.6	0	0	0	110.1
100	R	33.6	Very low	43.9	Very low	234 Å²	234	117 Å²	117	88%	0.883	63%	0.633	S	S	*	*			trans	-139.5	122.1	151.1	-152.1	172	-173.1	173.3	1.6	107.8	G102	R100-G102 PolarHBondContact O-N 3.48Å
101	E	37.1	Very low	43.6	Very low	203 Å²	203	114.7 Å²	114.7	95%	0.949	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	25.3	-168.2	-71.4	-178.8	140.7	0	0	116.4
102	G	41	Very low	43.4	Very low	67 Å²	67	112.2 Å²	112.2	69%	0.691	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-14.3	-177.6	0	0	0	0	0	116.6	R100	R100-G102 PolarHBondContact O-N 3.48Å
103	D	41.5	Very low	43.6	Very low	130 Å²	130	115.1 Å²	115.1	70%	0.695	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-100.4	4.8	-157.1	-132.2	8.9	0	0	0	115.7	A105 G106	D103-A105 PolarHBondContact O-N 3.08Å; D103-G106 PolarHBondContact O-N 3.21Å; D103-G106 VanDerWaalsContact O-N 3.08Å
104	N	41.9	Very low	43.6	Very low	137 Å²	137	115 Å²	115	73%	0.733	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-65.6	-19.7	178.4	-85.8	-20.3	0	0	0	113.4
105	A	41.4	Very low	43.9	Very low	71 Å²	71	117 Å²	117	59%	0.587	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-76.9	-22.6	173.6	0	0	0	0	0	113.3	D103	D103-A105 PolarHBondContact O-N 3.08Å
106	G	46.3	Very low	44.1	Very low	35 Å²	35	115.4 Å²	115.4	36%	0.361	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.6	-26.3	-176.5	0	0	0	0	0	114.8	D103 W110	D103-G106 PolarHBondContact O-N 3.21Å; D103-G106 VanDerWaalsContact O-N 3.08Å; G106-W110 PolarHBondContact O-N 3.03Å
107	L	47.3	Very low	44.6	Very low	71 Å²	71	106.3 Å²	106.3	37%	0.372	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-30.8	177	-96	152.3	0	0	0	112.8
108	L	43.4	Very low	45.1	Very low	108 Å²	108	106.8 Å²	106.8	57%	0.565	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-30.3	177.5	-94.2	132	0	0	0	112.8
109	H	48.5	Very low	45.8	Very low	137 Å²	137	106.8 Å²	106.8	63%	0.634	57%	0.566	S	S	*	*	S	Bend	trans	-89.3	-1.7	175.8	-81.7	-20.5	0	0	0	114.7	N111 S112	H109-N111 VanDerWaalsContact C-N 3.32Å; H109-S112 PolarHBondContact O-N 3.39Å; H109-S112 PolarHBondContact O-OG 3.29Å
110	W	48.3	Very low	46.6	Very low	105 Å²	105	99 Å²	99	40%	0.398	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-72.8	-28.8	176.6	-160.5	-94.5	0	0	0	112.5	R91 G106 S112 R113 A116	R91-W110 VanDerWaalsContact NH1-CE3 3.29Å; G106-W110 PolarHBondContact O-N 3.03Å; W110-S112 PolarHBondContact O-N 3.48Å; W110-R113 PolarHBondContact O-N 2.81Å; W110-A116 HydrophobicContact CZ2-CB 4.12Å
111	N	45	Very low	47.7	Very low	82 Å²	82	89.8 Å²	89.8	44%	0.439	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-70.2	-12.2	179.3	-148.1	23.4	0	0	0	113.2	L84 H109	L84-N111 WeakPolarHBondContact CD2-OD1 3.46Å; H109-N111 VanDerWaalsContact C-N 3.32Å
112	S	47.9	Very low	48.5	Very low	82 Å²	82	84.2 Å²	84.2	57%	0.573	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-107.4	-3.7	-179.1	58.9	0	0	0	0	114.6	H109 W110	H109-S112 PolarHBondContact O-N 3.39Å; H109-S112 PolarHBondContact O-OG 3.29Å; W110-S112 PolarHBondContact O-N 3.48Å
113	R	53.6	Low	48.9	Very low	148 Å²	148	84 Å²	84	56%	0.558	46%	0.462	S	S	*	.			trans	-83	128.5	178.3	-75.4	-165.2	-179.5	-160.6	2.3	111.9	W110 D115	W110-R113 PolarHBondContact O-N 2.81Å; R113-D115 VanDerWaalsContact C-N 3.31Å; R113-D115 PolarHBondContact O-N 3.31Å
114	L	49.4	Very low	49.2	Very low	112 Å²	112	78.3 Å²	78.3	59%	0.586	43%	0.434	S	S	*	.	H	α-helix	trans	-61.2	-34.9	179.1	-76.4	159.7	0	0	0	112.8	F117 V118	L114-F117 PolarHBondContact O-N 2.77Å; L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.4Å
115	D	48.1	Very low	49.5	Very low	119 Å²	119	76.8 Å²	76.8	64%	0.636	43%	0.425	S	S	*	.	H	α-helix	trans	-68	-41.2	-171.8	-51.8	-31.2	0	0	0	114.1	R113 F117 L119	R113-D115 VanDerWaalsContact C-N 3.31Å; R113-D115 PolarHBondContact O-N 3.31Å; D115-F117 PolarHBondContact O-N 2.98Å; D115-L119 PolarHBondContact O-N 3.06Å
116	A	51.3	Low	49.9	Very low	24 Å²	24	76.3 Å²	76.3	20%	0.198	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-26.4	178	0	0	0	0	0	112	W110 S120	W110-A116 HydrophobicContact CZ2-CB 4.12Å; A116-S120 PolarHBondContact O-N 3.29Å
117	F	53	Low	49.9	Very low	30 Å²	30	77.3 Å²	77.3	13%	0.132	42%	0.421	C	S	.	.	H	α-helix	trans	-85.5	-40.6	-176.1	-155.7	-94.5	0	0	0	111.8	L84 L114 D115 L119 S120 Y121	L84-F117 HydrophobicContact CD1-CD2 4.01Å; L84-F117 HydrophobicContact CD1-CE2 4.26Å; L114-F117 PolarHBondContact O-N 2.77Å; D115-F117 PolarHBondContact O-N 2.98Å; F117-L119 PolarHBondContact O-N 2.8Å; F117-S120 PolarHBondContact O-N 3.06Å; F117-S120 VanDerWaalsContact O-N 3.12Å; F117-S120 PolarHBondContact O-OG 2.79Å; F117-Y121 AromaticContact CD1-CD2 3.85Å; F117-Y121 HydrophobicContact CD1-CD2 3.85Å; F117-Y121 AromaticContact CD1-CE2 3.79Å; F117-Y121 HydrophobicContact CD1-CE2 3.79Å; F117-Y121 AromaticContact CE1-CD2 3.65Å; F117-Y121 HydrophobicContact CE1-CD2 3.65Å; F117-Y121 AromaticContact CE1-CE2 3.09Å; F117-Y121 HydrophobicContact CE1-CE2 3.09Å; F117-Y121 AromaticContact CE1-CZ 3.7Å; F117-Y121 HydrophobicContact CE2-CE2 4.34Å; F117-Y121 HydrophobicContact CZ-CD2 4.28Å; F117-Y121 AromaticContact CZ-CE2 3.44Å; F117-Y121 HydrophobicContact CZ-CE2 3.44Å; F117-Y121 VanDerWaalsContact CZ-CE2 3.44Å; F117-Y121 PolarHBondContact O-N 3.09Å; F117-Y121 VanDerWaalsContact O-N 3.16Å
118	V	55.3	Low	49.8	Very low	86 Å²	86	74.5 Å²	74.5	52%	0.521	41%	0.408	S	S	.	.	H	α-helix	trans	-56.1	-41.7	170.2	173.3	0	0	0	0	110.2	L114 S120 Y121 V122	L114-V118 WeakPolarHBondContact O-CG2 3.5Å; L114-V118 PolarHBondContact O-N 3.4Å; V118-S120 VanDerWaalsContact C-N 3.35Å; V118-S120 PolarHBondContact O-N 2.93Å; V118-Y121 PolarHBondContact O-N 3.13Å; V118-V122 HydrophobicContact CG1-CG2 3.94Å; V118-V122 VanDerWaalsContact O-CB 3.24Å; V118-V122 WeakPolarHBondContact O-CB 3.41Å; V118-V122 WeakPolarHBondContact O-CG2 3.21Å; V118-V122 PolarHBondContact O-N 3.46Å
119	L	54	Low	50	Low	86 Å²	86	71.8 Å²	71.8	45%	0.45	40%	0.401	S	S	.	.	H	α-helix	trans	-61.2	-39.1	177.1	-126.4	110.9	0	0	0	113.3	D115 F117 A123 F302	D115-L119 PolarHBondContact O-N 3.06Å; F117-L119 PolarHBondContact O-N 2.8Å; L119-A123 VanDerWaalsContact O-CB 3.29Å; L119-A123 WeakPolarHBondContact O-CB 3.28Å; L119-A123 PolarHBondContact O-N 3.29Å; L119-F302 HydrophobicContact CD2-CE1 3.85Å; L119-F302 HydrophobicContact CD2-CZ 4.31Å
120	S	51.2	Low	49.8	Very low	13 Å²	13	70.5 Å²	70.5	9%	0.091	40%	0.398	C	S	.	.	H	α-helix	trans	-70.3	-38.2	179.7	69.5	0	0	0	0	112.9	A116 F117 V118 A124	A116-S120 PolarHBondContact O-N 3.29Å; F117-S120 PolarHBondContact O-N 3.06Å; F117-S120 VanDerWaalsContact O-N 3.12Å; F117-S120 PolarHBondContact O-OG 2.79Å; V118-S120 VanDerWaalsContact C-N 3.35Å; V118-S120 PolarHBondContact O-N 2.93Å; S120-A124 WeakPolarHBondContact O-CB 3.46Å; S120-A124 PolarHBondContact O-N 2.93Å
121	Y	55.7	Low	49.7	Very low	40 Å²	40	72.9 Å²	72.9	16%	0.157	41%	0.408	C	S	.	.	H	α-helix	trans	-74.6	-38.2	176.6	-87.1	-114.9	0	0	0	111.9	L14 D17 L80 F117 V118 A123 A124 L125	L14-Y121 HydrophobicContact CB-CE1 4.38Å; L14-Y121 HydrophobicContact CD2-CD1 3.81Å; L14-Y121 HydrophobicContact CD2-CE1 3.26Å; L14-Y121 HydrophobicContact CG-CE1 4.31Å; D17-Y121 PolarHBondContact OD2-OH 2.92Å; L80-Y121 HydrophobicContact CD2-CD1 4.48Å; L80-Y121 HydrophobicContact CD2-CD2 4.09Å; L80-Y121 HydrophobicContact CD2-CE1 4.1Å; L80-Y121 HydrophobicContact CD2-CE2 3.57Å; L80-Y121 HydrophobicContact CD2-CG 4.49Å; F117-Y121 AromaticContact CD1-CD2 3.85Å; F117-Y121 HydrophobicContact CD1-CD2 3.85Å; F117-Y121 AromaticContact CD1-CE2 3.79Å; F117-Y121 HydrophobicContact CD1-CE2 3.79Å; F117-Y121 AromaticContact CE1-CD2 3.65Å; F117-Y121 HydrophobicContact CE1-CD2 3.65Å; F117-Y121 AromaticContact CE1-CE2 3.09Å; F117-Y121 HydrophobicContact CE1-CE2 3.09Å; F117-Y121 AromaticContact CE1-CZ 3.7Å; F117-Y121 HydrophobicContact CE2-CE2 4.34Å; F117-Y121 HydrophobicContact CZ-CD2 4.28Å; F117-Y121 AromaticContact CZ-CE2 3.44Å; F117-Y121 HydrophobicContact CZ-CE2 3.44Å; F117-Y121 VanDerWaalsContact CZ-CE2 3.44Å; F117-Y121 PolarHBondContact O-N 3.09Å; F117-Y121 VanDerWaalsContact O-N 3.16Å; V118-Y121 PolarHBondContact O-N 3.13Å; Y121-A123 VanDerWaalsContact C-N 3.31Å; Y121-A123 PolarHBondContact O-N 3.17Å; Y121-A124 PolarHBondContact O-N 3.49Å; Y121-L125 WeakPolarHBondContact O-CG 3.43Å; Y121-L125 PolarHBondContact O-N 3.44Å; Y121-L125 VanDerWaalsContact O-N 3.13Å
122	V	54.2	Low	49.8	Very low	86 Å²	86	73.1 Å²	73.1	52%	0.521	41%	0.406	S	S	.	.	H	α-helix	trans	-68.8	-27.5	175.1	171.9	0	0	0	0	112	V118 P126	V118-V122 HydrophobicContact CG1-CG2 3.94Å; V118-V122 VanDerWaalsContact O-CB 3.24Å; V118-V122 WeakPolarHBondContact O-CB 3.41Å; V118-V122 WeakPolarHBondContact O-CG2 3.21Å; V118-V122 PolarHBondContact O-N 3.46Å; V122-P126 WeakPolarHBondContact O-CD 3.39Å; V122-P126 WeakPolarHBondContact O-CG 3.46Å
123	A	50.5	Low	49.8	Very low	61 Å²	61	76.1 Å²	76.1	50%	0.504	41%	0.408	S	S	.	.	H	α-helix	trans	-83	-33.7	171.9	0	0	0	0	0	113.2	L119 Y121 P126 A127	L119-A123 VanDerWaalsContact O-CB 3.29Å; L119-A123 WeakPolarHBondContact O-CB 3.28Å; L119-A123 PolarHBondContact O-N 3.29Å; Y121-A123 VanDerWaalsContact C-N 3.31Å; Y121-A123 PolarHBondContact O-N 3.17Å; A123-P126 WeakPolarHBondContact O-CD 3.29Å; A123-A127 WeakPolarHBondContact O-CB 3.4Å; A123-A127 PolarHBondContact O-N 3.14Å
124	A	47.8	Very low	49.2	Very low	12 Å²	12	72.8 Å²	72.8	10%	0.099	40%	0.401	C	S	.	.	H	α-helix	trans	-70.6	-34	-179.8	0	0	0	0	0	113.1	A79 S120 Y121 A127 A128	A79-A124 HydrophobicContact CB-CB 4.24Å; S120-A124 WeakPolarHBondContact O-CB 3.46Å; S120-A124 PolarHBondContact O-N 2.93Å; Y121-A124 PolarHBondContact O-N 3.49Å; A124-A127 PolarHBondContact O-N 3.38Å; A124-A128 VanDerWaalsContact O-CB 3.25Å; A124-A128 WeakPolarHBondContact O-CB 3.27Å; A124-A128 PolarHBondContact O-N 2.84Å
125	L	48	Very low	48.7	Very low	105 Å²	105	68.9 Å²	68.9	55%	0.55	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-48.1	179.6	-80	164.3	0	0	0	113.5	Y121 A128 A129	Y121-L125 WeakPolarHBondContact O-CG 3.43Å; Y121-L125 PolarHBondContact O-N 3.44Å; Y121-L125 VanDerWaalsContact O-N 3.13Å; L125-A128 PolarHBondContact O-N 2.97Å; L125-A129 WeakPolarHBondContact O-CB 3.39Å; L125-A129 PolarHBondContact O-N 2.92Å
126	P	49.5	Very low	48.4	Very low	61 Å²	61	65.8 Å²	65.8	40%	0.396	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-39.5	171.7	-21.4	31	0	0	0	112.8	V122 A123 A129 L130	V122-P126 WeakPolarHBondContact O-CD 3.39Å; V122-P126 WeakPolarHBondContact O-CG 3.46Å; A123-P126 WeakPolarHBondContact O-CD 3.29Å; P126-A129 PolarHBondContact O-N 3.22Å; P126-L130 WeakPolarHBondContact O-CB 3.47Å; P126-L130 PolarHBondContact O-N 2.98Å
127	A	45.6	Very low	47.9	Very low	55 Å²	55	69.5 Å²	69.5	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-65.1	-41	178	0	0	0	0	0	111.9	A123 A124 L130 W131	A123-A127 WeakPolarHBondContact O-CB 3.4Å; A123-A127 PolarHBondContact O-N 3.14Å; A124-A127 PolarHBondContact O-N 3.38Å; A127-L130 PolarHBondContact O-N 3.13Å; A127-W131 VanDerWaalsContact O-CB 3.27Å; A127-W131 WeakPolarHBondContact O-CB 3.37Å; A127-W131 PolarHBondContact O-N 3.26Å
128	A	45.1	Very low	47.2	Very low	13 Å²	13	79.1 Å²	79.1	11%	0.107	43%	0.432	C	S	.	.	H	α-helix	trans	-67.4	-36.6	173.5	0	0	0	0	0	112.2	L76 A124 L125 H132	L76-A128 HydrophobicContact CD1-CB 3.94Å; L76-A128 HydrophobicContact CG-CB 4.5Å; A124-A128 VanDerWaalsContact O-CB 3.25Å; A124-A128 WeakPolarHBondContact O-CB 3.27Å; A124-A128 PolarHBondContact O-N 2.84Å; L125-A128 PolarHBondContact O-N 2.97Å; A128-H132 WeakPolarHBondContact O-CB 3.38Å; A128-H132 PolarHBondContact O-N 3.44Å
129	A	47.6	Very low	46.3	Very low	51 Å²	51	77.9 Å²	77.9	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-69.8	-39.2	174.5	0	0	0	0	0	112.6	L125 P126 H132 K133	L125-A129 WeakPolarHBondContact O-CB 3.39Å; L125-A129 PolarHBondContact O-N 2.92Å; P126-A129 PolarHBondContact O-N 3.22Å; A129-H132 PolarHBondContact O-N 2.77Å; A129-K133 PolarHBondContact O-N 2.78Å; A129-K133 VanDerWaalsContact O-N 3.11Å
130	L	45.8	Very low	45.3	Very low	109 Å²	109	79.7 Å²	79.7	57%	0.571	45%	0.447	S	S	*	.	H	α-helix	trans	-63.7	-46.3	172.7	-123.1	103	0	0	0	110	P126 A127 K133 L134	P126-L130 WeakPolarHBondContact O-CB 3.47Å; P126-L130 PolarHBondContact O-N 2.98Å; A127-L130 PolarHBondContact O-N 3.13Å; L130-K133 PolarHBondContact O-N 2.99Å; L130-L134 HydrophobicContact CD2-CD1 3.84Å; L130-L134 HydrophobicContact CG-CD1 4.41Å; L130-L134 VanDerWaalsContact O-CB 3.27Å; L130-L134 WeakPolarHBondContact O-CB 3.32Å; L130-L134 WeakPolarHBondContact O-CG 3.32Å; L130-L134 PolarHBondContact O-N 3.41Å
131	W	46.1	Very low	44.6	Very low	156 Å²	156	83.6 Å²	83.6	59%	0.591	47%	0.474	S	S	*	.	H	α-helix	trans	-67.7	-32.8	178.4	-168.1	-86.3	0	0	0	112.8	P75 A127 L134 G135	P75-W131 HydrophobicContact CB-CG 4.26Å; P75-W131 HydrophobicContact CG-CG 4.15Å; A127-W131 VanDerWaalsContact O-CB 3.27Å; A127-W131 WeakPolarHBondContact O-CB 3.37Å; A127-W131 PolarHBondContact O-N 3.26Å; W131-L134 PolarHBondContact O-N 3.23Å; W131-G135 WeakPolarHBondContact O-CA 3.47Å; W131-G135 PolarHBondContact O-N 2.97Å
132	H	47.4	Very low	43.6	Very low	87 Å²	87	85.6 Å²	85.6	40%	0.403	51%	0.507	S	S	.	.	H	α-helix	trans	-68	-38.6	173.1	-173	-72.8	0	0	0	111.4	A128 A129 G136	A128-H132 WeakPolarHBondContact O-CB 3.38Å; A128-H132 PolarHBondContact O-N 3.44Å; A129-H132 PolarHBondContact O-N 2.77Å; H132-G136 PolarHBondContact O-N 3.11Å
133	K	47.4	Very low	43.1	Very low	144 Å²	144	89.1 Å²	89.1	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-71.1	-37.1	173.2	-84.3	-162	174.9	-178	0	112.9	A129 L130 F137	A129-K133 PolarHBondContact O-N 2.78Å; A129-K133 VanDerWaalsContact O-N 3.11Å; L130-K133 PolarHBondContact O-N 2.99Å; K133-F137 VanDerWaalsContact O-CD2 3.27Å; K133-F137 WeakPolarHBondContact O-CD2 3.35Å; K133-F137 WeakPolarHBondContact O-CE2 3.37Å
134	L	40.5	Very low	43.1	Very low	78 Å²	78	92.3 Å²	92.3	41%	0.408	52%	0.52	S	S	.	.	H	α-helix	trans	-75.3	-33.3	176.8	-81.2	157	0	0	0	112.6	L130 W131 G136 F137	L130-L134 HydrophobicContact CD2-CD1 3.84Å; L130-L134 HydrophobicContact CG-CD1 4.41Å; L130-L134 VanDerWaalsContact O-CB 3.27Å; L130-L134 WeakPolarHBondContact O-CB 3.32Å; L130-L134 WeakPolarHBondContact O-CG 3.32Å; L130-L134 PolarHBondContact O-N 3.41Å; W131-L134 PolarHBondContact O-N 3.23Å; L134-G136 VanDerWaalsContact C-N 3.26Å; L134-G136 PolarHBondContact O-N 3.04Å; L134-F137 HydrophobicContact CB-CD2 4.35Å; L134-F137 HydrophobicContact CB-CE2 4.47Å; L134-F137 HydrophobicContact CD2-CD2 4.01Å; L134-F137 HydrophobicContact CD2-CE1 4.42Å; L134-F137 HydrophobicContact CD2-CE2 3.64Å; L134-F137 HydrophobicContact CD2-CZ 3.87Å; L134-F137 HydrophobicContact CG-CD2 4.47Å; L134-F137 HydrophobicContact CG-CE2 4.13Å; L134-F137 WeakPolarHBondContact O-CA 3.38Å; L134-F137 WeakPolarHBondContact O-CB 3.5Å; L134-F137 WeakPolarHBondContact O-CD2 3.35Å; L134-F137 WeakPolarHBondContact O-CG 3.35Å; L134-F137 PolarHBondContact O-N 2.9Å
135	G	38	Very low	43.5	Very low	31 Å²	31	92.5 Å²	92.5	32%	0.32	52%	0.524	S	S	.	.	H	α-helix	trans	-69.3	-27.3	175.1	0	0	0	0	0	112.1	W131 F137 W138 A139	W131-G135 WeakPolarHBondContact O-CA 3.47Å; W131-G135 PolarHBondContact O-N 2.97Å; G135-F137 PolarHBondContact O-N 3.46Å; G135-W138 PolarHBondContact O-N 3.3Å; G135-W138 VanDerWaalsContact O-N 3.08Å; G135-A139 PolarHBondContact O-N 2.95Å
136	G	42	Very low	43.8	Very low	53 Å²	53	90 Å²	90	55%	0.546	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-17.2	164.1	0	0	0	0	0	114.2	H132 L134 W138	H132-G136 PolarHBondContact O-N 3.11Å; L134-G136 VanDerWaalsContact C-N 3.26Å; L134-G136 PolarHBondContact O-N 3.04Å; G136-W138 VanDerWaalsContact C-N 3.3Å
137	F	41	Very low	44.5	Very low	102 Å²	102	88.9 Å²	88.9	45%	0.447	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.6	172.9	-70.2	-122.9	0	0	0	112.6	K133 L134 G135 Y442	K133-F137 VanDerWaalsContact O-CD2 3.27Å; K133-F137 WeakPolarHBondContact O-CD2 3.35Å; K133-F137 WeakPolarHBondContact O-CE2 3.37Å; L134-F137 HydrophobicContact CB-CD2 4.35Å; L134-F137 HydrophobicContact CB-CE2 4.47Å; L134-F137 HydrophobicContact CD2-CD2 4.01Å; L134-F137 HydrophobicContact CD2-CE1 4.42Å; L134-F137 HydrophobicContact CD2-CE2 3.64Å; L134-F137 HydrophobicContact CD2-CZ 3.87Å; L134-F137 HydrophobicContact CG-CD2 4.47Å; L134-F137 HydrophobicContact CG-CE2 4.13Å; L134-F137 WeakPolarHBondContact O-CA 3.38Å; L134-F137 WeakPolarHBondContact O-CB 3.5Å; L134-F137 WeakPolarHBondContact O-CD2 3.35Å; L134-F137 WeakPolarHBondContact O-CG 3.35Å; L134-F137 PolarHBondContact O-N 2.9Å; G135-F137 PolarHBondContact O-N 3.46Å; F137-Y442 AromaticContact CE1-CD2 3.88Å; F137-Y442 HydrophobicContact CE1-CD2 3.88Å; F137-Y442 HydrophobicContact CE1-CE2 4.18Å; F137-Y442 AromaticContact CZ-CD2 3.95Å; F137-Y442 HydrophobicContact CZ-CD2 3.95Å; F137-Y442 HydrophobicContact CZ-CE2 4.2Å
138	W	37.8	Very low	45.6	Very low	233 Å²	233	90 Å²	90	88%	0.883	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-5.3	-174.9	-73.1	72.5	0	0	0	113.1	G135 G136 P140	G135-W138 PolarHBondContact O-N 3.3Å; G135-W138 VanDerWaalsContact O-N 3.08Å; G136-W138 VanDerWaalsContact C-N 3.3Å; W138-P140 WeakPolarHBondContact O-CD 3.23Å
139	A	36.3	Very low	46.8	Very low	59 Å²	59	89.9 Å²	89.9	49%	0.488	51%	0.513	S	S	.	.	S	Bend	trans	-76.5	118.1	177.1	0	0	0	0	0	110	G135 S141	G135-A139 PolarHBondContact O-N 2.95Å; A139-S141 PolarHBondContact O-N 3.21Å
140	P	33.9	Very low	47.9	Very low	124 Å²	124	89.5 Å²	89.5	81%	0.805	50%	0.504	S	S	*	.			trans	-69.6	100.7	176.6	27.3	-30.7	0	0	0	109.1	W138 G142	W138-P140 WeakPolarHBondContact O-CD 3.23Å; P140-G142 PolarHBondContact O-N 3.49Å
141	S	35.8	Very low	49.2	Very low	95 Å²	95	88.1 Å²	88.1	66%	0.664	50%	0.503	S	S	*	.			trans	-90.2	95.2	174.7	59.2	0	0	0	0	110.8	A139 H143	A139-S141 PolarHBondContact O-N 3.21Å; S141-H143 PolarHBondContact O-N 2.94Å; S141-H143 VanDerWaalsContact O-O 3.1Å
142	G	36.4	Very low	50.7	Low	82 Å²	82	84.6 Å²	84.6	85%	0.845	49%	0.489	S	S	*	.	S	Bend	trans	58.7	-29	146.9	0	0	0	0	0	122.3	P140	P140-G142 PolarHBondContact O-N 3.49Å
143	H	41.9	Very low	52.1	Low	160 Å²	160	80.7 Å²	80.7	74%	0.741	47%	0.471	S	S	*	.	S	Bend	trans	-121.1	142	166.7	-78.4	-14.1	0	0	0	106.3	S141 G145	S141-H143 PolarHBondContact O-N 2.94Å; S141-H143 VanDerWaalsContact O-O 3.1Å; H143-G145 WeakPolarHBondContact O-CA 3.34Å; H143-G145 PolarHBondContact O-N 3.29Å
144	K	50.6	Low	53.3	Low	128 Å²	128	77.2 Å²	77.2	56%	0.557	46%	0.459	S	S	*	.	S	Bend	trans	-34	102.3	-177.6	-74.6	178.3	174.4	177	0	109.5	M149 D460	K144-M149 HydrophobicContact CB-CE 4.35Å; K144-M149 WeakPolarHBondContact O-CE 3.44Å; K144-D460 IonicContact NZ-OD2 2.6Å; K144-D460 PolarHBondContact NZ-OD2 2.99Å
145	G	56.1	Low	55	Low	17 Å²	17	75.2 Å²	75.2	18%	0.175	46%	0.457	C	S	.	.			trans	-67.4	157.2	-156.3	0	0	0	0	0	112.3	H143 G147 D148 M149	H143-G145 WeakPolarHBondContact O-CA 3.34Å; H143-G145 PolarHBondContact O-N 3.29Å; G145-G147 PolarHBondContact O-N 3.12Å; G145-G147 VanDerWaalsContact O-N 3.08Å; G145-D148 WeakPolarHBondContact O-CA 3.47Å; G145-D148 WeakPolarHBondContact O-CB 3.45Å; G145-D148 PolarHBondContact O-N 3.27Å; G145-M149 PolarHBondContact O-N 2.74Å; G145-M149 VanDerWaalsContact O-N 3.15Å
146	A	56.1	Low	56.8	Low	51 Å²	51	75.9 Å²	75.9	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-55.5	-31.4	177.1	0	0	0	0	0	113.1	L150 V449	A146-L150 WeakPolarHBondContact O-CG 3.3Å; A146-L150 PolarHBondContact O-N 3.24Å; A146-L150 VanDerWaalsContact O-N 3.13Å; A146-V449 VanDerWaalsContact CA-CG1 3.49Å; A146-V449 HydrophobicContact CB-CB 4.26Å; A146-V449 HydrophobicContact CB-CG1 3.6Å
147	G	62.2	Low	58.3	Low	38 Å²	38	74 Å²	74	39%	0.392	43%	0.429	S	S	.	.	H	α-helix	trans	-67.7	-36.1	172.5	0	0	0	0	0	113.8	G145 L150 C151	G145-G147 PolarHBondContact O-N 3.12Å; G145-G147 VanDerWaalsContact O-N 3.08Å; G147-L150 PolarHBondContact O-N 3.37Å; G147-C151 WeakPolarHBondContact O-CB 3.41Å; G147-C151 PolarHBondContact O-N 3.2Å; G147-C151 PolarHBondContact O-SG 3.41Å
148	D	68.9	Low	59.4	Low	79 Å²	79	73.7 Å²	73.7	42%	0.422	43%	0.432	S	S	.	.	H	α-helix	trans	-67.6	-43.4	177.1	-171.7	40.5	0	0	0	110.7	G145 L150 C151 R152	G145-D148 WeakPolarHBondContact O-CA 3.47Å; G145-D148 WeakPolarHBondContact O-CB 3.45Å; G145-D148 PolarHBondContact O-N 3.27Å; D148-L150 PolarHBondContact O-N 3.17Å; D148-C151 CarbonylContact O-C 3.59Å; D148-C151 WeakPolarHBondContact O-CB 3.42Å; D148-C151 PolarHBondContact O-N 3.14Å; D148-R152 WeakPolarHBondContact O-CB 3.49Å; D148-R152 VanDerWaalsContact O-CG 3.26Å; D148-R152 WeakPolarHBondContact O-CG 3.36Å; D148-R152 PolarHBondContact O-N 3.46Å
149	M	71.3	Confident	60.6	Low	10 Å²	10	67.8 Å²	67.8	5%	0.049	43%	0.426	C	S	.	.	H	α-helix	trans	-62.7	-42.7	175.3	-67	179.6	-171.4	0	0	112.5	K144 G145 R152 M153 V449 E453 F456	K144-M149 HydrophobicContact CB-CE 4.35Å; K144-M149 WeakPolarHBondContact O-CE 3.44Å; G145-M149 PolarHBondContact O-N 2.74Å; G145-M149 VanDerWaalsContact O-N 3.15Å; M149-R152 PolarHBondContact O-N 2.96Å; M149-M153 WeakPolarHBondContact O-CG 3.34Å; M149-M153 PolarHBondContact O-N 3.21Å; M149-V449 HydrophobicContact CB-CG1 3.83Å; M149-V449 HydrophobicContact CG-CG1 4.33Å; M149-V449 HydrophobicContact SD-CG1 3.66Å; M149-E453 HydrophobicContact CE-CB 3.56Å; M149-E453 HydrophobicContact CE-CG 3.48Å; M149-E453 VanDerWaalsContact CE-CG 3.48Å; M149-E453 HydrophobicContact SD-CB 3.93Å; M149-F456 HydrophobicContact CB-CE2 4.42Å; M149-F456 HydrophobicContact CG-CD2 4.49Å
150	L	70.9	Confident	62.2	Low	44 Å²	44	67 Å²	67	23%	0.23	41%	0.412	C	S	.	.	H	α-helix	trans	-62.9	-42.8	173.3	-75.5	170.7	0	0	0	111.4	A146 G147 D148 R152 M153 L154 I276 M445 V449	A146-L150 WeakPolarHBondContact O-CG 3.3Å; A146-L150 PolarHBondContact O-N 3.24Å; A146-L150 VanDerWaalsContact O-N 3.13Å; G147-L150 PolarHBondContact O-N 3.37Å; D148-L150 PolarHBondContact O-N 3.17Å; L150-R152 VanDerWaalsContact C-N 3.31Å; L150-R152 PolarHBondContact O-N 2.97Å; L150-M153 PolarHBondContact O-N 3.37Å; L150-L154 WeakPolarHBondContact O-CB 3.25Å; L150-L154 VanDerWaalsContact O-CG 3.22Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.02Å; L150-I276 HydrophobicContact CD2-CG2 4.02Å; L150-M445 HydrophobicContact CD1-CG 4.35Å; L150-M445 HydrophobicContact CD2-SD 4.29Å; L150-V449 HydrophobicContact CD1-CG2 4.07Å; L150-V449 HydrophobicContact CD2-CG2 3.88Å; L150-V449 HydrophobicContact CG-CG2 3.72Å
151	C	72.6	Confident	64	Low	80 Å²	80	66.6 Å²	66.6	54%	0.541	40%	0.397	S	S	.	.	H	α-helix	trans	-61.8	-38.6	174.7	-77.4	0	0	0	0	112.2	G147 D148 L154 G155	G147-C151 WeakPolarHBondContact O-CB 3.41Å; G147-C151 PolarHBondContact O-N 3.2Å; G147-C151 PolarHBondContact O-SG 3.41Å; D148-C151 CarbonylContact O-C 3.59Å; D148-C151 WeakPolarHBondContact O-CB 3.42Å; D148-C151 PolarHBondContact O-N 3.14Å; C151-L154 CarbonylContact O-C 3.57Å; C151-L154 PolarHBondContact O-N 2.83Å; C151-G155 PolarHBondContact O-N 3Å
152	R	78.2	Confident	66.1	Low	81 Å²	81	64.7 Å²	64.7	31%	0.306	39%	0.393	S	S	.	.	H	α-helix	trans	-67.4	-42.1	175	-71.2	-177.8	71.2	-173.7	2.3	112.1	D148 M149 L150 G155 F156 F456 D460	D148-R152 WeakPolarHBondContact O-CB 3.49Å; D148-R152 VanDerWaalsContact O-CG 3.26Å; D148-R152 WeakPolarHBondContact O-CG 3.36Å; D148-R152 PolarHBondContact O-N 3.46Å; M149-R152 PolarHBondContact O-N 2.96Å; L150-R152 VanDerWaalsContact C-N 3.31Å; L150-R152 PolarHBondContact O-N 2.97Å; R152-G155 WeakPolarHBondContact O-CA 3.43Å; R152-G155 PolarHBondContact O-N 3.27Å; R152-G155 VanDerWaalsContact O-N 3.11Å; R152-F156 VanDerWaalsContact O-CD2 3.25Å; R152-F156 WeakPolarHBondContact O-CD2 3.47Å; R152-F156 PolarHBondContact O-N 3.36Å; R152-F456 HydrophobicContact CB-CE1 4.02Å; R152-F456 HydrophobicContact CB-CZ 3.89Å; R152-D460 IonicContact CZ-OD1 3.65Å; R152-D460 IonicContact CZ-OD2 3.59Å; R152-D460 IonicContact NH1-OD1 3.89Å; R152-D460 PolarHBondContact NH1-OD1 3.46Å; R152-D460 IonicContact NH1-OD2 3.34Å; R152-D460 PolarHBondContact NH1-OD2 3.4Å; R152-D460 IonicContact NH2-OD1 2.77Å; R152-D460 PolarHBondContact NH2-OD1 2.88Å; R152-D460 IonicContact NH2-OD2 2.75Å
153	M	75.6	Confident	68.4	Low	6 Å²	6	65.9 Å²	65.9	3%	0.03	37%	0.371	C	S	.	.	H	α-helix	trans	-63.5	-44.8	173.7	-70.6	-165.4	87.6	0	0	111.7	M149 L150 G155 F156 V272 I276 F456	M149-M153 WeakPolarHBondContact O-CG 3.34Å; M149-M153 PolarHBondContact O-N 3.21Å; L150-M153 PolarHBondContact O-N 3.37Å; M153-G155 PolarHBondContact O-N 3.35Å; M153-F156 WeakPolarHBondContact O-CB 3.25Å; M153-F156 PolarHBondContact O-N 3.4Å; M153-V272 HydrophobicContact CE-CG1 4.12Å; M153-V272 HydrophobicContact SD-CG1 4.37Å; M153-I276 HydrophobicContact CE-CD1 4.03Å; M153-I276 HydrophobicContact SD-CD1 3.25Å; M153-I276 WeakPolarHBondContact SD-CD1 3.45Å; M153-F456 HydrophobicContact CG-CE2 3.54Å; M153-F456 HydrophobicContact CG-CZ 3.46Å; M153-F456 VanDerWaalsContact CG-CZ 3.46Å; M153-F456 HydrophobicContact SD-CE2 4.15Å
154	L	72.8	Confident	70.4	Confident	71 Å²	71	60.7 Å²	60.7	37%	0.372	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-25.1	172.7	-68.7	172.6	0	0	0	112.3	L150 C151 F156 L157 L280	L150-L154 WeakPolarHBondContact O-CB 3.25Å; L150-L154 VanDerWaalsContact O-CG 3.22Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.02Å; C151-L154 CarbonylContact O-C 3.57Å; C151-L154 PolarHBondContact O-N 2.83Å; L154-F156 PolarHBondContact O-N 3.35Å; L154-L157 HydrophobicContact CD2-CD1 3.8Å; L154-L157 VanDerWaalsContact O-CB 3.3Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 2.79Å; L154-L280 HydrophobicContact CD2-CD2 3.97Å
155	G	77	Confident	72.1	Confident	36 Å²	36	60.9 Å²	60.9	37%	0.371	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-30.2	170.9	0	0	0	0	0	112.8	C151 R152 M153 L157 D158	C151-G155 PolarHBondContact O-N 3Å; R152-G155 WeakPolarHBondContact O-CA 3.43Å; R152-G155 PolarHBondContact O-N 3.27Å; R152-G155 VanDerWaalsContact O-N 3.11Å; M153-G155 PolarHBondContact O-N 3.35Å; G155-L157 PolarHBondContact O-N 3.09Å; G155-D158 WeakPolarHBondContact O-CB 3.35Å; G155-D158 PolarHBondContact O-N 2.85Å; G155-D158 VanDerWaalsContact O-N 3.17Å
156	F	75.8	Confident	73.7	Confident	45 Å²	45	64.2 Å²	64.2	20%	0.197	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-15	174.3	-68.7	-84.1	0	0	0	113.3	R152 M153 L154 D158 M233 R236 V237 E240 F456 L459	R152-F156 VanDerWaalsContact O-CD2 3.25Å; R152-F156 WeakPolarHBondContact O-CD2 3.47Å; R152-F156 PolarHBondContact O-N 3.36Å; M153-F156 WeakPolarHBondContact O-CB 3.25Å; M153-F156 PolarHBondContact O-N 3.4Å; L154-F156 PolarHBondContact O-N 3.35Å; F156-D158 VanDerWaalsContact C-N 3.34Å; F156-M233 HydrophobicContact CB-CG 4.19Å; F156-R236 HydrophobicContact CD1-CG 4.37Å; F156-R236 PolarHBondContact O-NH1 2.59Å; F156-V237 HydrophobicContact CB-CG2 4.29Å; F156-V237 HydrophobicContact CD1-CG2 4.4Å; F156-V237 HydrophobicContact CD2-CG2 4.04Å; F156-V237 HydrophobicContact CE2-CG2 4.47Å; F156-V237 HydrophobicContact CG-CG2 3.99Å; F156-E240 HydrophobicContact CE1-CB 4.47Å; F156-E240 HydrophobicContact CE1-CG 4.2Å; F156-F456 HydrophobicContact CE2-CE1 4.14Å; F156-F456 HydrophobicContact CE2-CZ 4.39Å; F156-L459 HydrophobicContact CZ-CD1 4.45Å
157	L	73.3	Confident	75.3	Confident	13 Å²	13	62 Å²	62	7%	0.068	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	2.2	173.6	-74.7	117.4	0	0	0	114.5	L154 G155 S159 K160 L164 T229 M233	L154-L157 HydrophobicContact CD2-CD1 3.8Å; L154-L157 VanDerWaalsContact O-CB 3.3Å; L154-L157 WeakPolarHBondContact O-CB 3.48Å; L154-L157 PolarHBondContact O-N 2.79Å; G155-L157 PolarHBondContact O-N 3.09Å; L157-S159 PolarHBondContact O-N 3.17Å; L157-K160 PolarHBondContact O-N 2.87Å; L157-L164 HydrophobicContact CD2-CD1 4.04Å; L157-L164 HydrophobicContact CD2-CG 4.4Å; L157-T229 HydrophobicContact CD2-CG2 3.54Å; L157-M233 HydrophobicContact CD1-CB 4.46Å; L157-M233 HydrophobicContact CD1-CG 3.99Å; L157-M233 HydrophobicContact CD1-SD 3.44Å; L157-M233 WeakPolarHBondContact CD1-SD 3.22Å; L157-M233 HydrophobicContact CG-CB 4.28Å; L157-M233 HydrophobicContact CG-CG 4.19Å; L157-M233 HydrophobicContact CG-SD 4.25Å
158	D	64.3	Low	76.5	Confident	95 Å²	95	64.1 Å²	64.1	51%	0.508	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-52.7	-30.6	-166.2	-125.1	-18.6	0	0	0	115.4	G155 F156 K160 K161	G155-D158 WeakPolarHBondContact O-CB 3.35Å; G155-D158 PolarHBondContact O-N 2.85Å; G155-D158 VanDerWaalsContact O-N 3.17Å; F156-D158 VanDerWaalsContact C-N 3.34Å; D158-K160 VanDerWaalsContact C-N 3.32Å; D158-K160 PolarHBondContact O-N 3.25Å; D158-K161 WeakPolarHBondContact OD1-CE 3.21Å; D158-K161 IonicContact OD1-NZ 3.08Å; D158-K161 PolarHBondContact OD1-NZ 3.17Å
159	S	63	Low	77.5	Confident	109 Å²	109	64.7 Å²	64.7	76%	0.762	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-75.7	-12.9	179.9	-179.7	0	0	0	0	114.3	L157	L157-S159 PolarHBondContact O-N 3.17Å
160	K	69.3	Low	78.5	Confident	44 Å²	44	65.5 Å²	65.5	19%	0.191	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-131.1	21.1	-171.2	-67.8	-175	176.7	-172.9	0	115.1	L157 D158 G162 R163 T229 H232	L157-K160 PolarHBondContact O-N 2.87Å; D158-K160 VanDerWaalsContact C-N 3.32Å; D158-K160 PolarHBondContact O-N 3.25Å; K160-G162 PolarHBondContact O-N 2.98Å; K160-R163 HydrophobicContact CB-CG 4.49Å; K160-R163 VanDerWaalsContact NZ-NH1 3.14Å; K160-R163 WeakPolarHBondContact O-CB 3.28Å; K160-R163 PolarHBondContact O-N 2.91Å; K160-T229 HydrophobicContact CB-CG2 4.47Å; K160-H232 PolarHBondContact NZ-CE1 3.03Å; K160-H232 PolarHBondContact NZ-ND1 2.91Å
161	K	72.7	Confident	79.4	Confident	115 Å²	115	63.7 Å²	63.7	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-49.9	-33.8	178.4	-73.5	174.5	165.6	168.1	0	114.1	D158 R163 L164 H165	D158-K161 WeakPolarHBondContact OD1-CE 3.21Å; D158-K161 IonicContact OD1-NZ 3.08Å; D158-K161 PolarHBondContact OD1-NZ 3.17Å; K161-R163 VanDerWaalsContact C-N 3.28Å; K161-R163 PolarHBondContact O-N 3.42Å; K161-L164 PolarHBondContact O-N 3.33Å; K161-H165 PolarHBondContact O-CD2 3.13Å; K161-H165 PolarHBondContact O-N 3.38Å
162	G	79.2	Confident	80.1	Confident	55 Å²	55	63.5 Å²	63.5	57%	0.567	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-31.9	175.2	0	0	0	0	0	114.5	K160 H165 L166	K160-G162 PolarHBondContact O-N 2.98Å; G162-H165 PolarHBondContact O-N 3.4Å; G162-L166 PolarHBondContact O-N 3.26Å; G162-L166 VanDerWaalsContact O-N 3.14Å
163	R	85.1	Confident	80.6	Confident	106 Å²	106	64.1 Å²	64.1	40%	0.4	35%	0.351	S	S	.	.	H	α-helix	trans	-72.2	-35.8	177.3	-62.4	-173	-174.5	-170.5	-4.9	112.1	K160 K161 L166 V167 I225	K160-R163 HydrophobicContact CB-CG 4.49Å; K160-R163 VanDerWaalsContact NZ-NH1 3.14Å; K160-R163 WeakPolarHBondContact O-CB 3.28Å; K160-R163 PolarHBondContact O-N 2.91Å; K161-R163 VanDerWaalsContact C-N 3.28Å; K161-R163 PolarHBondContact O-N 3.42Å; R163-L166 WeakPolarHBondContact O-CB 3.13Å; R163-L166 PolarHBondContact O-N 3.34Å; R163-V167 WeakPolarHBondContact O-CG2 3.38Å; R163-V167 PolarHBondContact O-N 3.28Å; R163-I225 HydrophobicContact CB-CG2 4.27Å
164	L	83.3	Confident	81.4	Confident	51 Å²	51	63.8 Å²	63.8	27%	0.267	35%	0.349	S	S	.	.	H	α-helix	trans	-65.5	-39.9	174.6	-75.4	172.9	0	0	0	111.7	L157 K161 L166 V167 L168	L157-L164 HydrophobicContact CD2-CD1 4.04Å; L157-L164 HydrophobicContact CD2-CG 4.4Å; K161-L164 PolarHBondContact O-N 3.33Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.45Å; L164-V167 PolarHBondContact O-N 2.87Å; L164-L168 PolarHBondContact O-N 3.4Å
165	H	85.9	Confident	82.1	Confident	133 Å²	133	60.4 Å²	60.4	62%	0.616	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-41.9	172.8	-73.9	-59.4	0	0	0	111.9	K161 G162 L168 V169	K161-H165 PolarHBondContact O-CD2 3.13Å; K161-H165 PolarHBondContact O-N 3.38Å; G162-H165 PolarHBondContact O-N 3.4Å; H165-L168 PolarHBondContact O-N 3.49Å; H165-V169 WeakPolarHBondContact O-CG2 3.46Å; H165-V169 PolarHBondContact O-N 3.15Å
166	L	89.7	Confident	82.6	Confident	86 Å²	86	62.6 Å²	62.6	45%	0.45	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-44.8	175	-177.8	65.7	0	0	0	111.9	G162 R163 L164 L168 V169 L170 I225	G162-L166 PolarHBondContact O-N 3.26Å; G162-L166 VanDerWaalsContact O-N 3.14Å; R163-L166 WeakPolarHBondContact O-CB 3.13Å; R163-L166 PolarHBondContact O-N 3.34Å; L164-L166 VanDerWaalsContact C-N 3.32Å; L164-L166 PolarHBondContact O-N 3.45Å; L166-L168 VanDerWaalsContact C-N 3.32Å; L166-L168 PolarHBondContact O-N 3.02Å; L166-V169 PolarHBondContact O-N 3.22Å; L166-L170 HydrophobicContact CD1-CD1 4.42Å; L166-L170 HydrophobicContact CD1-CG 4.46Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 WeakPolarHBondContact O-CB 3.43Å; L166-L170 WeakPolarHBondContact O-CG 3.39Å; L166-L170 PolarHBondContact O-N 3.08Å; L166-I225 HydrophobicContact CD2-CD1 3.93Å
167	V	89.8	Confident	83.1	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.03	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-45	175	171.2	0	0	0	0	110.8	R163 L164 V169 L170 L171 I225 Y226	R163-V167 WeakPolarHBondContact O-CG2 3.38Å; R163-V167 PolarHBondContact O-N 3.28Å; L164-V167 PolarHBondContact O-N 2.87Å; V167-V169 VanDerWaalsContact C-N 3.34Å; V167-V169 PolarHBondContact O-N 3.11Å; V167-L170 PolarHBondContact O-N 3.37Å; V167-L171 WeakPolarHBondContact O-CB 3.39Å; V167-L171 PolarHBondContact O-N 3Å; V167-I225 HydrophobicContact CG2-CB 4.02Å; V167-I225 HydrophobicContact CG2-CG2 3.66Å; V167-Y226 HydrophobicContact CG1-CD2 4.28Å
168	L	88.4	Confident	83.7	Confident	83 Å²	83	61.6 Å²	61.6	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-39.6	179.4	-170.7	127.5	0	0	0	112.3	L164 H165 L166 I172	L164-L168 PolarHBondContact O-N 3.4Å; H165-L168 PolarHBondContact O-N 3.49Å; L166-L168 VanDerWaalsContact C-N 3.32Å; L166-L168 PolarHBondContact O-N 3.02Å; L168-I172 HydrophobicContact CD2-CD1 3.84Å; L168-I172 HydrophobicContact CG-CD1 4.39Å; L168-I172 VanDerWaalsContact O-CG1 3.31Å; L168-I172 WeakPolarHBondContact O-CG1 3.28Å; L168-I172 PolarHBondContact O-N 2.82Å; L168-I172 VanDerWaalsContact O-N 3.08Å
169	V	90.1	Very high	84.7	Confident	90 Å²	90	57.1 Å²	57.1	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-65.8	-47.3	175.3	172.1	0	0	0	0	111.3	H165 L166 V167 L171 I172 L173	H165-V169 WeakPolarHBondContact O-CG2 3.46Å; H165-V169 PolarHBondContact O-N 3.15Å; L166-V169 PolarHBondContact O-N 3.22Å; V167-V169 VanDerWaalsContact C-N 3.34Å; V167-V169 PolarHBondContact O-N 3.11Å; V169-L171 VanDerWaalsContact C-N 3.29Å; V169-L171 PolarHBondContact O-N 3.49Å; V169-I172 PolarHBondContact O-N 3.39Å; V169-L173 WeakPolarHBondContact O-CB 3.43Å; V169-L173 PolarHBondContact O-N 3.28Å
170	L	91.1	Very high	85.8	Confident	28 Å²	28	52.4 Å²	52.4	15%	0.147	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-39.9	177.6	-72.2	170.4	0	0	0	111.7	L166 V167 L173 S174 L218 I225	L166-L170 HydrophobicContact CD1-CD1 4.42Å; L166-L170 HydrophobicContact CD1-CG 4.46Å; L166-L170 HydrophobicContact CG-CD1 4.05Å; L166-L170 WeakPolarHBondContact O-CB 3.43Å; L166-L170 WeakPolarHBondContact O-CG 3.39Å; L166-L170 PolarHBondContact O-N 3.08Å; V167-L170 PolarHBondContact O-N 3.37Å; L170-L173 PolarHBondContact O-N 3.15Å; L170-S174 PolarHBondContact O-N 3.16Å; L170-L218 HydrophobicContact CD2-CD2 3.64Å; L170-I225 HydrophobicContact CD1-CD1 3.86Å
171	L	89.9	Confident	86.8	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-46.6	177.9	-176.3	154	0	0	0	111.8	V167 V169 L173 S174 C175 L284 W285	V167-L171 WeakPolarHBondContact O-CB 3.39Å; V167-L171 PolarHBondContact O-N 3Å; V169-L171 VanDerWaalsContact C-N 3.29Å; V169-L171 PolarHBondContact O-N 3.49Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 3.49Å; L171-S174 PolarHBondContact O-N 2.97Å; L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 2.8Å; L171-C175 PolarHBondContact O-SG 3.26Å; L171-L284 HydrophobicContact CD1-CB 4.21Å; L171-W285 HydrophobicContact CD1-CB 4.39Å; L171-W285 HydrophobicContact CD1-CD2 3.77Å; L171-W285 HydrophobicContact CD1-CE3 4.35Å; L171-W285 HydrophobicContact CD1-CG 3.78Å; L171-W285 HydrophobicContact CD1-CZ2 4.5Å; L171-W285 HydrophobicContact CG-CD2 4.04Å; L171-W285 HydrophobicContact CG-CE3 4.11Å; L171-W285 HydrophobicContact CG-CG 4.47Å; L171-W285 HydrophobicContact CG-CZ3 4.39Å
172	I	88.1	Confident	87.6	Confident	76 Å²	76	47.9 Å²	47.9	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-43.4	176.2	-67.7	166.7	0	0	0	110.5	L168 V169 C175 L176	L168-I172 HydrophobicContact CD2-CD1 3.84Å; L168-I172 HydrophobicContact CG-CD1 4.39Å; L168-I172 VanDerWaalsContact O-CG1 3.31Å; L168-I172 WeakPolarHBondContact O-CG1 3.28Å; L168-I172 PolarHBondContact O-N 2.82Å; L168-I172 VanDerWaalsContact O-N 3.08Å; V169-I172 PolarHBondContact O-N 3.39Å; I172-C175 PolarHBondContact O-N 2.69Å; I172-L176 WeakPolarHBondContact O-CG 3.37Å; I172-L176 PolarHBondContact O-N 3.4Å; I172-L176 VanDerWaalsContact O-N 3.14Å
173	L	89	Confident	88.1	Confident	93 Å²	93	48.8 Å²	48.8	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-64.9	-40.9	179.6	-171.1	64.2	0	0	0	111.8	V169 L170 L171 L176 G177 L218	V169-L173 WeakPolarHBondContact O-CB 3.43Å; V169-L173 PolarHBondContact O-N 3.28Å; L170-L173 PolarHBondContact O-N 3.15Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 3.49Å; L173-L176 PolarHBondContact O-N 3.48Å; L173-G177 PolarHBondContact O-N 3.34Å; L173-L218 HydrophobicContact CB-CD1 4.21Å; L173-L218 HydrophobicContact CD2-CD1 3.64Å; L173-L218 HydrophobicContact CD2-CD2 4.18Å; L173-L218 HydrophobicContact CG-CD1 3.66Å
174	S	91.5	Very high	88.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-44.6	174.5	-170.4	0	0	0	0	112.1	L170 L171 L176 G177 E178 S215 E219	L170-S174 PolarHBondContact O-N 3.16Å; L171-S174 PolarHBondContact O-N 2.97Å; S174-L176 PolarHBondContact O-N 2.92Å; S174-G177 CarbonylContact O-C 3.58Å; S174-G177 WeakPolarHBondContact O-CA 3.46Å; S174-G177 PolarHBondContact O-N 3.04Å; S174-E178 PolarHBondContact O-N 3.45Å; S174-S215 WeakPolarHBondContact OG-CB 3.35Å; S174-S215 PolarHBondContact OG-O 3.18Å; S174-S215 VanDerWaalsContact OG-O 3.14Å; S174-E219 WeakPolarHBondContact OG-CG 3.5Å; S174-E219 PolarHBondContact OG-OE1 3.48Å
175	C	88.7	Confident	88.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.1	-41.9	178.1	-74.4	0	0	0	0	111.1	L171 I172 G177 E178 M179 C292	L171-C175 WeakPolarHBondContact O-CB 3.47Å; L171-C175 PolarHBondContact O-N 2.8Å; L171-C175 PolarHBondContact O-SG 3.26Å; I172-C175 PolarHBondContact O-N 2.69Å; C175-G177 VanDerWaalsContact C-N 3.31Å; C175-G177 PolarHBondContact O-N 2.92Å; C175-E178 PolarHBondContact O-N 3.17Å; C175-M179 WeakPolarHBondContact O-CB 3.17Å; C175-M179 WeakPolarHBondContact O-CG 3.09Å; C175-M179 PolarHBondContact O-N 3.05Å; C175-C292 HydrophobicContact CB-CB 4.34Å
176	L	86	Confident	88.6	Confident	81 Å²	81	38 Å²	38	42%	0.424	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-38.1	175.4	-69.5	169.8	0	0	0	112.7	I172 L173 S174 F296	I172-L176 WeakPolarHBondContact O-CG 3.37Å; I172-L176 PolarHBondContact O-N 3.4Å; I172-L176 VanDerWaalsContact O-N 3.14Å; L173-L176 PolarHBondContact O-N 3.48Å; S174-L176 PolarHBondContact O-N 2.92Å; L176-F296 HydrophobicContact CD2-CE2 4.02Å; L176-F296 HydrophobicContact CD2-CZ 4.3Å
177	G	86.8	Confident	88.4	Confident	5 Å²	5	40 Å²	40	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-70.3	-42.6	176	0	0	0	0	0	113.3	L173 S174 C175 M179 A180	L173-G177 PolarHBondContact O-N 3.34Å; S174-G177 CarbonylContact O-C 3.58Å; S174-G177 WeakPolarHBondContact O-CA 3.46Å; S174-G177 PolarHBondContact O-N 3.04Å; C175-G177 VanDerWaalsContact C-N 3.31Å; C175-G177 PolarHBondContact O-N 2.92Å; G177-M179 VanDerWaalsContact C-N 3.26Å; G177-M179 PolarHBondContact O-N 2.99Å; G177-A180 WeakPolarHBondContact O-CB 3.24Å; G177-A180 PolarHBondContact O-N 3Å; G177-A180 VanDerWaalsContact O-N 3.09Å
178	E	85.7	Confident	88.3	Confident	32 Å²	32	41.3 Å²	41.3	15%	0.15	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-38.5	173.2	-71.3	-164.4	112.2	0	0	111.8	S174 C175 A180 I181 E219 R289	S174-E178 PolarHBondContact O-N 3.45Å; C175-E178 PolarHBondContact O-N 3.17Å; E178-A180 PolarHBondContact O-N 3.03Å; E178-I181 PolarHBondContact O-N 2.81Å; E178-E219 VanDerWaalsContact CG-OE1 3.29Å; E178-E219 WeakPolarHBondContact CG-OE1 3.4Å; E178-R289 VanDerWaalsContact CD-NH1 3.32Å; E178-R289 IonicContact OE1-CZ 2.59Å; E178-R289 IonicContact OE1-NH1 3Å; E178-R289 PolarHBondContact OE1-NH1 3Å; E178-R289 IonicContact OE1-NH2 3.4Å; E178-R289 IonicContact OE2-CZ 2.63Å; E178-R289 VanDerWaalsContact OE2-CZ 3.32Å; E178-R289 IonicContact OE2-NE 3.18Å; E178-R289 IonicContact OE2-NH1 3.37Å; E178-R289 PolarHBondContact OE2-NH1 3.37Å; E178-R289 IonicContact OE2-NH2 2.86Å
179	M	85.9	Confident	88.2	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.4	179.1	-68.4	-39.2	106.5	0	0	113.6	C175 G177 I181 P182 R289 C292 L293 F296 Y427	C175-M179 WeakPolarHBondContact O-CB 3.17Å; C175-M179 WeakPolarHBondContact O-CG 3.09Å; C175-M179 PolarHBondContact O-N 3.05Å; G177-M179 VanDerWaalsContact C-N 3.26Å; G177-M179 PolarHBondContact O-N 2.99Å; M179-I181 VanDerWaalsContact C-N 3.33Å; M179-P182 WeakPolarHBondContact O-CD 3.36Å; M179-R289 HydrophobicContact CE-CG 3.85Å; M179-C292 HydrophobicContact CG-CB 4.29Å; M179-L293 HydrophobicContact CE-CD2 4.23Å; M179-L293 HydrophobicContact CE-CG 4.19Å; M179-L293 HydrophobicContact SD-CD1 4.42Å; M179-L293 HydrophobicContact SD-CD2 3.16Å; M179-L293 WeakPolarHBondContact SD-CD2 3.42Å; M179-L293 HydrophobicContact SD-CG 3.47Å; M179-L293 WeakPolarHBondContact SD-CG 2.86Å; M179-F296 HydrophobicContact CB-CD2 3.85Å; M179-F296 HydrophobicContact CB-CE2 3.67Å; M179-F296 HydrophobicContact CB-CZ 4.33Å; M179-F296 HydrophobicContact CG-CD2 3.93Å; M179-F296 HydrophobicContact CG-CE2 4.03Å; M179-Y427 HydrophobicContact CB-CE1 4.19Å; M179-Y427 WeakPolarHBondContact O-CE1 3.46Å; M179-Y427 PolarHBondContact O-OH 2.85Å; M179-Y427 HydrophobicContact SD-CD1 4.31Å; M179-Y427 HydrophobicContact SD-CE1 4.14Å
180	A	87	Confident	87.9	Confident	10 Å²	10	36 Å²	36	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-68.7	-31.7	174.8	0	0	0	0	0	112.2	G177 E178 F183 F184 L211	G177-A180 WeakPolarHBondContact O-CB 3.24Å; G177-A180 PolarHBondContact O-N 3Å; G177-A180 VanDerWaalsContact O-N 3.09Å; E178-A180 PolarHBondContact O-N 3.03Å; A180-F183 WeakPolarHBondContact O-CB 3.34Å; A180-F183 PolarHBondContact O-N 2.9Å; A180-F184 HydrophobicContact CB-CD2 3.94Å; A180-F184 HydrophobicContact CB-CE2 3.89Å; A180-F184 WeakPolarHBondContact O-CD2 3.15Å; A180-F184 PolarHBondContact O-N 3.28Å; A180-L211 HydrophobicContact CB-CB 4.15Å; A180-L211 HydrophobicContact CB-CD1 4Å
181	I	89.3	Confident	87.4	Confident	64 Å²	64	37.4 Å²	37.4	33%	0.328	18%	0.184	S	C	.	.	H	α-helix	trans	-58.1	-56.6	-175.5	-61.8	169.1	0	0	0	111.1	E178 M179 F183 F184 T185 M208 T212	E178-I181 PolarHBondContact O-N 2.81Å; M179-I181 VanDerWaalsContact C-N 3.33Å; I181-F183 VanDerWaalsContact C-N 3.27Å; I181-F183 PolarHBondContact O-N 2.78Å; I181-F184 PolarHBondContact O-N 3.07Å; I181-T185 PolarHBondContact O-N 3.08Å; I181-T185 PolarHBondContact O-OG1 2.73Å; I181-M208 HydrophobicContact CB-CE 4.42Å; I181-M208 HydrophobicContact CG1-CE 4.21Å; I181-M208 HydrophobicContact CG2-CE 3.89Å; I181-T212 HydrophobicContact CD1-CG2 3.69Å; I181-T212 HydrophobicContact CG1-CG2 3.51Å
182	P	90.4	Very high	87.1	Confident	1 Å²	1	42 Å²	42	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-34.1	-180	-25.2	37.4	0	0	0	113.7	M179 G186 S423 L426 Y427	M179-P182 WeakPolarHBondContact O-CD 3.36Å; P182-G186 PolarHBondContact O-N 3.21Å; P182-G186 VanDerWaalsContact O-N 3.13Å; P182-S423 WeakPolarHBondContact O-CB 3.49Å; P182-S423 PolarHBondContact O-OG 3.06Å; P182-L426 HydrophobicContact CB-CB 3.75Å; P182-L426 HydrophobicContact CB-CD1 4.21Å; P182-L426 HydrophobicContact CG-CB 4.14Å; P182-Y427 HydrophobicContact CB-CD1 3.73Å; P182-Y427 HydrophobicContact CB-CD2 4.31Å; P182-Y427 HydrophobicContact CB-CE1 3.51Å; P182-Y427 HydrophobicContact CB-CE2 4.1Å; P182-Y427 HydrophobicContact CB-CG 4.14Å; P182-Y427 HydrophobicContact CG-CD1 3.72Å; P182-Y427 HydrophobicContact CG-CE1 3.57Å
183	F	88.9	Confident	86.6	Confident	73 Å²	73	43.8 Å²	43.8	32%	0.32	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-50.5	177.4	179.8	-100.1	0	0	0	111.8	A180 I181 T185 G186 R187 Y427	A180-F183 WeakPolarHBondContact O-CB 3.34Å; A180-F183 PolarHBondContact O-N 2.9Å; I181-F183 VanDerWaalsContact C-N 3.27Å; I181-F183 PolarHBondContact O-N 2.78Å; F183-T185 VanDerWaalsContact C-N 3.35Å; F183-G186 PolarHBondContact O-N 2.95Å; F183-R187 HydrophobicContact CE1-CG 4.24Å; F183-R187 HydrophobicContact CZ-CG 4.38Å; F183-R187 PolarHBondContact O-N 3.14Å; F183-R187 VanDerWaalsContact O-N 3.07Å; F183-Y427 WeakPolarHBondContact CB-OH 3.4Å; F183-Y427 PolarHBondContact N-OH 2.84Å
184	F	88.9	Confident	86.1	Confident	18 Å²	18	44.5 Å²	44.5	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-35.3	179.2	-75.1	-65.9	0	0	0	111.9	A180 I181 G186 R187 I188 N204 L207 M208 L211	A180-F184 HydrophobicContact CB-CD2 3.94Å; A180-F184 HydrophobicContact CB-CE2 3.89Å; A180-F184 WeakPolarHBondContact O-CD2 3.15Å; A180-F184 PolarHBondContact O-N 3.28Å; I181-F184 PolarHBondContact O-N 3.07Å; F184-G186 PolarHBondContact O-N 3.13Å; F184-R187 PolarHBondContact O-N 3.14Å; F184-I188 WeakPolarHBondContact O-CB 3.17Å; F184-I188 WeakPolarHBondContact O-CD1 3.23Å; F184-I188 VanDerWaalsContact O-CG1 3.24Å; F184-I188 WeakPolarHBondContact O-CG1 3.09Å; F184-I188 PolarHBondContact O-N 3.14Å; F184-N204 HydrophobicContact CD1-CB 4.13Å; F184-N204 HydrophobicContact CE1-CB 4.45Å; F184-L207 HydrophobicContact CE1-CB 4.21Å; F184-L207 HydrophobicContact CE2-CB 4.48Å; F184-L207 HydrophobicContact CZ-CB 3.85Å; F184-L207 HydrophobicContact CZ-CD1 4.47Å; F184-M208 HydrophobicContact CB-CB 4.19Å; F184-M208 HydrophobicContact CB-CG 4.37Å; F184-M208 HydrophobicContact CB-SD 4.17Å; F184-M208 HydrophobicContact CD2-CB 3.96Å; F184-M208 HydrophobicContact CD2-CG 4.45Å; F184-M208 HydrophobicContact CG-CB 4.12Å; F184-L211 HydrophobicContact CE2-CD1 3.67Å; F184-L211 HydrophobicContact CZ-CD1 4.19Å
185	T	89.3	Confident	84.6	Confident	45 Å²	45	52 Å²	52	28%	0.276	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-47	173.4	-55.1	0	0	0	0	111.5	I181 F183 R187 I188 T189 V422 L426	I181-T185 PolarHBondContact O-N 3.08Å; I181-T185 PolarHBondContact O-OG1 2.73Å; F183-T185 VanDerWaalsContact C-N 3.35Å; T185-R187 PolarHBondContact O-N 3Å; T185-I188 PolarHBondContact O-N 2.94Å; T185-T189 PolarHBondContact O-N 3.2Å; T185-T189 PolarHBondContact O-OG1 3.38Å; T185-T189 VanDerWaalsContact O-OG1 3.06Å; T185-V422 HydrophobicContact CG2-CG1 4.15Å; T185-L426 HydrophobicContact CG2-CD1 3.9Å
186	G	87.1	Confident	83.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-41.3	177	0	0	0	0	0	113.2	P182 F183 F184 I188 T189 D190 G419 S423	P182-G186 PolarHBondContact O-N 3.21Å; P182-G186 VanDerWaalsContact O-N 3.13Å; F183-G186 PolarHBondContact O-N 2.95Å; F184-G186 PolarHBondContact O-N 3.13Å; G186-I188 VanDerWaalsContact C-N 3.29Å; G186-I188 PolarHBondContact O-N 3.43Å; G186-T189 PolarHBondContact O-N 3.3Å; G186-D190 PolarHBondContact O-N 3.45Å; G186-G419 WeakPolarHBondContact CA-O 3.23Å; G186-G419 WeakPolarHBondContact O-CA 3.43Å; G186-S423 VanDerWaalsContact CA-OG 3.29Å; G186-S423 WeakPolarHBondContact CA-OG 3.48Å; G186-S423 PolarHBondContact N-OG 3.03Å
187	R	85.3	Confident	82.6	Confident	129 Å²	129	58.4 Å²	58.4	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-38.9	173.3	-83.9	-81.4	171.1	91.4	-2.6	112.6	F183 F184 T185 W191	F183-R187 HydrophobicContact CE1-CG 4.24Å; F183-R187 HydrophobicContact CZ-CG 4.38Å; F183-R187 PolarHBondContact O-N 3.14Å; F183-R187 VanDerWaalsContact O-N 3.07Å; F184-R187 PolarHBondContact O-N 3.14Å; T185-R187 PolarHBondContact O-N 3Å; R187-W191 VanDerWaalsContact O-CB 3.3Å; R187-W191 WeakPolarHBondContact O-CB 3.42Å; R187-W191 PolarHBondContact O-N 3.29Å
188	I	86.6	Confident	81.9	Confident	32 Å²	32	61.6 Å²	61.6	16%	0.164	32%	0.317	C	S	.	.	H	α-helix	trans	-67.9	-41.9	175.8	-71.4	164.2	0	0	0	110.4	F184 T185 G186 W191 I192 F201	F184-I188 WeakPolarHBondContact O-CB 3.17Å; F184-I188 WeakPolarHBondContact O-CD1 3.23Å; F184-I188 VanDerWaalsContact O-CG1 3.24Å; F184-I188 WeakPolarHBondContact O-CG1 3.09Å; F184-I188 PolarHBondContact O-N 3.14Å; T185-I188 PolarHBondContact O-N 2.94Å; G186-I188 VanDerWaalsContact C-N 3.29Å; G186-I188 PolarHBondContact O-N 3.43Å; I188-W191 WeakPolarHBondContact O-CB 3.49Å; I188-W191 PolarHBondContact O-N 3.08Å; I188-W191 VanDerWaalsContact O-N 3.17Å; I188-I192 HydrophobicContact CG2-CD1 3.82Å; I188-I192 HydrophobicContact CG2-CG1 4.32Å; I188-I192 WeakPolarHBondContact O-CG1 3.46Å; I188-I192 PolarHBondContact O-N 3.44Å; I188-F201 HydrophobicContact CG1-CD2 4.5Å; I188-F201 HydrophobicContact CG1-CE2 4.29Å; I188-F201 HydrophobicContact CG2-CE2 3.89Å
189	T	86	Confident	81.4	Confident	38 Å²	38	64.6 Å²	64.6	23%	0.233	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-46.3	175.8	-53.6	0	0	0	0	112.1	T185 G186 W191 I192 L193 V422	T185-T189 PolarHBondContact O-N 3.2Å; T185-T189 PolarHBondContact O-OG1 3.38Å; T185-T189 VanDerWaalsContact O-OG1 3.06Å; G186-T189 PolarHBondContact O-N 3.3Å; T189-W191 PolarHBondContact O-N 2.73Å; T189-I192 PolarHBondContact O-N 3.43Å; T189-L193 HydrophobicContact CG2-CD1 3.99Å; T189-L193 WeakPolarHBondContact O-CD1 3.26Å; T189-L193 WeakPolarHBondContact O-CG 3.42Å; T189-L193 PolarHBondContact O-N 2.82Å; T189-V422 HydrophobicContact CG2-CG2 4.18Å
190	D	83.8	Confident	80.9	Confident	24 Å²	24	66.3 Å²	66.3	13%	0.128	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-33.9	175.2	-83.6	-20.2	0	0	0	111.9	G186 Q194 S417 S418 G419	G186-D190 PolarHBondContact O-N 3.45Å; D190-Q194 WeakPolarHBondContact O-CB 3.33Å; D190-Q194 VanDerWaalsContact O-CG 3.29Å; D190-Q194 WeakPolarHBondContact O-CG 3.36Å; D190-Q194 PolarHBondContact O-N 2.81Å; D190-S417 WeakPolarHBondContact OD1-CB 3.34Å; D190-S417 PolarHBondContact OD1-OG 3.48Å; D190-S417 WeakPolarHBondContact OD2-CB 3.49Å; D190-S417 PolarHBondContact OD2-OG 3.11Å; D190-S418 PolarHBondContact OD1-OG 3.02Å; D190-G419 VanDerWaalsContact CG-CA 3.49Å; D190-G419 VanDerWaalsContact OD1-CA 3.29Å; D190-G419 WeakPolarHBondContact OD1-CA 3.43Å; D190-G419 PolarHBondContact OD1-N 3.16Å
191	W	82.1	Confident	80.7	Confident	58 Å²	58	68.9 Å²	68.9	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-71.1	-43.6	178.2	-177.8	93.4	0	0	0	112.6	R187 I188 T189 L193 Q194 D195 K196 T197 F201	R187-W191 VanDerWaalsContact O-CB 3.3Å; R187-W191 WeakPolarHBondContact O-CB 3.42Å; R187-W191 PolarHBondContact O-N 3.29Å; I188-W191 WeakPolarHBondContact O-CB 3.49Å; I188-W191 PolarHBondContact O-N 3.08Å; I188-W191 VanDerWaalsContact O-N 3.17Å; T189-W191 PolarHBondContact O-N 2.73Å; W191-L193 VanDerWaalsContact C-N 3.26Å; W191-L193 PolarHBondContact O-N 2.88Å; W191-Q194 PolarHBondContact O-N 3.1Å; W191-D195 PolarHBondContact O-N 3.12Å; W191-K196 HydrophobicContact CG-CB 4.49Å; W191-K196 WeakPolarHBondContact CZ2-O 3.34Å; W191-T197 WeakPolarHBondContact CZ2-O 3.46Å; W191-T197 PolarHBondContact NE1-O 3.26Å; W191-F201 HydrophobicContact CD2-CB 4.29Å; W191-F201 HydrophobicContact CD2-CD2 4.28Å; W191-F201 HydrophobicContact CE3-CB 4.43Å; W191-F201 AromaticContact CE3-CD2 3.8Å; W191-F201 HydrophobicContact CE3-CD2 3.8Å; W191-F201 HydrophobicContact CE3-CG 4.44Å; W191-F201 HydrophobicContact CH2-CB 3.85Å; W191-F201 HydrophobicContact CH2-CD2 4.25Å; W191-F201 HydrophobicContact CH2-CG 4.13Å; W191-F201 HydrophobicContact CZ2-CB 3.64Å; W191-F201 HydrophobicContact CZ2-CG 4.4Å; W191-F201 HydrophobicContact CZ3-CB 4.24Å; W191-F201 AromaticContact CZ3-CD2 3.79Å; W191-F201 HydrophobicContact CZ3-CD2 3.79Å; W191-F201 HydrophobicContact CZ3-CE2 4.46Å; W191-F201 HydrophobicContact CZ3-CG 4.15Å
192	I	82.2	Confident	80.4	Confident	103 Å²	103	67.7 Å²	67.7	53%	0.528	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-36.5	176.4	-68.4	168.7	0	0	0	110.8	I188 T189 Q194	I188-I192 HydrophobicContact CG2-CD1 3.82Å; I188-I192 HydrophobicContact CG2-CG1 4.32Å; I188-I192 WeakPolarHBondContact O-CG1 3.46Å; I188-I192 PolarHBondContact O-N 3.44Å; T189-I192 PolarHBondContact O-N 3.43Å; I192-Q194 VanDerWaalsContact C-N 3.34Å
193	L	79.4	Confident	80.1	Confident	113 Å²	113	75.1 Å²	75.1	59%	0.592	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-11.1	-178.7	-69	167.4	0	0	0	114.1	T189 W191 S418	T189-L193 HydrophobicContact CG2-CD1 3.99Å; T189-L193 WeakPolarHBondContact O-CD1 3.26Å; T189-L193 WeakPolarHBondContact O-CG 3.42Å; T189-L193 PolarHBondContact O-N 2.82Å; W191-L193 VanDerWaalsContact C-N 3.26Å; W191-L193 PolarHBondContact O-N 2.88Å; L193-S418 WeakPolarHBondContact CD1-OG 3.44Å
194	Q	76.9	Confident	79.9	Confident	108 Å²	108	72.8 Å²	72.8	51%	0.505	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	9.9	-175.2	-69.1	-177.4	9.4	0	0	114.4	D190 W191 I192 K196	D190-Q194 WeakPolarHBondContact O-CB 3.33Å; D190-Q194 VanDerWaalsContact O-CG 3.29Å; D190-Q194 WeakPolarHBondContact O-CG 3.36Å; D190-Q194 PolarHBondContact O-N 2.81Å; W191-Q194 PolarHBondContact O-N 3.1Å; I192-Q194 VanDerWaalsContact C-N 3.34Å; Q194-K196 PolarHBondContact O-N 3.4Å
195	D	60.2	Low	79.8	Confident	156 Å²	156	76.1 Å²	76.1	83%	0.834	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.1	57.1	176.8	-76.9	-24.1	0	0	0	114.8	W191	W191-D195 PolarHBondContact O-N 3.12Å
196	K	66.1	Low	79.8	Confident	122 Å²	122	82.3 Å²	82.3	53%	0.53	41%	0.414	S	S	.	.			trans	-99	168.4	179.6	-76.4	179.2	179.6	158.6	0	113.9	W191 Q194	W191-K196 HydrophobicContact CG-CB 4.49Å; W191-K196 WeakPolarHBondContact CZ2-O 3.34Å; Q194-K196 PolarHBondContact O-N 3.4Å
197	T	67.9	Low	79.8	Confident	94 Å²	94	85.9 Å²	85.9	58%	0.577	43%	0.433	S	S	*	.			trans	-64.2	140.6	-170.1	56.6	0	0	0	0	115.2	W191 P199 S200	W191-T197 WeakPolarHBondContact CZ2-O 3.46Å; W191-T197 PolarHBondContact NE1-O 3.26Å; T197-P199 VanDerWaalsContact C-CD 3.4Å; T197-S200 PolarHBondContact O-N 2.85Å
198	A	71.1	Confident	79.9	Confident	73 Å²	73	82 Å²	82	60%	0.603	42%	0.421	S	S	*	.	H	α-helix	trans	-50.7	-38.5	-179.8	0	0	0	0	0	117.7	S200 F201 A202	A198-S200 VanDerWaalsContact C-N 3.32Å; A198-S200 PolarHBondContact O-N 3.39Å; A198-F201 PolarHBondContact O-N 2.94Å; A198-A202 PolarHBondContact O-N 3.32Å
199	P	75.8	Confident	80.1	Confident	94 Å²	94	83.1 Å²	83.1	61%	0.61	43%	0.431	S	S	*	.	H	α-helix	trans	-67.7	-27.3	-176.2	23.6	-34.4	0	0	0	114.1	T197 R203	T197-P199 VanDerWaalsContact C-CD 3.4Å; P199-R203 PolarHBondContact O-N 2.93Å
200	S	75.5	Confident	80.4	Confident	38 Å²	38	86.1 Å²	86.1	27%	0.266	44%	0.444	S	S	.	.	H	α-helix	trans	-72.8	-32.3	177.9	-66.8	0	0	0	0	112.4	T197 A198 N204	T197-S200 PolarHBondContact O-N 2.85Å; A198-S200 VanDerWaalsContact C-N 3.32Å; A198-S200 PolarHBondContact O-N 3.39Å; S200-N204 PolarHBondContact O-N 3.04Å; S200-N204 VanDerWaalsContact O-N 3.17Å; S200-N204 PolarHBondContact O-ND2 3.46Å
201	F	81.1	Confident	80.7	Confident	64 Å²	64	88.2 Å²	88.2	28%	0.281	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-50.5	175.3	177.5	-95.9	0	0	0	111.1	I188 W191 A198 R203 N204 M205	I188-F201 HydrophobicContact CG1-CD2 4.5Å; I188-F201 HydrophobicContact CG1-CE2 4.29Å; I188-F201 HydrophobicContact CG2-CE2 3.89Å; W191-F201 HydrophobicContact CD2-CB 4.29Å; W191-F201 HydrophobicContact CD2-CD2 4.28Å; W191-F201 HydrophobicContact CE3-CB 4.43Å; W191-F201 AromaticContact CE3-CD2 3.8Å; W191-F201 HydrophobicContact CE3-CD2 3.8Å; W191-F201 HydrophobicContact CE3-CG 4.44Å; W191-F201 HydrophobicContact CH2-CB 3.85Å; W191-F201 HydrophobicContact CH2-CD2 4.25Å; W191-F201 HydrophobicContact CH2-CG 4.13Å; W191-F201 HydrophobicContact CZ2-CB 3.64Å; W191-F201 HydrophobicContact CZ2-CG 4.4Å; W191-F201 HydrophobicContact CZ3-CB 4.24Å; W191-F201 AromaticContact CZ3-CD2 3.79Å; W191-F201 HydrophobicContact CZ3-CD2 3.79Å; W191-F201 HydrophobicContact CZ3-CE2 4.46Å; W191-F201 HydrophobicContact CZ3-CG 4.15Å; A198-F201 PolarHBondContact O-N 2.94Å; F201-R203 VanDerWaalsContact C-N 3.31Å; F201-R203 PolarHBondContact O-N 3.25Å; F201-N204 PolarHBondContact O-N 3.28Å; F201-M205 HydrophobicContact CE1-CE 4Å; F201-M205 HydrophobicContact CE1-SD 4Å; F201-M205 HydrophobicContact CZ-SD 4.22Å; F201-M205 PolarHBondContact O-N 3Å
202	A	84.3	Confident	81.1	Confident	39 Å²	39	87 Å²	87	32%	0.322	45%	0.454	S	S	.	.	H	α-helix	trans	-56.9	-43.8	177.4	0	0	0	0	0	111.7	A198 M205 W206	A198-A202 PolarHBondContact O-N 3.32Å; A202-M205 PolarHBondContact O-N 2.86Å; A202-W206 WeakPolarHBondContact O-CB 3.43Å; A202-W206 PolarHBondContact O-N 3.38Å
203	R	84.3	Confident	81.6	Confident	156 Å²	156	87.6 Å²	87.6	59%	0.589	46%	0.457	S	S	*	.	H	α-helix	trans	-60.9	-45.6	176.9	-175.6	178.1	63.8	-163.4	-4	112.9	P199 F201 M205 W206 L207	P199-R203 PolarHBondContact O-N 2.93Å; F201-R203 VanDerWaalsContact C-N 3.31Å; F201-R203 PolarHBondContact O-N 3.25Å; R203-M205 VanDerWaalsContact C-N 3.33Å; R203-W206 PolarHBondContact O-N 3.03Å; R203-L207 HydrophobicContact CG-CD1 4.2Å; R203-L207 WeakPolarHBondContact O-CB 3.35Å; R203-L207 VanDerWaalsContact O-CG 3.31Å; R203-L207 WeakPolarHBondContact O-CG 3.19Å; R203-L207 PolarHBondContact O-N 3.38Å
204	N	84.8	Confident	82.2	Confident	25 Å²	25	84.4 Å²	84.4	13%	0.134	45%	0.447	C	S	.	.	H	α-helix	trans	-66	-37.4	179.1	-71.6	-21.9	0	0	0	111.9	F184 S200 F201 M208	F184-N204 HydrophobicContact CD1-CB 4.13Å; F184-N204 HydrophobicContact CE1-CB 4.45Å; S200-N204 PolarHBondContact O-N 3.04Å; S200-N204 VanDerWaalsContact O-N 3.17Å; S200-N204 PolarHBondContact O-ND2 3.46Å; F201-N204 PolarHBondContact O-N 3.28Å; N204-M208 WeakPolarHBondContact O-CB 3.27Å; N204-M208 PolarHBondContact O-N 3.44Å
205	M	85.5	Confident	83	Confident	87 Å²	87	79.6 Å²	79.6	43%	0.429	43%	0.425	S	S	.	.	H	α-helix	trans	-67.5	-42.9	176.3	-168.3	164.2	64.9	0	0	111.8	F201 A202 R203 M208 C209	F201-M205 HydrophobicContact CE1-CE 4Å; F201-M205 HydrophobicContact CE1-SD 4Å; F201-M205 HydrophobicContact CZ-SD 4.22Å; F201-M205 PolarHBondContact O-N 3Å; A202-M205 PolarHBondContact O-N 2.86Å; R203-M205 VanDerWaalsContact C-N 3.33Å; M205-M208 PolarHBondContact O-N 3.34Å; M205-C209 PolarHBondContact O-N 2.98Å; M205-C209 PolarHBondContact O-SG 3.38Å; M205-C209 VanDerWaalsContact O-SG 3.33Å
206	W	89	Confident	84.4	Confident	176 Å²	176	76.3 Å²	76.3	67%	0.667	41%	0.411	S	S	*	.	H	α-helix	trans	-62.1	-44.1	173.6	-84.3	112.7	0	0	0	112.6	A202 R203 M208 C209 I210	A202-W206 WeakPolarHBondContact O-CB 3.43Å; A202-W206 PolarHBondContact O-N 3.38Å; R203-W206 PolarHBondContact O-N 3.03Å; W206-M208 VanDerWaalsContact C-N 3.35Å; W206-M208 PolarHBondContact O-N 3.22Å; W206-C209 PolarHBondContact O-N 3.27Å; W206-I210 VanDerWaalsContact O-CG1 3.27Å; W206-I210 WeakPolarHBondContact O-CG1 3.31Å; W206-I210 PolarHBondContact O-N 3.08Å
207	L	88.1	Confident	85.8	Confident	75 Å²	75	73.4 Å²	73.4	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.1	-73.5	172.3	0	0	0	111.8	F184 R203 I210 L211	F184-L207 HydrophobicContact CE1-CB 4.21Å; F184-L207 HydrophobicContact CE2-CB 4.48Å; F184-L207 HydrophobicContact CZ-CB 3.85Å; F184-L207 HydrophobicContact CZ-CD1 4.47Å; R203-L207 HydrophobicContact CG-CD1 4.2Å; R203-L207 WeakPolarHBondContact O-CB 3.35Å; R203-L207 VanDerWaalsContact O-CG 3.31Å; R203-L207 WeakPolarHBondContact O-CG 3.19Å; R203-L207 PolarHBondContact O-N 3.38Å; L207-I210 PolarHBondContact O-N 2.97Å; L207-L211 WeakPolarHBondContact O-CB 3.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.46Å; L207-L211 WeakPolarHBondContact O-CG 3.3Å; L207-L211 PolarHBondContact O-N 3.37Å
208	M	87.6	Confident	87	Confident	48 Å²	48	71 Å²	71	24%	0.236	39%	0.393	C	S	.	.	H	α-helix	trans	-58.1	-51.2	174.1	179	178.7	165	0	0	110.8	I181 F184 N204 M205 W206 I210 L211 T212	I181-M208 HydrophobicContact CB-CE 4.42Å; I181-M208 HydrophobicContact CG1-CE 4.21Å; I181-M208 HydrophobicContact CG2-CE 3.89Å; F184-M208 HydrophobicContact CB-CB 4.19Å; F184-M208 HydrophobicContact CB-CG 4.37Å; F184-M208 HydrophobicContact CB-SD 4.17Å; F184-M208 HydrophobicContact CD2-CB 3.96Å; F184-M208 HydrophobicContact CD2-CG 4.45Å; F184-M208 HydrophobicContact CG-CB 4.12Å; N204-M208 WeakPolarHBondContact O-CB 3.27Å; N204-M208 PolarHBondContact O-N 3.44Å; M205-M208 PolarHBondContact O-N 3.34Å; W206-M208 VanDerWaalsContact C-N 3.35Å; W206-M208 PolarHBondContact O-N 3.22Å; M208-I210 PolarHBondContact O-N 3.18Å; M208-L211 PolarHBondContact O-N 3.29Å; M208-T212 WeakPolarHBondContact O-CG2 3.22Å; M208-T212 PolarHBondContact O-N 3.19Å; M208-T212 PolarHBondContact O-OG1 3.16Å; M208-T212 VanDerWaalsContact O-OG1 3.06Å
209	C	89.9	Confident	87.9	Confident	55 Å²	55	69.6 Å²	69.6	37%	0.372	37%	0.374	S	S	.	.	H	α-helix	trans	-58.2	-48.8	178.5	-70	0	0	0	0	112.3	M205 W206 L211 T212 I213	M205-C209 PolarHBondContact O-N 2.98Å; M205-C209 PolarHBondContact O-SG 3.38Å; M205-C209 VanDerWaalsContact O-SG 3.33Å; W206-C209 PolarHBondContact O-N 3.27Å; C209-L211 PolarHBondContact O-N 2.89Å; C209-T212 WeakPolarHBondContact CA-OG1 3.33Å; C209-T212 PolarHBondContact O-N 2.92Å; C209-T212 PolarHBondContact O-OG1 3.17Å; C209-I213 VanDerWaalsContact O-CG1 3.31Å; C209-I213 WeakPolarHBondContact O-CG1 3.1Å; C209-I213 PolarHBondContact O-N 3.23Å
210	I	92.1	Very high	88.8	Confident	101 Å²	101	73.2 Å²	73.2	52%	0.518	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-46.2	-179.7	-68.2	165.2	0	0	0	110.8	W206 L207 M208 T212 I213 A214	W206-I210 VanDerWaalsContact O-CG1 3.27Å; W206-I210 WeakPolarHBondContact O-CG1 3.31Å; W206-I210 PolarHBondContact O-N 3.08Å; L207-I210 PolarHBondContact O-N 2.97Å; M208-I210 PolarHBondContact O-N 3.18Å; I210-T212 PolarHBondContact O-N 2.8Å; I210-I213 PolarHBondContact O-N 2.84Å; I210-A214 WeakPolarHBondContact O-CB 3.41Å; I210-A214 PolarHBondContact O-N 3.32Å
211	L	91.2	Very high	89.6	Confident	67 Å²	67	73.4 Å²	73.4	35%	0.351	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-38.9	178.9	-81.7	157.1	0	0	0	112.2	A180 F184 L207 M208 C209 S215	A180-L211 HydrophobicContact CB-CB 4.15Å; A180-L211 HydrophobicContact CB-CD1 4Å; F184-L211 HydrophobicContact CE2-CD1 3.67Å; F184-L211 HydrophobicContact CZ-CD1 4.19Å; L207-L211 WeakPolarHBondContact O-CB 3.37Å; L207-L211 WeakPolarHBondContact O-CD1 3.46Å; L207-L211 WeakPolarHBondContact O-CG 3.3Å; L207-L211 PolarHBondContact O-N 3.37Å; M208-L211 PolarHBondContact O-N 3.29Å; C209-L211 PolarHBondContact O-N 2.89Å; L211-S215 WeakPolarHBondContact O-CB 3.35Å; L211-S215 PolarHBondContact O-N 3.32Å; L211-S215 PolarHBondContact O-OG 3.06Å
212	T	89.7	Confident	90.1	Very high	32 Å²	32	70.5 Å²	70.5	20%	0.196	37%	0.372	C	S	.	.	H	α-helix	trans	-71.1	-35.1	177.3	54.1	0	0	0	0	114	I181 M208 C209 I210 S215 T216	I181-T212 HydrophobicContact CD1-CG2 3.69Å; I181-T212 HydrophobicContact CG1-CG2 3.51Å; M208-T212 WeakPolarHBondContact O-CG2 3.22Å; M208-T212 PolarHBondContact O-N 3.19Å; M208-T212 PolarHBondContact O-OG1 3.16Å; M208-T212 VanDerWaalsContact O-OG1 3.06Å; C209-T212 WeakPolarHBondContact CA-OG1 3.33Å; C209-T212 PolarHBondContact O-N 2.92Å; C209-T212 PolarHBondContact O-OG1 3.17Å; I210-T212 PolarHBondContact O-N 2.8Å; T212-S215 WeakPolarHBondContact CA-OG 3.37Å; T212-S215 PolarHBondContact O-OG 3.38Å; T212-T216 WeakPolarHBondContact O-CB 3.42Å; T212-T216 PolarHBondContact O-N 2.81Å; T212-T216 VanDerWaalsContact O-N 3.13Å; T212-T216 PolarHBondContact O-OG1 3.08Å
213	I	93	Very high	90.5	Very high	117 Å²	117	71.3 Å²	71.3	60%	0.6	37%	0.371	S	S	*	.	H	α-helix	trans	-71.2	-43.5	175.3	-67.2	166.6	0	0	0	109.2	C209 I210 T216 A217	C209-I213 VanDerWaalsContact O-CG1 3.31Å; C209-I213 WeakPolarHBondContact O-CG1 3.1Å; C209-I213 PolarHBondContact O-N 3.23Å; I210-I213 PolarHBondContact O-N 2.84Å; I213-T216 PolarHBondContact O-N 3.5Å; I213-A217 WeakPolarHBondContact O-CB 3.46Å; I213-A217 PolarHBondContact O-N 3.3Å
214	A	92.8	Very high	90.8	Very high	45 Å²	45	65.4 Å²	65.4	37%	0.372	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.7	0	0	0	0	0	112.1	I210 A217 L218	I210-A214 WeakPolarHBondContact O-CB 3.41Å; I210-A214 PolarHBondContact O-N 3.32Å; A214-A217 PolarHBondContact O-N 3.15Å; A214-L218 VanDerWaalsContact O-CG 3.25Å; A214-L218 WeakPolarHBondContact O-CG 3.49Å; A214-L218 PolarHBondContact O-N 3.34Å
215	S	92	Very high	91.2	Very high	7 Å²	7	66.3 Å²	66.3	5%	0.049	36%	0.363	C	S	.	.	H	α-helix	trans	-60.3	-56.5	175.8	66	0	0	0	0	110.1	S174 L211 T212 A217 L218 E219	S174-S215 WeakPolarHBondContact OG-CB 3.35Å; S174-S215 PolarHBondContact OG-O 3.18Å; S174-S215 VanDerWaalsContact OG-O 3.14Å; L211-S215 WeakPolarHBondContact O-CB 3.35Å; L211-S215 PolarHBondContact O-N 3.32Å; L211-S215 PolarHBondContact O-OG 3.06Å; T212-S215 WeakPolarHBondContact CA-OG 3.37Å; T212-S215 PolarHBondContact O-OG 3.38Å; S215-A217 PolarHBondContact O-N 3.04Å; S215-A217 VanDerWaalsContact O-N 3.13Å; S215-L218 CarbonylContact O-C 3.45Å; S215-L218 WeakPolarHBondContact O-CA 3.4Å; S215-L218 WeakPolarHBondContact O-CB 3.35Å; S215-L218 PolarHBondContact O-N 3.42Å; S215-E219 VanDerWaalsContact O-CG 3.27Å; S215-E219 WeakPolarHBondContact O-CG 2.92Å; S215-E219 PolarHBondContact O-N 3.01Å
216	T	91.4	Very high	91.5	Very high	88 Å²	88	62.3 Å²	62.3	54%	0.54	34%	0.343	S	S	.	.	H	α-helix	trans	-54.6	-38.6	-179.5	-49.9	0	0	0	0	112.4	T212 I213 E219 F220	T212-T216 WeakPolarHBondContact O-CB 3.42Å; T212-T216 PolarHBondContact O-N 2.81Å; T212-T216 VanDerWaalsContact O-N 3.13Å; T212-T216 PolarHBondContact O-OG1 3.08Å; I213-T216 PolarHBondContact O-N 3.5Å; T216-E219 PolarHBondContact O-N 2.98Å; T216-F220 WeakPolarHBondContact O-CB 3.36Å; T216-F220 PolarHBondContact O-N 3.32Å
217	A	94.1	Very high	91.6	Very high	60 Å²	60	57.3 Å²	57.3	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-66.6	-39.8	175.5	0	0	0	0	0	112.9	I213 A214 S215 A221	I213-A217 WeakPolarHBondContact O-CB 3.46Å; I213-A217 PolarHBondContact O-N 3.3Å; A214-A217 PolarHBondContact O-N 3.15Å; S215-A217 PolarHBondContact O-N 3.04Å; S215-A217 VanDerWaalsContact O-N 3.13Å; A217-A221 WeakPolarHBondContact O-CB 3.47Å; A217-A221 PolarHBondContact O-N 3.44Å
218	L	92.9	Very high	91.7	Very high	43 Å²	43	58.4 Å²	58.4	23%	0.225	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-36.7	173.9	-68	167.5	0	0	0	111.8	L170 L173 A214 S215 A221 G222	L170-L218 HydrophobicContact CD2-CD2 3.64Å; L173-L218 HydrophobicContact CB-CD1 4.21Å; L173-L218 HydrophobicContact CD2-CD1 3.64Å; L173-L218 HydrophobicContact CD2-CD2 4.18Å; L173-L218 HydrophobicContact CG-CD1 3.66Å; A214-L218 VanDerWaalsContact O-CG 3.25Å; A214-L218 WeakPolarHBondContact O-CG 3.49Å; A214-L218 PolarHBondContact O-N 3.34Å; S215-L218 CarbonylContact O-C 3.45Å; S215-L218 WeakPolarHBondContact O-CA 3.4Å; S215-L218 WeakPolarHBondContact O-CB 3.35Å; S215-L218 PolarHBondContact O-N 3.42Å; L218-A221 PolarHBondContact O-N 2.87Å; L218-G222 PolarHBondContact O-N 3.07Å
219	E	91.2	Very high	91.8	Very high	44 Å²	44	56.3 Å²	56.3	21%	0.206	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-49.1	174.2	-50.9	-163	156.2	0	0	111	S174 E178 S215 T216 A221 G222 D223 W285	S174-E219 WeakPolarHBondContact OG-CG 3.5Å; S174-E219 PolarHBondContact OG-OE1 3.48Å; E178-E219 VanDerWaalsContact CG-OE1 3.29Å; E178-E219 WeakPolarHBondContact CG-OE1 3.4Å; S215-E219 VanDerWaalsContact O-CG 3.27Å; S215-E219 WeakPolarHBondContact O-CG 2.92Å; S215-E219 PolarHBondContact O-N 3.01Å; T216-E219 PolarHBondContact O-N 2.98Å; E219-A221 VanDerWaalsContact C-N 3.3Å; E219-A221 PolarHBondContact O-N 3.43Å; E219-G222 PolarHBondContact O-N 2.97Å; E219-D223 VanDerWaalsContact O-CB 3.28Å; E219-D223 WeakPolarHBondContact O-CB 3.28Å; E219-D223 PolarHBondContact O-N 3.2Å; E219-W285 HydrophobicContact CB-CH2 3.63Å; E219-W285 HydrophobicContact CB-CZ2 4.31Å; E219-W285 HydrophobicContact CB-CZ3 4.45Å; E219-W285 HydrophobicContact CG-CH2 3.54Å; E219-W285 HydrophobicContact CG-CZ3 3.96Å
220	F	93.4	Very high	91.7	Very high	170 Å²	170	54.2 Å²	54.2	75%	0.746	31%	0.309	S	S	*	.	H	α-helix	trans	-58.4	-44.2	178.1	-178.8	-99.4	0	0	0	111.7	T216 G224	T216-F220 WeakPolarHBondContact O-CB 3.36Å; T216-F220 PolarHBondContact O-N 3.32Å; F220-G224 PolarHBondContact O-N 3.09Å
221	A	93.5	Very high	91.6	Very high	42 Å²	42	51 Å²	51	35%	0.347	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-44.9	176.1	0	0	0	0	0	112.2	A217 L218 E219 I225	A217-A221 WeakPolarHBondContact O-CB 3.47Å; A217-A221 PolarHBondContact O-N 3.44Å; L218-A221 PolarHBondContact O-N 2.87Å; E219-A221 VanDerWaalsContact C-N 3.3Å; E219-A221 PolarHBondContact O-N 3.43Å; A221-I225 WeakPolarHBondContact O-CD1 3.29Å; A221-I225 VanDerWaalsContact O-CG1 3.23Å; A221-I225 WeakPolarHBondContact O-CG1 3.23Å; A221-I225 PolarHBondContact O-N 2.78Å
222	G	92.1	Very high	91.4	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-46.4	179.3	0	0	0	0	0	112.5	L218 E219 I225 Y226	L218-G222 PolarHBondContact O-N 3.07Å; E219-G222 PolarHBondContact O-N 2.97Å; G222-I225 PolarHBondContact O-N 2.93Å; G222-Y226 WeakPolarHBondContact O-CB 3.26Å; G222-Y226 PolarHBondContact O-N 3.18Å
223	D	91.4	Very high	91.2	Very high	57 Å²	57	51.7 Å²	51.7	31%	0.305	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-39.3	178.7	-165.2	57.9	0	0	0	111.4	E219 I225 Y226 N227 N281	E219-D223 VanDerWaalsContact O-CB 3.28Å; E219-D223 WeakPolarHBondContact O-CB 3.28Å; E219-D223 PolarHBondContact O-N 3.2Å; D223-I225 PolarHBondContact O-N 3.35Å; D223-Y226 PolarHBondContact O-N 2.63Å; D223-N227 VanDerWaalsContact CG-ND2 3.28Å; D223-N227 WeakPolarHBondContact O-CB 3.14Å; D223-N227 PolarHBondContact O-N 3.17Å; D223-N227 PolarHBondContact O-ND2 3.48Å; D223-N227 PolarHBondContact OD1-ND2 3.22Å; D223-N227 PolarHBondContact OD2-ND2 3.31Å; D223-N281 PolarHBondContact OD1-ND2 3.2Å
224	G	91.5	Very high	91	Very high	31 Å²	31	48.9 Å²	48.9	32%	0.32	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-47.3	171.9	0	0	0	0	0	112.7	F220 Y226 I228	F220-G224 PolarHBondContact O-N 3.09Å; G224-Y226 VanDerWaalsContact C-N 3.33Å; G224-Y226 PolarHBondContact O-N 3.09Å; G224-I228 WeakPolarHBondContact O-CB 3.47Å; G224-I228 WeakPolarHBondContact O-CD1 3.16Å; G224-I228 VanDerWaalsContact O-CG1 3.23Å; G224-I228 WeakPolarHBondContact O-CG1 3.35Å; G224-I228 PolarHBondContact O-N 2.99Å
225	I	92	Very high	90.8	Very high	45 Å²	45	50.6 Å²	50.6	23%	0.231	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-39.1	177.2	-65.9	163.7	0	0	0	111	R163 L166 V167 L170 A221 G222 D223 T229	R163-I225 HydrophobicContact CB-CG2 4.27Å; L166-I225 HydrophobicContact CD2-CD1 3.93Å; V167-I225 HydrophobicContact CG2-CB 4.02Å; V167-I225 HydrophobicContact CG2-CG2 3.66Å; L170-I225 HydrophobicContact CD1-CD1 3.86Å; A221-I225 WeakPolarHBondContact O-CD1 3.29Å; A221-I225 VanDerWaalsContact O-CG1 3.23Å; A221-I225 WeakPolarHBondContact O-CG1 3.23Å; A221-I225 PolarHBondContact O-N 2.78Å; G222-I225 PolarHBondContact O-N 2.93Å; D223-I225 PolarHBondContact O-N 3.35Å; I225-T229 VanDerWaalsContact O-CB 3.31Å; I225-T229 WeakPolarHBondContact O-CB 3.31Å; I225-T229 PolarHBondContact O-N 2.92Å; I225-T229 PolarHBondContact O-OG1 3.41Å
226	Y	91.7	Very high	90.6	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-54.8	177.1	-178.4	-93.2	0	0	0	111.3	V167 G222 D223 G224 I228 T229 M230 S277 N281	V167-Y226 HydrophobicContact CG1-CD2 4.28Å; G222-Y226 WeakPolarHBondContact O-CB 3.26Å; G222-Y226 PolarHBondContact O-N 3.18Å; D223-Y226 PolarHBondContact O-N 2.63Å; G224-Y226 VanDerWaalsContact C-N 3.33Å; G224-Y226 PolarHBondContact O-N 3.09Å; Y226-I228 PolarHBondContact O-N 2.78Å; Y226-T229 WeakPolarHBondContact O-CA 3.34Å; Y226-T229 WeakPolarHBondContact O-CB 3.49Å; Y226-T229 PolarHBondContact O-N 3.18Å; Y226-M230 HydrophobicContact CE1-CB 4.38Å; Y226-M230 HydrophobicContact CE1-CG 4.48Å; Y226-M230 WeakPolarHBondContact O-CB 3.35Å; Y226-M230 PolarHBondContact O-N 3.45Å; Y226-S277 PolarHBondContact OH-O 2.94Å; Y226-N281 HydrophobicContact CD1-CB 4.08Å; Y226-N281 HydrophobicContact CE1-CB 3.43Å; Y226-N281 VanDerWaalsContact CE1-CB 3.43Å; Y226-N281 HydrophobicContact CE2-CB 4.42Å; Y226-N281 PolarHBondContact OH-N 3.17Å
227	N	91.1	Very high	90.5	Very high	71 Å²	71	51.9 Å²	51.9	38%	0.38	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-40.6	-178.5	-74.6	-49.1	0	0	0	112.3	D223 T229 M230 G231	D223-N227 VanDerWaalsContact CG-ND2 3.28Å; D223-N227 WeakPolarHBondContact O-CB 3.14Å; D223-N227 PolarHBondContact O-N 3.17Å; D223-N227 PolarHBondContact O-ND2 3.48Å; D223-N227 PolarHBondContact OD1-ND2 3.22Å; D223-N227 PolarHBondContact OD2-ND2 3.31Å; N227-T229 VanDerWaalsContact C-N 3.33Å; N227-T229 PolarHBondContact O-N 3.47Å; N227-M230 PolarHBondContact O-N 3.25Å; N227-G231 PolarHBondContact O-N 3.44Å
228	I	90.4	Very high	90.2	Very high	98 Å²	98	50.8 Å²	50.8	50%	0.503	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-43.5	173.3	-68.9	166.6	0	0	0	110.8	G224 Y226 M230 H232	G224-I228 WeakPolarHBondContact O-CB 3.47Å; G224-I228 WeakPolarHBondContact O-CD1 3.16Å; G224-I228 VanDerWaalsContact O-CG1 3.23Å; G224-I228 WeakPolarHBondContact O-CG1 3.35Å; G224-I228 PolarHBondContact O-N 2.99Å; Y226-I228 PolarHBondContact O-N 2.78Å; I228-M230 VanDerWaalsContact C-N 3.34Å; I228-H232 PolarHBondContact O-CD2 3.37Å; I228-H232 PolarHBondContact O-N 3.45Å
229	T	89.9	Confident	90	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-40.1	-179.1	-59.2	0	0	0	0	111.1	L157 K160 I225 Y226 N227 H232 M233	L157-T229 HydrophobicContact CD2-CG2 3.54Å; K160-T229 HydrophobicContact CB-CG2 4.47Å; I225-T229 VanDerWaalsContact O-CB 3.31Å; I225-T229 WeakPolarHBondContact O-CB 3.31Å; I225-T229 PolarHBondContact O-N 2.92Å; I225-T229 PolarHBondContact O-OG1 3.41Å; Y226-T229 WeakPolarHBondContact O-CA 3.34Å; Y226-T229 WeakPolarHBondContact O-CB 3.49Å; Y226-T229 PolarHBondContact O-N 3.18Å; N227-T229 VanDerWaalsContact C-N 3.33Å; N227-T229 PolarHBondContact O-N 3.47Å; T229-H232 PolarHBondContact O-N 2.81Å; T229-M233 PolarHBondContact O-N 3.32Å
230	M	88.7	Confident	90	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.049	29%	0.289	C	S	.	.	H	α-helix	trans	-75.7	-32.9	-179.6	-150.6	52.2	168.2	0	0	112.8	Y226 N227 I228 H232 M233 H234 S277	Y226-M230 HydrophobicContact CE1-CB 4.38Å; Y226-M230 HydrophobicContact CE1-CG 4.48Å; Y226-M230 WeakPolarHBondContact O-CB 3.35Å; Y226-M230 PolarHBondContact O-N 3.45Å; N227-M230 PolarHBondContact O-N 3.25Å; I228-M230 VanDerWaalsContact C-N 3.34Å; M230-H232 VanDerWaalsContact C-N 3.33Å; M230-H232 PolarHBondContact O-N 3.05Å; M230-M233 HydrophobicContact CE-CE 3.2Å; M230-M233 HydrophobicContact CE-SD 3.67Å; M230-M233 HydrophobicContact CG-CE 4.41Å; M230-M233 WeakPolarHBondContact O-CB 3.39Å; M230-M233 PolarHBondContact O-N 2.89Å; M230-M233 VanDerWaalsContact O-N 3.12Å; M230-M233 HydrophobicContact SD-CB 4.15Å; M230-M233 HydrophobicContact SD-CE 3.48Å; M230-M233 WeakPolarHBondContact SD-CE 3.39Å; M230-M233 HydrophobicContact SD-SD 3.57Å; M230-H234 PolarHBondContact O-N 3.48Å; M230-S277 VanDerWaalsContact CE-CA 3.4Å; M230-S277 WeakPolarHBondContact CG-OG 3.3Å
231	G	89.1	Confident	89.8	Confident	34 Å²	34	44.2 Å²	44.2	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-60.9	-39.4	170.9	0	0	0	0	0	112.7	N227 M233 H234 S235	N227-G231 PolarHBondContact O-N 3.44Å; G231-M233 PolarHBondContact O-N 3.04Å; G231-H234 WeakPolarHBondContact O-CB 3.08Å; G231-H234 PolarHBondContact O-N 3.25Å; G231-S235 PolarHBondContact O-N 2.99Å; G231-S235 PolarHBondContact O-OG 3.13Å
232	H	87.1	Confident	89.7	Confident	106 Å²	106	47.8 Å²	47.8	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-38.7	172.5	-78.9	-125.3	0	0	0	112.5	K160 I228 T229 M230 R236	K160-H232 PolarHBondContact NZ-CE1 3.03Å; K160-H232 PolarHBondContact NZ-ND1 2.91Å; I228-H232 PolarHBondContact O-CD2 3.37Å; I228-H232 PolarHBondContact O-N 3.45Å; T229-H232 PolarHBondContact O-N 2.81Å; M230-H232 VanDerWaalsContact C-N 3.33Å; M230-H232 PolarHBondContact O-N 3.05Å; H232-R236 WeakPolarHBondContact O-CB 3.42Å; H232-R236 PolarHBondContact O-N 3.31Å; H232-R236 VanDerWaalsContact O-N 3.1Å
233	M	86.8	Confident	89.6	Confident	7 Å²	7	54.5 Å²	54.5	3%	0.034	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-46.2	175	-172	-159.2	73.2	0	0	110.2	F156 L157 T229 M230 G231 R236 V237	F156-M233 HydrophobicContact CB-CG 4.19Å; L157-M233 HydrophobicContact CD1-CB 4.46Å; L157-M233 HydrophobicContact CD1-CG 3.99Å; L157-M233 HydrophobicContact CD1-SD 3.44Å; L157-M233 WeakPolarHBondContact CD1-SD 3.22Å; L157-M233 HydrophobicContact CG-CB 4.28Å; L157-M233 HydrophobicContact CG-CG 4.19Å; L157-M233 HydrophobicContact CG-SD 4.25Å; T229-M233 PolarHBondContact O-N 3.32Å; M230-M233 HydrophobicContact CE-CE 3.2Å; M230-M233 HydrophobicContact CE-SD 3.67Å; M230-M233 HydrophobicContact CG-CE 4.41Å; M230-M233 WeakPolarHBondContact O-CB 3.39Å; M230-M233 PolarHBondContact O-N 2.89Å; M230-M233 VanDerWaalsContact O-N 3.12Å; M230-M233 HydrophobicContact SD-CB 4.15Å; M230-M233 HydrophobicContact SD-CE 3.48Å; M230-M233 WeakPolarHBondContact SD-CE 3.39Å; M230-M233 HydrophobicContact SD-SD 3.57Å; G231-M233 PolarHBondContact O-N 3.04Å; M233-R236 PolarHBondContact O-N 3.45Å; M233-V237 HydrophobicContact CG-CG2 4.36Å; M233-V237 WeakPolarHBondContact O-CG2 3.23Å; M233-V237 PolarHBondContact O-N 2.98Å
234	H	88.3	Confident	89.5	Confident	58 Å²	58	52.9 Å²	52.9	27%	0.269	28%	0.281	S	S	.	.	H	α-helix	trans	-56.4	-52.4	177.9	176.4	93.2	0	0	0	111.8	M230 G231 R236 V237 H238 C273	M230-H234 PolarHBondContact O-N 3.48Å; G231-H234 WeakPolarHBondContact O-CB 3.08Å; G231-H234 PolarHBondContact O-N 3.25Å; H234-R236 VanDerWaalsContact C-N 3.31Å; H234-R236 PolarHBondContact O-N 3.37Å; H234-V237 PolarHBondContact O-N 2.86Å; H234-H238 AromaticContact CD2-CD2 3.72Å; H234-H238 AromaticContact CE1-CD2 3.4Å; H234-H238 PolarHBondContact CE1-CD2 3.4Å; H234-H238 AromaticContact CE1-NE2 3.18Å; H234-H238 PolarHBondContact CE1-NE2 3.21Å; H234-H238 AromaticContact CG-CD2 3.99Å; H234-H238 AromaticContact ND1-CD2 3.8Å; H234-H238 AromaticContact ND1-NE2 3.86Å; H234-H238 AromaticContact NE2-CD2 3.33Å; H234-H238 PolarHBondContact NE2-CD2 2.95Å; H234-H238 VanDerWaalsContact NE2-CD2 3.33Å; H234-H238 AromaticContact NE2-NE2 3.46Å; H234-H238 PolarHBondContact NE2-NE2 3.21Å; H234-H238 PolarHBondContact O-CD2 3.09Å; H234-H238 PolarHBondContact O-N 2.92Å; H234-C273 WeakPolarHBondContact ND1-CB 3.41Å
235	S	88.4	Confident	89.5	Confident	81 Å²	81	51.8 Å²	51.8	57%	0.566	27%	0.268	S	S	*	.	H	α-helix	trans	-60.3	-38.4	177	-58.8	0	0	0	0	113.1	G231 G239	G231-S235 PolarHBondContact O-N 2.99Å; G231-S235 PolarHBondContact O-OG 3.13Å; S235-G239 PolarHBondContact O-N 3.47Å
236	R	88.6	Confident	89.3	Confident	118 Å²	118	54.6 Å²	54.6	45%	0.445	28%	0.283	S	S	.	.	H	α-helix	trans	-67.2	-45.3	179.2	-172.5	177.8	-175.4	-179.3	4.2	111.7	F156 H232 M233 H234 G239 E240	F156-R236 HydrophobicContact CD1-CG 4.37Å; F156-R236 PolarHBondContact O-NH1 2.59Å; H232-R236 WeakPolarHBondContact O-CB 3.42Å; H232-R236 PolarHBondContact O-N 3.31Å; H232-R236 VanDerWaalsContact O-N 3.1Å; M233-R236 PolarHBondContact O-N 3.45Å; H234-R236 VanDerWaalsContact C-N 3.31Å; H234-R236 PolarHBondContact O-N 3.37Å; R236-G239 PolarHBondContact O-N 2.69Å; R236-E240 WeakPolarHBondContact O-CG 2.94Å; R236-E240 PolarHBondContact O-N 3.31Å
237	V	87.8	Confident	89.1	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-46.9	177.4	172.4	0	0	0	0	110.1	F156 M233 H234 G239 E240 V241 T269	F156-V237 HydrophobicContact CB-CG2 4.29Å; F156-V237 HydrophobicContact CD1-CG2 4.4Å; F156-V237 HydrophobicContact CD2-CG2 4.04Å; F156-V237 HydrophobicContact CE2-CG2 4.47Å; F156-V237 HydrophobicContact CG-CG2 3.99Å; M233-V237 HydrophobicContact CG-CG2 4.36Å; M233-V237 WeakPolarHBondContact O-CG2 3.23Å; M233-V237 PolarHBondContact O-N 2.98Å; H234-V237 PolarHBondContact O-N 2.86Å; V237-G239 VanDerWaalsContact C-N 3.32Å; V237-G239 PolarHBondContact O-N 3.35Å; V237-E240 PolarHBondContact O-N 2.78Å; V237-V241 HydrophobicContact CG1-CG2 4.12Å; V237-V241 WeakPolarHBondContact O-CB 3.37Å; V237-V241 VanDerWaalsContact O-CG2 3.22Å; V237-V241 WeakPolarHBondContact O-CG2 3.44Å; V237-V241 PolarHBondContact O-N 3.46Å; V237-T269 HydrophobicContact CG1-CG2 3.98Å
238	H	88.2	Confident	88.9	Confident	37 Å²	37	55 Å²	55	17%	0.171	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-43.8	175.3	-89.6	-77.1	0	0	0	112.6	H234 F242 V265 T266 S270	H234-H238 AromaticContact CD2-CD2 3.72Å; H234-H238 AromaticContact CE1-CD2 3.4Å; H234-H238 PolarHBondContact CE1-CD2 3.4Å; H234-H238 AromaticContact CE1-NE2 3.18Å; H234-H238 PolarHBondContact CE1-NE2 3.21Å; H234-H238 AromaticContact CG-CD2 3.99Å; H234-H238 AromaticContact ND1-CD2 3.8Å; H234-H238 AromaticContact ND1-NE2 3.86Å; H234-H238 AromaticContact NE2-CD2 3.33Å; H234-H238 PolarHBondContact NE2-CD2 2.95Å; H234-H238 VanDerWaalsContact NE2-CD2 3.33Å; H234-H238 AromaticContact NE2-NE2 3.46Å; H234-H238 PolarHBondContact NE2-NE2 3.21Å; H234-H238 PolarHBondContact O-CD2 3.09Å; H234-H238 PolarHBondContact O-N 2.92Å; H238-F242 VanDerWaalsContact O-CB 3.27Å; H238-F242 WeakPolarHBondContact O-CB 3.3Å; H238-F242 PolarHBondContact O-N 2.9Å; H238-V265 PolarHBondContact CE1-O 3Å; H238-V265 VanDerWaalsContact CE1-O 3.25Å; H238-V265 PolarHBondContact ND1-O 3.04Å; H238-V265 VanDerWaalsContact ND1-O 3.14Å; H238-T266 PolarHBondContact CE1-O 3.5Å; H238-S270 PolarHBondContact NE2-N 3.2Å
239	G	89.9	Confident	88.7	Confident	39 Å²	39	52.3 Å²	52.3	40%	0.402	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-45.9	177.5	0	0	0	0	0	113.2	S235 R236 V237 R243	S235-G239 PolarHBondContact O-N 3.47Å; R236-G239 PolarHBondContact O-N 2.69Å; V237-G239 VanDerWaalsContact C-N 3.32Å; V237-G239 PolarHBondContact O-N 3.35Å; G239-R243 WeakPolarHBondContact O-CB 3.41Å; G239-R243 PolarHBondContact O-N 3.42Å
240	E	89.4	Confident	88.6	Confident	79 Å²	79	54.2 Å²	54.2	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-69.6	-39.6	179.2	-68.7	-67.2	169.8	0	0	112.3	F156 R236 V237 R243 A244 L459	F156-E240 HydrophobicContact CE1-CB 4.47Å; F156-E240 HydrophobicContact CE1-CG 4.2Å; R236-E240 WeakPolarHBondContact O-CG 2.94Å; R236-E240 PolarHBondContact O-N 3.31Å; V237-E240 PolarHBondContact O-N 2.78Å; E240-R243 PolarHBondContact O-N 2.98Å; E240-A244 WeakPolarHBondContact O-CB 3.32Å; E240-A244 PolarHBondContact O-N 3.32Å; E240-L459 HydrophobicContact CB-CD2 4.21Å
241	V	90.7	Very high	88.4	Confident	2 Å²	2	54 Å²	54	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-47.5	176	172	0	0	0	0	110.4	V237 R243 A244 V245 V265 T269 I455 L459	V237-V241 HydrophobicContact CG1-CG2 4.12Å; V237-V241 WeakPolarHBondContact O-CB 3.37Å; V237-V241 VanDerWaalsContact O-CG2 3.22Å; V237-V241 WeakPolarHBondContact O-CG2 3.44Å; V237-V241 PolarHBondContact O-N 3.46Å; V241-R243 VanDerWaalsContact C-N 3.32Å; V241-R243 PolarHBondContact O-N 3.42Å; V241-A244 PolarHBondContact O-N 3.39Å; V241-V245 WeakPolarHBondContact O-CG2 3.42Å; V241-V245 PolarHBondContact O-N 2.86Å; V241-V265 HydrophobicContact CG1-CG1 4.27Å; V241-V265 HydrophobicContact CG1-CG2 4.15Å; V241-T269 HydrophobicContact CG2-CG2 4.38Å; V241-I455 HydrophobicContact CG1-CG2 4.41Å; V241-I455 HydrophobicContact CG2-CG2 3.49Å; V241-I455 VanDerWaalsContact CG2-CG2 3.49Å; V241-L459 HydrophobicContact CB-CD2 4.48Å; V241-L459 HydrophobicContact CG2-CD1 3.86Å; V241-L459 HydrophobicContact CG2-CD2 3.93Å; V241-L459 HydrophobicContact CG2-CG 3.9Å
242	F	91.1	Very high	88.2	Confident	116 Å²	116	52.8 Å²	52.8	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.6	-176.4	-111	0	0	0	111.4	H238 V245 L246 V265	H238-F242 VanDerWaalsContact O-CB 3.27Å; H238-F242 WeakPolarHBondContact O-CB 3.3Å; H238-F242 PolarHBondContact O-N 2.9Å; F242-V245 PolarHBondContact O-N 2.92Å; F242-L246 HydrophobicContact CD1-CD1 3.91Å; F242-L246 HydrophobicContact CE1-CD1 3.45Å; F242-L246 VanDerWaalsContact CE1-CD1 3.45Å; F242-L246 HydrophobicContact CE1-CG 4.22Å; F242-L246 HydrophobicContact CE2-CG 4.49Å; F242-L246 HydrophobicContact CZ-CD1 3.81Å; F242-L246 HydrophobicContact CZ-CD2 4.33Å; F242-L246 HydrophobicContact CZ-CG 4.2Å; F242-L246 WeakPolarHBondContact O-CG 3.35Å; F242-L246 PolarHBondContact O-N 3.06Å; F242-V265 HydrophobicContact CB-CG1 4.24Å; F242-V265 HydrophobicContact CD2-CG1 4.17Å
243	R	90.3	Very high	88.3	Confident	145 Å²	145	51.3 Å²	51.3	55%	0.547	26%	0.257	S	S	.	.	H	α-helix	trans	-59.3	-48.2	174.4	-178.3	-177.7	169.6	84.7	7.8	111.4	G239 E240 V241 V245 L246 H247	G239-R243 WeakPolarHBondContact O-CB 3.41Å; G239-R243 PolarHBondContact O-N 3.42Å; E240-R243 PolarHBondContact O-N 2.98Å; V241-R243 VanDerWaalsContact C-N 3.32Å; V241-R243 PolarHBondContact O-N 3.42Å; R243-V245 PolarHBondContact O-N 3.35Å; R243-L246 PolarHBondContact O-N 3.43Å; R243-H247 PolarHBondContact O-N 3.01Å; R243-H247 VanDerWaalsContact O-N 3.14Å; R243-H247 PolarHBondContact O-ND1 3.4Å
244	A	89.4	Confident	88.1	Confident	22 Å²	22	54.9 Å²	54.9	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-43.8	-179.9	0	0	0	0	0	111.8	E240 V241 L246 H247 Q248 L459	E240-A244 WeakPolarHBondContact O-CB 3.32Å; E240-A244 PolarHBondContact O-N 3.32Å; V241-A244 PolarHBondContact O-N 3.39Å; A244-L246 PolarHBondContact O-N 3.08Å; A244-H247 PolarHBondContact O-N 2.95Å; A244-H247 VanDerWaalsContact O-N 3.14Å; A244-Q248 PolarHBondContact O-N 3.44Å; A244-L459 HydrophobicContact CB-CD2 3.93Å
245	V	90	Very high	87.8	Confident	8 Å²	8	57.8 Å²	57.8	5%	0.048	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-43.7	175.9	171.1	0	0	0	0	111.7	V241 F242 R243 H247 Q248 F253 I261 V265 Y458	V241-V245 WeakPolarHBondContact O-CG2 3.42Å; V241-V245 PolarHBondContact O-N 2.86Å; F242-V245 PolarHBondContact O-N 2.92Å; R243-V245 PolarHBondContact O-N 3.35Å; V245-H247 PolarHBondContact O-N 3.15Å; V245-Q248 VanDerWaalsContact O-CB 3.29Å; V245-Q248 WeakPolarHBondContact O-CB 3.43Å; V245-Q248 PolarHBondContact O-N 3.03Å; V245-Q248 VanDerWaalsContact O-N 3.13Å; V245-F253 HydrophobicContact CG1-CE1 3.99Å; V245-F253 HydrophobicContact CG1-CZ 3.92Å; V245-F253 VanDerWaalsContact O-CZ 3.31Å; V245-F253 WeakPolarHBondContact O-CZ 3.49Å; V245-I261 HydrophobicContact CG1-CG2 3.64Å; V245-V265 HydrophobicContact CG2-CG2 3.78Å; V245-Y458 HydrophobicContact CG2-CD1 3.85Å; V245-Y458 HydrophobicContact CG2-CE1 4.4Å
246	L	88.4	Confident	87.5	Confident	105 Å²	105	55.7 Å²	55.7	55%	0.55	27%	0.27	S	S	.	.	H	α-helix	trans	-65	-24	177.3	-71.8	179.7	0	0	0	113.8	F242 R243 A244 Q248	F242-L246 HydrophobicContact CD1-CD1 3.91Å; F242-L246 HydrophobicContact CE1-CD1 3.45Å; F242-L246 VanDerWaalsContact CE1-CD1 3.45Å; F242-L246 HydrophobicContact CE1-CG 4.22Å; F242-L246 HydrophobicContact CE2-CG 4.49Å; F242-L246 HydrophobicContact CZ-CD1 3.81Å; F242-L246 HydrophobicContact CZ-CD2 4.33Å; F242-L246 HydrophobicContact CZ-CG 4.2Å; F242-L246 WeakPolarHBondContact O-CG 3.35Å; F242-L246 PolarHBondContact O-N 3.06Å; R243-L246 PolarHBondContact O-N 3.43Å; A244-L246 PolarHBondContact O-N 3.08Å; L246-Q248 VanDerWaalsContact C-N 3.29Å
247	H	87.3	Confident	87.2	Confident	67 Å²	67	54.3 Å²	54.3	31%	0.31	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.2	177.3	-74.7	69.7	0	0	0	112.8	R243 A244 V245 L467	R243-H247 PolarHBondContact O-N 3.01Å; R243-H247 VanDerWaalsContact O-N 3.14Å; R243-H247 PolarHBondContact O-ND1 3.4Å; A244-H247 PolarHBondContact O-N 2.95Å; A244-H247 VanDerWaalsContact O-N 3.14Å; V245-H247 PolarHBondContact O-N 3.15Å; H247-L467 HydrophobicContact CB-CD1 3.95Å; H247-L467 HydrophobicContact CB-CD2 4.08Å; H247-L467 WeakPolarHBondContact O-CD1 3.41Å
248	Q	88	Confident	87	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.075	30%	0.304	C	S	.	.	S	Bend	trans	-75.9	150.9	-179.6	-157.1	64	44.6	0	0	112.1	A244 V245 L246 F252 F253 R461	A244-Q248 PolarHBondContact O-N 3.44Å; V245-Q248 VanDerWaalsContact O-CB 3.29Å; V245-Q248 WeakPolarHBondContact O-CB 3.43Å; V245-Q248 PolarHBondContact O-N 3.03Å; V245-Q248 VanDerWaalsContact O-N 3.13Å; L246-Q248 VanDerWaalsContact C-N 3.29Å; Q248-F252 HydrophobicContact CB-CB 4.2Å; Q248-F252 HydrophobicContact CB-CD1 4.17Å; Q248-F252 HydrophobicContact CB-CG 4.21Å; Q248-F252 HydrophobicContact CG-CB 3.34Å; Q248-F252 HydrophobicContact CG-CD1 3.82Å; Q248-F252 HydrophobicContact CG-CD2 3.87Å; Q248-F252 HydrophobicContact CG-CG 3.38Å; Q248-F253 HydrophobicContact CB-CE2 4.37Å; Q248-R461 VanDerWaalsContact CD-NE 3.28Å
249	E	86.4	Confident	86.8	Confident	41 Å²	41	59.8 Å²	59.8	19%	0.192	32%	0.324	C	S	.	.			trans	-58.9	151.3	176.1	65.5	-78.6	164.4	0	0	113.5	G251 F252 R461 P463 C464	E249-G251 PolarHBondContact O-N 3.38Å; E249-G251 VanDerWaalsContact O-N 3.14Å; E249-F252 HydrophobicContact CG-CB 4.41Å; E249-F252 WeakPolarHBondContact O-CB 3.17Å; E249-F252 PolarHBondContact O-N 3.23Å; E249-R461 IonicContact OE1-CZ 2.68Å; E249-R461 IonicContact OE1-NE 3.82Å; E249-R461 IonicContact OE1-NH2 2.81Å; E249-R461 PolarHBondContact OE1-NH2 3.36Å; E249-P463 WeakPolarHBondContact OE2-CA 3.49Å; E249-C464 PolarHBondContact OE2-N 3.29Å
250	T	86.6	Confident	86.4	Confident	44 Å²	44	59.5 Å²	59.5	27%	0.27	32%	0.316	S	S	.	.	H	α-helix	trans	-55.8	-33	175.8	57.7	0	0	0	0	113	F252 F253 L254 L531 Y532	T250-F252 PolarHBondContact O-N 3.47Å; T250-F253 PolarHBondContact O-N 3.19Å; T250-F253 VanDerWaalsContact O-N 3.08Å; T250-L254 PolarHBondContact O-N 3.49Å; T250-L531 HydrophobicContact CG2-CB 4.13Å; T250-L531 HydrophobicContact CG2-CD2 4.15Å; T250-L531 PolarHBondContact OG1-O 2.73Å; T250-Y532 WeakPolarHBondContact OG1-CE1 3.47Å; T250-Y532 VanDerWaalsContact OG1-CZ 3.25Å
251	G	84.1	Confident	86.3	Confident	5 Å²	5	56.2 Å²	56.2	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-24.2	174.6	0	0	0	0	0	114.2	E249 K255	E249-G251 PolarHBondContact O-N 3.38Å; E249-G251 VanDerWaalsContact O-N 3.14Å; G251-K255 PolarHBondContact O-N 2.89Å
252	F	86.3	Confident	86.1	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.035	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-42.3	172.9	175.3	-96.1	0	0	0	111.9	Q248 E249 T250 L254 K255 N256 I261 Y458	Q248-F252 HydrophobicContact CB-CB 4.2Å; Q248-F252 HydrophobicContact CB-CD1 4.17Å; Q248-F252 HydrophobicContact CB-CG 4.21Å; Q248-F252 HydrophobicContact CG-CB 3.34Å; Q248-F252 HydrophobicContact CG-CD1 3.82Å; Q248-F252 HydrophobicContact CG-CD2 3.87Å; Q248-F252 HydrophobicContact CG-CG 3.38Å; E249-F252 HydrophobicContact CG-CB 4.41Å; E249-F252 WeakPolarHBondContact O-CB 3.17Å; E249-F252 PolarHBondContact O-N 3.23Å; T250-F252 PolarHBondContact O-N 3.47Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.39Å; F252-K255 PolarHBondContact O-N 3.07Å; F252-N256 WeakPolarHBondContact CD2-ND2 3.34Å; F252-N256 HydrophobicContact CE1-CB 4.39Å; F252-N256 WeakPolarHBondContact CE2-ND2 3.39Å; F252-N256 HydrophobicContact CZ-CB 4.21Å; F252-N256 WeakPolarHBondContact CZ-ND2 3.38Å; F252-N256 PolarHBondContact O-N 2.7Å; F252-N256 VanDerWaalsContact O-N 3.09Å; F252-N256 PolarHBondContact O-ND2 2.98Å; F252-I261 HydrophobicContact CD1-CD1 4.32Å; F252-I261 HydrophobicContact CE1-CD1 3.77Å; F252-I261 HydrophobicContact CE1-CG1 4.18Å; F252-Y458 AromaticContact CE1-CE1 3.9Å; F252-Y458 HydrophobicContact CE1-CE1 3.9Å; F252-Y458 HydrophobicContact CE2-CE1 4.15Å; F252-Y458 HydrophobicContact CZ-CD1 4.03Å; F252-Y458 AromaticContact CZ-CE1 3.27Å; F252-Y458 HydrophobicContact CZ-CE1 3.27Å
253	F	87.5	Confident	85.8	Confident	76 Å²	76	56 Å²	56	33%	0.333	31%	0.311	S	S	.	.	H	α-helix	trans	-72	-23.2	178.5	-63.9	-86	0	0	0	112.7	V245 Q248 T250 I261	V245-F253 HydrophobicContact CG1-CE1 3.99Å; V245-F253 HydrophobicContact CG1-CZ 3.92Å; V245-F253 VanDerWaalsContact O-CZ 3.31Å; V245-F253 WeakPolarHBondContact O-CZ 3.49Å; Q248-F253 HydrophobicContact CB-CE2 4.37Å; T250-F253 PolarHBondContact O-N 3.19Å; T250-F253 VanDerWaalsContact O-N 3.08Å; F253-I261 HydrophobicContact CD1-CD1 3.45Å; F253-I261 VanDerWaalsContact CD1-CD1 3.45Å; F253-I261 HydrophobicContact CE1-CD1 3.85Å; F253-I261 HydrophobicContact CG-CD1 4.36Å
254	L	82.8	Confident	85.4	Confident	82 Å²	82	53.2 Å²	53.2	43%	0.429	30%	0.3	S	S	.	.	H	α-helix	trans	-73.5	-29.3	169.8	-71.6	-177.1	0	0	0	113.2	T250 F252 Y489 N491 Y532	T250-L254 PolarHBondContact O-N 3.49Å; F252-L254 VanDerWaalsContact C-N 3.29Å; F252-L254 PolarHBondContact O-N 3.39Å; L254-Y489 HydrophobicContact CD1-CD1 4.1Å; L254-N491 PolarHBondContact O-ND2 2.98Å; L254-Y532 HydrophobicContact CD1-CE1 4.07Å; L254-Y532 WeakPolarHBondContact CD1-OH 2.91Å
255	K	82.8	Confident	85.3	Confident	118 Å²	118	52.8 Å²	52.8	51%	0.513	30%	0.295	S	S	.	.	H	α-helix	trans	-82.8	-31.6	178.8	-72.6	-175.8	-180	-172.5	0	112.6	G251 F252 P490 N491	G251-K255 PolarHBondContact O-N 2.89Å; F252-K255 PolarHBondContact O-N 3.07Å; K255-P490 WeakPolarHBondContact CE-O 3.42Å; K255-P490 PolarHBondContact NZ-O 3.4Å; K255-N491 VanDerWaalsContact CE-OD1 3.28Å; K255-N491 WeakPolarHBondContact CE-OD1 3.32Å; K255-N491 WeakPolarHBondContact CG-OD1 3.47Å
256	N	82.9	Confident	85.1	Confident	37 Å²	37	55.6 Å²	55.6	20%	0.198	31%	0.313	C	S	.	.	S	Bend	trans	-116.4	118.3	-172.8	-60.7	-84.1	0	0	0	109	F252 T258 I261	F252-N256 WeakPolarHBondContact CD2-ND2 3.34Å; F252-N256 HydrophobicContact CE1-CB 4.39Å; F252-N256 WeakPolarHBondContact CE2-ND2 3.39Å; F252-N256 HydrophobicContact CZ-CB 4.21Å; F252-N256 WeakPolarHBondContact CZ-ND2 3.38Å; F252-N256 PolarHBondContact O-N 2.7Å; F252-N256 VanDerWaalsContact O-N 3.09Å; F252-N256 PolarHBondContact O-ND2 2.98Å; N256-T258 PolarHBondContact O-N 3.28Å; N256-I261 HydrophobicContact CB-CD1 3.94Å; N256-I261 HydrophobicContact CB-CG1 3.89Å; N256-I261 WeakPolarHBondContact O-CD1 3.43Å
257	P	82.3	Confident	85.1	Confident	89 Å²	89	56 Å²	56	58%	0.578	31%	0.312	S	S	*	.			trans	-62.5	140.8	-179.2	24.6	-31.6	0	0	0	110.4	G259 S260 I261	P257-G259 VanDerWaalsContact C-N 3.26Å; P257-G259 PolarHBondContact O-N 3.49Å; P257-G259 VanDerWaalsContact O-N 3.15Å; P257-S260 WeakPolarHBondContact CD-OG 3.49Å; P257-S260 WeakPolarHBondContact CG-OG 3.34Å; P257-S260 WeakPolarHBondContact O-CA 3.43Å; P257-S260 WeakPolarHBondContact O-CB 3.21Å; P257-S260 PolarHBondContact O-N 3.28Å; P257-S260 PolarHBondContact O-OG 3.43Å; P257-I261 PolarHBondContact O-N 2.84Å
258	T	83.6	Confident	84.9	Confident	100 Å²	100	56 Å²	56	61%	0.613	31%	0.314	S	S	*	.	H	α-helix	trans	-52.3	-42	-175	-48.8	0	0	0	0	112.7	N256 S260 I261 T262	N256-T258 PolarHBondContact O-N 3.28Å; T258-S260 VanDerWaalsContact C-N 3.28Å; T258-S260 PolarHBondContact O-N 2.91Å; T258-I261 PolarHBondContact O-N 3.15Å; T258-I261 VanDerWaalsContact O-N 3.11Å; T258-T262 PolarHBondContact O-N 2.78Å; T258-T262 PolarHBondContact O-OG1 2.84Å; T258-T262 VanDerWaalsContact O-OG1 3.07Å
259	G	82.9	Confident	84.9	Confident	56 Å²	56	55.3 Å²	55.3	58%	0.577	31%	0.311	S	S	*	.	H	α-helix	trans	-59.7	-35.7	177.3	0	0	0	0	0	113.7	P257 S263	P257-G259 VanDerWaalsContact C-N 3.26Å; P257-G259 PolarHBondContact O-N 3.49Å; P257-G259 VanDerWaalsContact O-N 3.15Å; G259-S263 WeakPolarHBondContact O-CB 3.33Å; G259-S263 PolarHBondContact O-N 2.9Å
260	S	81.3	Confident	85	Confident	34 Å²	34	55 Å²	55	24%	0.238	31%	0.313	C	S	.	.	H	α-helix	trans	-70.7	-36.7	175.8	73.7	0	0	0	0	112.4	P257 T258 R264	P257-S260 WeakPolarHBondContact CD-OG 3.49Å; P257-S260 WeakPolarHBondContact CG-OG 3.34Å; P257-S260 WeakPolarHBondContact O-CA 3.43Å; P257-S260 WeakPolarHBondContact O-CB 3.21Å; P257-S260 PolarHBondContact O-N 3.28Å; P257-S260 PolarHBondContact O-OG 3.43Å; T258-S260 VanDerWaalsContact C-N 3.28Å; T258-S260 PolarHBondContact O-N 2.91Å; S260-R264 VanDerWaalsContact O-CB 3.31Å; S260-R264 WeakPolarHBondContact O-CB 3.2Å; S260-R264 WeakPolarHBondContact O-CD 3.21Å; S260-R264 WeakPolarHBondContact O-CG 3.48Å; S260-R264 PolarHBondContact O-N 3.47Å; S260-R264 VanDerWaalsContact O-N 3.08Å
261	I	86.9	Confident	85.1	Confident	9 Å²	9	57 Å²	57	5%	0.046	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-45.6	176	-58	172.4	0	0	0	109.1	V245 F252 F253 N256 P257 T258 R264 V265	V245-I261 HydrophobicContact CG1-CG2 3.64Å; F252-I261 HydrophobicContact CD1-CD1 4.32Å; F252-I261 HydrophobicContact CE1-CD1 3.77Å; F252-I261 HydrophobicContact CE1-CG1 4.18Å; F253-I261 HydrophobicContact CD1-CD1 3.45Å; F253-I261 VanDerWaalsContact CD1-CD1 3.45Å; F253-I261 HydrophobicContact CE1-CD1 3.85Å; F253-I261 HydrophobicContact CG-CD1 4.36Å; N256-I261 HydrophobicContact CB-CD1 3.94Å; N256-I261 HydrophobicContact CB-CG1 3.89Å; N256-I261 WeakPolarHBondContact O-CD1 3.43Å; P257-I261 PolarHBondContact O-N 2.84Å; T258-I261 PolarHBondContact O-N 3.15Å; T258-I261 VanDerWaalsContact O-N 3.11Å; I261-R264 PolarHBondContact O-N 3.14Å; I261-V265 HydrophobicContact CG2-CG2 4.19Å; I261-V265 WeakPolarHBondContact O-CB 3.37Å; I261-V265 VanDerWaalsContact O-CG2 3.26Å; I261-V265 WeakPolarHBondContact O-CG2 3.49Å; I261-V265 PolarHBondContact O-N 3.31Å
262	T	86.6	Confident	85.2	Confident	75 Å²	75	57 Å²	57	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-58.8	-55.8	178.5	-56.8	0	0	0	0	111.1	T258 R264 V265 T266	T258-T262 PolarHBondContact O-N 2.78Å; T258-T262 PolarHBondContact O-OG1 2.84Å; T258-T262 VanDerWaalsContact O-OG1 3.07Å; T262-R264 VanDerWaalsContact C-N 3.26Å; T262-R264 PolarHBondContact O-N 2.82Å; T262-V265 PolarHBondContact O-N 2.93Å; T262-V265 VanDerWaalsContact O-N 3.13Å; T262-T266 HydrophobicContact CG2-CG2 4.43Å; T262-T266 PolarHBondContact O-N 3.23Å; T262-T266 PolarHBondContact O-OG1 3.08Å
263	S	85.3	Confident	85.2	Confident	40 Å²	40	56.7 Å²	56.7	28%	0.28	32%	0.32	S	S	.	.	H	α-helix	trans	-57.9	-37.6	178.8	171.1	0	0	0	0	112	G259 E267 D268	G259-S263 WeakPolarHBondContact O-CB 3.33Å; G259-S263 PolarHBondContact O-N 2.9Å; S263-E267 WeakPolarHBondContact O-CA 3.35Å; S263-E267 WeakPolarHBondContact O-CB 3.35Å; S263-E267 PolarHBondContact O-N 2.99Å; S263-E267 PolarHBondContact OG-OE2 3.48Å; S263-D268 PolarHBondContact O-N 2.88Å
264	R	82.6	Confident	85.3	Confident	85 Å²	85	58 Å²	58	32%	0.321	33%	0.327	S	S	.	.	I	π-helix	trans	-66.7	-43.2	175.7	-74.3	173.3	-176.5	-154.6	3.1	113.3	S260 I261 T262 D268 T269 Y458	S260-R264 VanDerWaalsContact O-CB 3.31Å; S260-R264 WeakPolarHBondContact O-CB 3.2Å; S260-R264 WeakPolarHBondContact O-CD 3.21Å; S260-R264 WeakPolarHBondContact O-CG 3.48Å; S260-R264 PolarHBondContact O-N 3.47Å; S260-R264 VanDerWaalsContact O-N 3.08Å; I261-R264 PolarHBondContact O-N 3.14Å; T262-R264 VanDerWaalsContact C-N 3.26Å; T262-R264 PolarHBondContact O-N 2.82Å; R264-D268 WeakPolarHBondContact O-CB 3.46Å; R264-T269 PolarHBondContact O-N 2.88Å; R264-T269 PolarHBondContact O-OG1 2.8Å; R264-Y458 WeakPolarHBondContact CD-OH 3.48Å; R264-Y458 PolarHBondContact NH1-OH 3.48Å
265	V	86.7	Confident	85.6	Confident	13 Å²	13	56.2 Å²	56.2	8%	0.079	32%	0.321	C	S	.	.	I	π-helix	trans	-73.9	-31.1	-178.8	174.5	0	0	0	0	111.9	H238 V241 F242 V245 I261 T262 T269	H238-V265 PolarHBondContact CE1-O 3Å; H238-V265 VanDerWaalsContact CE1-O 3.25Å; H238-V265 PolarHBondContact ND1-O 3.04Å; H238-V265 VanDerWaalsContact ND1-O 3.14Å; V241-V265 HydrophobicContact CG1-CG1 4.27Å; V241-V265 HydrophobicContact CG1-CG2 4.15Å; F242-V265 HydrophobicContact CB-CG1 4.24Å; F242-V265 HydrophobicContact CD2-CG1 4.17Å; V245-V265 HydrophobicContact CG2-CG2 3.78Å; I261-V265 HydrophobicContact CG2-CG2 4.19Å; I261-V265 WeakPolarHBondContact O-CB 3.37Å; I261-V265 VanDerWaalsContact O-CG2 3.26Å; I261-V265 WeakPolarHBondContact O-CG2 3.49Å; I261-V265 PolarHBondContact O-N 3.31Å; T262-V265 PolarHBondContact O-N 2.93Å; T262-V265 VanDerWaalsContact O-N 3.13Å; V265-T269 VanDerWaalsContact O-CB 3.28Å; V265-T269 WeakPolarHBondContact O-CB 3.32Å; V265-T269 PolarHBondContact O-OG1 3.44Å
266	T	86.8	Confident	85.7	Confident	68 Å²	68	50.9 Å²	50.9	42%	0.417	30%	0.298	S	S	.	.	I	π-helix	trans	-96.7	-70.7	-179.2	59.8	0	0	0	0	111.7	H238 T262 S270	H238-T266 PolarHBondContact CE1-O 3.5Å; T262-T266 HydrophobicContact CG2-CG2 4.43Å; T262-T266 PolarHBondContact O-N 3.23Å; T262-T266 PolarHBondContact O-OG1 3.08Å; T266-S270 WeakPolarHBondContact O-CB 3.27Å; T266-S270 PolarHBondContact O-N 3.47Å
267	E	86.5	Confident	86	Confident	113 Å²	113	49.6 Å²	49.6	53%	0.528	29%	0.293	S	S	.	.	I	π-helix	trans	-69.2	-53.6	-171.5	-61.5	173.9	161	0	0	111.9	S263 T269 S270 N271	S263-E267 WeakPolarHBondContact O-CA 3.35Å; S263-E267 WeakPolarHBondContact O-CB 3.35Å; S263-E267 PolarHBondContact O-N 2.99Å; S263-E267 PolarHBondContact OG-OE2 3.48Å; E267-T269 VanDerWaalsContact C-N 3.33Å; E267-T269 PolarHBondContact O-N 3.31Å; E267-S270 PolarHBondContact O-N 3.26Å; E267-N271 VanDerWaalsContact O-CB 3.23Å; E267-N271 WeakPolarHBondContact O-CB 3.09Å; E267-N271 PolarHBondContact O-N 3.44Å; E267-N271 PolarHBondContact O-ND2 3.27Å; E267-N271 VanDerWaalsContact O-ND2 3.13Å
268	D	85	Confident	86.4	Confident	68 Å²	68	48.7 Å²	48.7	36%	0.364	28%	0.283	S	S	.	.	I	π-helix	trans	-64	-41.9	-177.1	-73.2	-18.6	0	0	0	111	S263 R264 V272	S263-D268 PolarHBondContact O-N 2.88Å; R264-D268 WeakPolarHBondContact O-CB 3.46Å; D268-V272 VanDerWaalsContact O-CB 3.29Å; D268-V272 WeakPolarHBondContact O-CB 3.49Å; D268-V272 WeakPolarHBondContact O-CG2 3.47Å; D268-V272 PolarHBondContact O-N 3.5Å
269	T	87.4	Confident	86.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-41.1	177.9	-56.7	0	0	0	0	111.8	V237 V241 R264 V265 E267 C273 I455	V237-T269 HydrophobicContact CG1-CG2 3.98Å; V241-T269 HydrophobicContact CG2-CG2 4.38Å; R264-T269 PolarHBondContact O-N 2.88Å; R264-T269 PolarHBondContact O-OG1 2.8Å; V265-T269 VanDerWaalsContact O-CB 3.28Å; V265-T269 WeakPolarHBondContact O-CB 3.32Å; V265-T269 PolarHBondContact O-OG1 3.44Å; E267-T269 VanDerWaalsContact C-N 3.33Å; E267-T269 PolarHBondContact O-N 3.31Å; T269-C273 WeakPolarHBondContact O-CB 3.41Å; T269-C273 PolarHBondContact O-N 2.79Å; T269-C273 PolarHBondContact O-SG 3.29Å; T269-I455 HydrophobicContact CG2-CD1 4.45Å
270	S	88.7	Confident	86.8	Confident	34 Å²	34	45.8 Å²	45.8	24%	0.238	25%	0.247	C	C	.	.	H	α-helix	trans	-65.5	-51.4	176.3	-174.8	0	0	0	0	111.2	H238 T266 E267 V272 C273 E274	H238-S270 PolarHBondContact NE2-N 3.2Å; T266-S270 WeakPolarHBondContact O-CB 3.27Å; T266-S270 PolarHBondContact O-N 3.47Å; E267-S270 PolarHBondContact O-N 3.26Å; S270-V272 VanDerWaalsContact C-N 3.28Å; S270-V272 PolarHBondContact O-N 3.3Å; S270-C273 PolarHBondContact O-N 3.02Å; S270-C273 VanDerWaalsContact O-N 3.15Å; S270-E274 VanDerWaalsContact O-CB 3.3Å; S270-E274 WeakPolarHBondContact O-CB 3.17Å; S270-E274 PolarHBondContact O-N 3.49Å
271	N	87.9	Confident	87.2	Confident	86 Å²	86	45.1 Å²	45.1	46%	0.46	24%	0.241	S	C	.	.	H	α-helix	trans	-57.5	-41.1	-179.6	-72.3	-25.5	0	0	0	111.9	E267 S275	E267-N271 VanDerWaalsContact O-CB 3.23Å; E267-N271 WeakPolarHBondContact O-CB 3.09Å; E267-N271 PolarHBondContact O-N 3.44Å; E267-N271 PolarHBondContact O-ND2 3.27Å; E267-N271 VanDerWaalsContact O-ND2 3.13Å; N271-S275 WeakPolarHBondContact O-CB 3.34Å; N271-S275 PolarHBondContact O-N 3.34Å; N271-S275 PolarHBondContact O-OG 3.05Å
272	V	87.3	Confident	87.4	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-67.9	-48.3	177	167.2	0	0	0	0	111	M153 D268 S270 S275 I276 A451 S452 I455	M153-V272 HydrophobicContact CE-CG1 4.12Å; M153-V272 HydrophobicContact SD-CG1 4.37Å; D268-V272 VanDerWaalsContact O-CB 3.29Å; D268-V272 WeakPolarHBondContact O-CB 3.49Å; D268-V272 WeakPolarHBondContact O-CG2 3.47Å; D268-V272 PolarHBondContact O-N 3.5Å; S270-V272 VanDerWaalsContact C-N 3.28Å; S270-V272 PolarHBondContact O-N 3.3Å; V272-S275 PolarHBondContact O-N 3.11Å; V272-I276 HydrophobicContact CG1-CD1 3.67Å; V272-I276 WeakPolarHBondContact O-CB 3.22Å; V272-I276 VanDerWaalsContact O-CG1 3.26Å; V272-I276 WeakPolarHBondContact O-CG1 3.39Å; V272-I276 PolarHBondContact O-N 3.38Å; V272-A451 HydrophobicContact CG2-CB 3.64Å; V272-S452 VanDerWaalsContact CG1-CB 3.47Å; V272-I455 HydrophobicContact CB-CD1 3.78Å; V272-I455 HydrophobicContact CG1-CD1 3.98Å; V272-I455 HydrophobicContact CG2-CD1 3.81Å
273	C	86.3	Confident	87.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-44.2	-179.4	-71.2	0	0	0	0	112	H234 T269 S270 S277	H234-C273 WeakPolarHBondContact ND1-CB 3.41Å; T269-C273 WeakPolarHBondContact O-CB 3.41Å; T269-C273 PolarHBondContact O-N 2.79Å; T269-C273 PolarHBondContact O-SG 3.29Å; S270-C273 PolarHBondContact O-N 3.02Å; S270-C273 VanDerWaalsContact O-N 3.15Å; C273-S277 WeakPolarHBondContact O-CB 3.41Å; C273-S277 PolarHBondContact O-N 3.33Å
274	E	88.8	Confident	87.7	Confident	104 Å²	104	47.6 Å²	47.6	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-65.2	-48.5	176.8	-174.3	176.7	-171	0	0	110.9	S270 I276 S277 D278	S270-E274 VanDerWaalsContact O-CB 3.3Å; S270-E274 WeakPolarHBondContact O-CB 3.17Å; S270-E274 PolarHBondContact O-N 3.49Å; E274-I276 VanDerWaalsContact C-N 3.33Å; E274-I276 PolarHBondContact O-N 2.89Å; E274-S277 WeakPolarHBondContact O-CB 3.26Å; E274-S277 PolarHBondContact O-N 2.91Å; E274-D278 PolarHBondContact O-N 2.96Å
275	S	88.7	Confident	88	Confident	43 Å²	43	45.4 Å²	45.4	30%	0.301	24%	0.236	S	C	.	.	H	α-helix	trans	-59.3	-44.8	177.5	-65.1	0	0	0	0	111.8	N271 V272 K279 S448	N271-S275 WeakPolarHBondContact O-CB 3.34Å; N271-S275 PolarHBondContact O-N 3.34Å; N271-S275 PolarHBondContact O-OG 3.05Å; V272-S275 PolarHBondContact O-N 3.11Å; S275-K279 VanDerWaalsContact O-CB 3.25Å; S275-K279 WeakPolarHBondContact O-CB 3.37Å; S275-K279 WeakPolarHBondContact O-CG 3.27Å; S275-K279 PolarHBondContact O-N 2.99Å; S275-S448 VanDerWaalsContact CB-OG 3.22Å; S275-S448 WeakPolarHBondContact CB-OG 3.16Å
276	I	86.3	Confident	88.2	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-41.2	179.6	-69.2	171.3	0	0	0	110.4	L150 M153 V272 E274 L280	L150-I276 HydrophobicContact CD2-CG2 4.02Å; M153-I276 HydrophobicContact CE-CD1 4.03Å; M153-I276 HydrophobicContact SD-CD1 3.25Å; M153-I276 WeakPolarHBondContact SD-CD1 3.45Å; V272-I276 HydrophobicContact CG1-CD1 3.67Å; V272-I276 WeakPolarHBondContact O-CB 3.22Å; V272-I276 VanDerWaalsContact O-CG1 3.26Å; V272-I276 WeakPolarHBondContact O-CG1 3.39Å; V272-I276 PolarHBondContact O-N 3.38Å; E274-I276 VanDerWaalsContact C-N 3.33Å; E274-I276 PolarHBondContact O-N 2.89Å; I276-L280 WeakPolarHBondContact O-CB 3.34Å; I276-L280 PolarHBondContact O-N 3.31Å
277	S	88.3	Confident	88.3	Confident	11 Å²	11	48 Å²	48	8%	0.077	24%	0.242	C	C	.	.	H	α-helix	trans	-52.9	-56.2	172.5	173.1	0	0	0	0	112.3	Y226 M230 C273 E274 L280 N281	Y226-S277 PolarHBondContact OH-O 2.94Å; M230-S277 VanDerWaalsContact CE-CA 3.4Å; M230-S277 WeakPolarHBondContact CG-OG 3.3Å; C273-S277 WeakPolarHBondContact O-CB 3.41Å; C273-S277 PolarHBondContact O-N 3.33Å; E274-S277 WeakPolarHBondContact O-CB 3.26Å; E274-S277 PolarHBondContact O-N 2.91Å; S277-L280 PolarHBondContact O-N 3.23Å; S277-N281 WeakPolarHBondContact O-CB 3.42Å; S277-N281 PolarHBondContact O-N 2.89Å
278	D	89.8	Confident	88.3	Confident	70 Å²	70	43.1 Å²	43.1	37%	0.374	22%	0.223	S	C	.	.	H	α-helix	trans	-69.2	-43.7	-173.4	-69.7	-5.5	0	0	0	111.2	E274 L280 N281 L282	E274-D278 PolarHBondContact O-N 2.96Å; D278-L280 VanDerWaalsContact C-N 3.33Å; D278-L280 PolarHBondContact O-N 3.24Å; D278-N281 PolarHBondContact O-N 2.93Å; D278-L282 WeakPolarHBondContact O-CB 3.43Å; D278-L282 VanDerWaalsContact O-CG 3.25Å; D278-L282 WeakPolarHBondContact O-CG 3.25Å; D278-L282 PolarHBondContact O-N 3.31Å
279	K	88.9	Confident	88.5	Confident	62 Å²	62	42.4 Å²	42.4	27%	0.27	22%	0.215	S	C	.	.	H	α-helix	trans	-68.3	-33.7	179.6	-62.6	-50.7	169.4	-162.9	0	111.8	S275 L282 F283 I441 S444 M445	S275-K279 VanDerWaalsContact O-CB 3.25Å; S275-K279 WeakPolarHBondContact O-CB 3.37Å; S275-K279 WeakPolarHBondContact O-CG 3.27Å; S275-K279 PolarHBondContact O-N 2.99Å; K279-L282 HydrophobicContact CD-CD1 4.37Å; K279-F283 WeakPolarHBondContact O-CB 3.5Å; K279-F283 PolarHBondContact O-N 3.03Å; K279-I441 HydrophobicContact CB-CG2 4.18Å; K279-S444 VanDerWaalsContact CE-OG 3.24Å; K279-S444 WeakPolarHBondContact CE-OG 3.41Å; K279-M445 HydrophobicContact CB-CE 3.63Å; K279-M445 HydrophobicContact CB-SD 4.05Å
280	L	87.3	Confident	88.6	Confident	33 Å²	33	42.9 Å²	42.9	17%	0.173	22%	0.22	C	C	.	.	H	α-helix	trans	-69.6	-41.7	174.2	-177.1	67.7	0	0	0	111.3	L154 I276 S277 D278 F283 L284 M445	L154-L280 HydrophobicContact CD2-CD2 3.97Å; I276-L280 WeakPolarHBondContact O-CB 3.34Å; I276-L280 PolarHBondContact O-N 3.31Å; S277-L280 PolarHBondContact O-N 3.23Å; D278-L280 VanDerWaalsContact C-N 3.33Å; D278-L280 PolarHBondContact O-N 3.24Å; L280-F283 PolarHBondContact O-N 3.33Å; L280-L284 HydrophobicContact CG-CD1 4.28Å; L280-L284 WeakPolarHBondContact O-CG 3.3Å; L280-L284 PolarHBondContact O-N 3.1Å; L280-M445 HydrophobicContact CB-CE 4.4Å
281	N	89.4	Confident	88.5	Confident	20 Å²	20	46.5 Å²	46.5	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-56.8	175.6	-161.8	19	0	0	0	109.6	D223 Y226 S277 D278 F283 L284 W285	D223-N281 PolarHBondContact OD1-ND2 3.2Å; Y226-N281 HydrophobicContact CD1-CB 4.08Å; Y226-N281 HydrophobicContact CE1-CB 3.43Å; Y226-N281 VanDerWaalsContact CE1-CB 3.43Å; Y226-N281 HydrophobicContact CE2-CB 4.42Å; Y226-N281 PolarHBondContact OH-N 3.17Å; S277-N281 WeakPolarHBondContact O-CB 3.42Å; S277-N281 PolarHBondContact O-N 2.89Å; D278-N281 PolarHBondContact O-N 2.93Å; N281-F283 PolarHBondContact O-N 3.22Å; N281-L284 PolarHBondContact O-N 2.95Å; N281-L284 VanDerWaalsContact O-N 3.11Å; N281-W285 PolarHBondContact O-N 2.92Å; N281-W285 PolarHBondContact OD1-NE1 2.75Å
282	L	90.3	Very high	88.5	Confident	61 Å²	61	43.3 Å²	43.3	32%	0.319	22%	0.22	S	C	.	.	H	α-helix	trans	-55.7	-41.2	178.2	-69.5	168.2	0	0	0	111.6	D278 K279 W285 Y286 I441	D278-L282 WeakPolarHBondContact O-CB 3.43Å; D278-L282 VanDerWaalsContact O-CG 3.25Å; D278-L282 WeakPolarHBondContact O-CG 3.25Å; D278-L282 PolarHBondContact O-N 3.31Å; K279-L282 HydrophobicContact CD-CD1 4.37Å; L282-W285 PolarHBondContact O-N 3.13Å; L282-Y286 HydrophobicContact CB-CD2 4.42Å; L282-Y286 HydrophobicContact CD2-CD2 4.29Å; L282-Y286 HydrophobicContact CD2-CE2 3.81Å; L282-Y286 WeakPolarHBondContact O-CB 3.49Å; L282-Y286 VanDerWaalsContact O-CD2 3.27Å; L282-Y286 WeakPolarHBondContact O-CD2 3.35Å; L282-Y286 PolarHBondContact O-N 3.03Å; L282-I441 HydrophobicContact CB-CD1 3.76Å; L282-I441 HydrophobicContact CB-CG1 4.5Å
283	F	89.9	Confident	88.6	Confident	69 Å²	69	43 Å²	43	30%	0.303	22%	0.219	S	C	.	.	H	α-helix	trans	-60.8	-49.7	177.6	177.8	-97	0	0	0	111.5	K279 L280 N281 L287 L438 I441	K279-F283 WeakPolarHBondContact O-CB 3.5Å; K279-F283 PolarHBondContact O-N 3.03Å; L280-F283 PolarHBondContact O-N 3.33Å; N281-F283 PolarHBondContact O-N 3.22Å; F283-L287 HydrophobicContact CE1-CD2 3.89Å; F283-L287 HydrophobicContact CZ-CD2 4.03Å; F283-L287 WeakPolarHBondContact O-CB 3.45Å; F283-L287 PolarHBondContact O-N 3.04Å; F283-L438 HydrophobicContact CD2-CD1 3.4Å; F283-L438 VanDerWaalsContact CD2-CD1 3.4Å; F283-L438 HydrophobicContact CE2-CD1 3.67Å; F283-L438 HydrophobicContact CG-CD1 4.3Å; F283-I441 HydrophobicContact CB-CD1 4.18Å; F283-I441 HydrophobicContact CB-CG2 4.39Å
284	L	87.9	Confident	88.7	Confident	46 Å²	46	45.8 Å²	45.8	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-44.7	179.4	-69.8	171.2	0	0	0	111.7	L171 L280 N281 G288	L171-L284 HydrophobicContact CD1-CB 4.21Å; L280-L284 HydrophobicContact CG-CD1 4.28Å; L280-L284 WeakPolarHBondContact O-CG 3.3Å; L280-L284 PolarHBondContact O-N 3.1Å; N281-L284 PolarHBondContact O-N 2.95Å; N281-L284 VanDerWaalsContact O-N 3.11Å; L284-G288 PolarHBondContact O-N 3.09Å
285	W	89.8	Confident	88.6	Confident	39 Å²	39	43.6 Å²	43.6	15%	0.148	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-56	177.7	-85.2	96.9	0	0	0	112.6	L171 E219 N281 L282 L287 G288 R289	L171-W285 HydrophobicContact CD1-CB 4.39Å; L171-W285 HydrophobicContact CD1-CD2 3.77Å; L171-W285 HydrophobicContact CD1-CE3 4.35Å; L171-W285 HydrophobicContact CD1-CG 3.78Å; L171-W285 HydrophobicContact CD1-CZ2 4.5Å; L171-W285 HydrophobicContact CG-CD2 4.04Å; L171-W285 HydrophobicContact CG-CE3 4.11Å; L171-W285 HydrophobicContact CG-CG 4.47Å; L171-W285 HydrophobicContact CG-CZ3 4.39Å; E219-W285 HydrophobicContact CB-CH2 3.63Å; E219-W285 HydrophobicContact CB-CZ2 4.31Å; E219-W285 HydrophobicContact CB-CZ3 4.45Å; E219-W285 HydrophobicContact CG-CH2 3.54Å; E219-W285 HydrophobicContact CG-CZ3 3.96Å; N281-W285 PolarHBondContact O-N 2.92Å; N281-W285 PolarHBondContact OD1-NE1 2.75Å; L282-W285 PolarHBondContact O-N 3.13Å; W285-L287 VanDerWaalsContact C-N 3.32Å; W285-L287 PolarHBondContact O-N 3.17Å; W285-G288 PolarHBondContact O-N 3.45Å; W285-R289 VanDerWaalsContact O-CB 3.24Å; W285-R289 WeakPolarHBondContact O-CB 3.39Å; W285-R289 PolarHBondContact O-N 3Å
286	Y	90.6	Very high	88.5	Confident	69 Å²	69	43.6 Å²	43.6	27%	0.271	23%	0.227	S	C	.	.	H	α-helix	trans	-73.4	-25.3	-176.2	-75.7	-73.7	0	0	0	113	L282 G290 A434 V437	L282-Y286 HydrophobicContact CB-CD2 4.42Å; L282-Y286 HydrophobicContact CD2-CD2 4.29Å; L282-Y286 HydrophobicContact CD2-CE2 3.81Å; L282-Y286 WeakPolarHBondContact O-CB 3.49Å; L282-Y286 VanDerWaalsContact O-CD2 3.27Å; L282-Y286 WeakPolarHBondContact O-CD2 3.35Å; L282-Y286 PolarHBondContact O-N 3.03Å; Y286-G290 WeakPolarHBondContact O-CA 3.31Å; Y286-G290 PolarHBondContact O-N 2.99Å; Y286-A434 HydrophobicContact CD1-CB 3.85Å; Y286-V437 HydrophobicContact CD1-CB 4.35Å; Y286-V437 HydrophobicContact CD2-CB 4.1Å; Y286-V437 HydrophobicContact CD2-CG1 3.48Å; Y286-V437 VanDerWaalsContact CD2-CG1 3.48Å; Y286-V437 HydrophobicContact CE1-CB 4.38Å; Y286-V437 HydrophobicContact CE1-CG2 4.3Å; Y286-V437 HydrophobicContact CE2-CB 4.19Å; Y286-V437 HydrophobicContact CE2-CG1 3.57Å; Y286-V437 HydrophobicContact CE2-CG2 4.38Å; Y286-V437 HydrophobicContact CG-CB 4.18Å; Y286-V437 HydrophobicContact CG-CG1 4.03Å
287	L	89.1	Confident	88.4	Confident	65 Å²	65	43.4 Å²	43.4	34%	0.34	23%	0.226	S	C	.	.	H	α-helix	trans	-67.6	-50.4	169.8	-175.4	70.3	0	0	0	110.9	F283 W285 G290 L291 L438	F283-L287 HydrophobicContact CE1-CD2 3.89Å; F283-L287 HydrophobicContact CZ-CD2 4.03Å; F283-L287 WeakPolarHBondContact O-CB 3.45Å; F283-L287 PolarHBondContact O-N 3.04Å; W285-L287 VanDerWaalsContact C-N 3.32Å; W285-L287 PolarHBondContact O-N 3.17Å; L287-G290 PolarHBondContact O-N 3.22Å; L287-L291 HydrophobicContact CG-CD1 4.38Å; L287-L291 VanDerWaalsContact O-CG 3.32Å; L287-L291 WeakPolarHBondContact O-CG 3.39Å; L287-L291 PolarHBondContact O-N 3.31Å; L287-L438 HydrophobicContact CB-CD1 4.5Å; L287-L438 HydrophobicContact CD1-CD2 4.31Å
288	G	87.4	Confident	88.2	Confident	12 Å²	12	45.6 Å²	45.6	12%	0.124	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-49.8	176.9	0	0	0	0	0	111.7	L284 W285 G290 L291 C292	L284-G288 PolarHBondContact O-N 3.09Å; W285-G288 PolarHBondContact O-N 3.45Å; G288-G290 PolarHBondContact O-N 3.21Å; G288-L291 PolarHBondContact O-N 2.72Å; G288-C292 PolarHBondContact O-N 3.22Å; G288-C292 PolarHBondContact O-SG 3.01Å; G288-C292 VanDerWaalsContact O-SG 3.41Å
289	R	88.8	Confident	88	Confident	52 Å²	52	52 Å²	52	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-43.5	176.7	-171.6	172.9	179.6	142.3	8	112.2	E178 M179 W285 L291 C292 L293	E178-R289 VanDerWaalsContact CD-NH1 3.32Å; E178-R289 IonicContact OE1-CZ 2.59Å; E178-R289 IonicContact OE1-NH1 3Å; E178-R289 PolarHBondContact OE1-NH1 3Å; E178-R289 IonicContact OE1-NH2 3.4Å; E178-R289 IonicContact OE2-CZ 2.63Å; E178-R289 VanDerWaalsContact OE2-CZ 3.32Å; E178-R289 IonicContact OE2-NE 3.18Å; E178-R289 IonicContact OE2-NH1 3.37Å; E178-R289 PolarHBondContact OE2-NH1 3.37Å; E178-R289 IonicContact OE2-NH2 2.86Å; M179-R289 HydrophobicContact CE-CG 3.85Å; W285-R289 VanDerWaalsContact O-CB 3.24Å; W285-R289 WeakPolarHBondContact O-CB 3.39Å; W285-R289 PolarHBondContact O-N 3Å; R289-L291 PolarHBondContact O-N 3.31Å; R289-C292 PolarHBondContact O-N 3.33Å; R289-L293 HydrophobicContact CG-CD1 3.82Å; R289-L293 HydrophobicContact CG-CG 4.41Å; R289-L293 VanDerWaalsContact O-CB 3.27Å; R289-L293 WeakPolarHBondContact O-CB 3.35Å; R289-L293 WeakPolarHBondContact O-CD1 3.26Å; R289-L293 VanDerWaalsContact O-CG 3.23Å; R289-L293 WeakPolarHBondContact O-CG 3.33Å; R289-L293 PolarHBondContact O-N 3Å
290	G	88.3	Confident	87.5	Confident	11 Å²	11	51 Å²	51	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-42.5	177.3	0	0	0	0	0	112.9	Y286 L287 G288 L294	Y286-G290 WeakPolarHBondContact O-CA 3.31Å; Y286-G290 PolarHBondContact O-N 2.99Å; L287-G290 PolarHBondContact O-N 3.22Å; G288-G290 PolarHBondContact O-N 3.21Å; G290-L294 VanDerWaalsContact O-CB 3.28Å; G290-L294 WeakPolarHBondContact O-CB 3.29Å; G290-L294 PolarHBondContact O-N 2.97Å
291	L	87.8	Confident	87.2	Confident	110 Å²	110	50.3 Å²	50.3	58%	0.576	26%	0.261	S	S	*	.	H	α-helix	trans	-66.9	-44.8	176.7	-69.6	172.8	0	0	0	112	L287 G288 R289 L294 A295	L287-L291 HydrophobicContact CG-CD1 4.38Å; L287-L291 VanDerWaalsContact O-CG 3.32Å; L287-L291 WeakPolarHBondContact O-CG 3.39Å; L287-L291 PolarHBondContact O-N 3.31Å; G288-L291 PolarHBondContact O-N 2.72Å; R289-L291 PolarHBondContact O-N 3.31Å; L291-L294 PolarHBondContact O-N 2.97Å; L291-A295 PolarHBondContact O-N 3.04Å
292	C	87.7	Confident	86.9	Confident	19 Å²	19	54 Å²	54	13%	0.128	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-48.8	175.3	-70.7	0	0	0	0	111.4	C175 M179 G288 R289 L294 A295 F296	C175-C292 HydrophobicContact CB-CB 4.34Å; M179-C292 HydrophobicContact CG-CB 4.29Å; G288-C292 PolarHBondContact O-N 3.22Å; G288-C292 PolarHBondContact O-SG 3.01Å; G288-C292 VanDerWaalsContact O-SG 3.41Å; R289-C292 PolarHBondContact O-N 3.33Å; C292-L294 VanDerWaalsContact C-N 3.33Å; C292-L294 PolarHBondContact O-N 3.46Å; C292-A295 WeakPolarHBondContact O-CB 3.41Å; C292-A295 PolarHBondContact O-N 3.36Å; C292-F296 VanDerWaalsContact O-CD2 3.25Å; C292-F296 WeakPolarHBondContact O-CD2 3.39Å; C292-F296 PolarHBondContact O-N 3.12Å
293	L	89.4	Confident	86.4	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-46.2	177.1	-80.4	166.1	0	0	0	112.1	M179 R289 A295 F296 M297 Y427 Q430 F431 A434	M179-L293 HydrophobicContact CE-CD2 4.23Å; M179-L293 HydrophobicContact CE-CG 4.19Å; M179-L293 HydrophobicContact SD-CD1 4.42Å; M179-L293 HydrophobicContact SD-CD2 3.16Å; M179-L293 WeakPolarHBondContact SD-CD2 3.42Å; M179-L293 HydrophobicContact SD-CG 3.47Å; M179-L293 WeakPolarHBondContact SD-CG 2.86Å; R289-L293 HydrophobicContact CG-CD1 3.82Å; R289-L293 HydrophobicContact CG-CG 4.41Å; R289-L293 VanDerWaalsContact O-CB 3.27Å; R289-L293 WeakPolarHBondContact O-CB 3.35Å; R289-L293 WeakPolarHBondContact O-CD1 3.26Å; R289-L293 VanDerWaalsContact O-CG 3.23Å; R289-L293 WeakPolarHBondContact O-CG 3.33Å; R289-L293 PolarHBondContact O-N 3Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 3.44Å; L293-F296 PolarHBondContact O-N 3.4Å; L293-M297 WeakPolarHBondContact O-CB 3.31Å; L293-M297 VanDerWaalsContact O-CG 3.26Å; L293-M297 WeakPolarHBondContact O-CG 3.33Å; L293-M297 PolarHBondContact O-N 3.02Å; L293-Y427 HydrophobicContact CD2-CD1 3.59Å; L293-Y427 HydrophobicContact CD2-CE1 4.43Å; L293-Y427 HydrophobicContact CD2-CG 4.34Å; L293-Q430 HydrophobicContact CD1-CB 3.94Å; L293-Q430 HydrophobicContact CD2-CB 4.02Å; L293-F431 HydrophobicContact CB-CB 4.27Å; L293-F431 HydrophobicContact CB-CD2 3.97Å; L293-F431 HydrophobicContact CD1-CB 4.18Å; L293-A434 HydrophobicContact CD1-CB 4.41Å
294	L	87.8	Confident	85.9	Confident	60 Å²	60	54.2 Å²	54.2	31%	0.314	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-40.6	178.7	-174.8	139.2	0	0	0	111.5	G290 L291 C292 M297 I298 F431	G290-L294 VanDerWaalsContact O-CB 3.28Å; G290-L294 WeakPolarHBondContact O-CB 3.29Å; G290-L294 PolarHBondContact O-N 2.97Å; L291-L294 PolarHBondContact O-N 2.97Å; C292-L294 VanDerWaalsContact C-N 3.33Å; C292-L294 PolarHBondContact O-N 3.46Å; L294-M297 PolarHBondContact O-N 2.94Å; L294-I298 HydrophobicContact CD2-CD1 3.59Å; L294-I298 HydrophobicContact CG-CD1 4.32Å; L294-I298 VanDerWaalsContact O-CG1 3.28Å; L294-I298 WeakPolarHBondContact O-CG1 3.35Å; L294-I298 PolarHBondContact O-N 3.36Å; L294-F431 HydrophobicContact CB-CE2 4.09Å; L294-F431 HydrophobicContact CD1-CE2 4.17Å; L294-F431 HydrophobicContact CD1-CZ 4.04Å
295	A	86.6	Confident	85.8	Confident	57 Å²	57	52.6 Å²	52.6	47%	0.471	26%	0.264	S	S	.	.	H	α-helix	trans	-62.3	-45.5	175.2	0	0	0	0	0	112.4	L291 C292 L293 I298 W299	L291-A295 PolarHBondContact O-N 3.04Å; C292-A295 WeakPolarHBondContact O-CB 3.41Å; C292-A295 PolarHBondContact O-N 3.36Å; L293-A295 VanDerWaalsContact C-N 3.32Å; L293-A295 PolarHBondContact O-N 3.44Å; A295-I298 PolarHBondContact O-N 3.47Å; A295-W299 PolarHBondContact O-N 3.08Å; A295-W299 VanDerWaalsContact O-N 3.08Å
296	F	86.2	Confident	85.5	Confident	43 Å²	43	53.8 Å²	53.8	19%	0.189	28%	0.275	C	S	.	.	H	α-helix	trans	-66.8	-36.3	176.6	-81.2	-75.1	0	0	0	113	L176 M179 C292 L293 W299 G300 Y427	L176-F296 HydrophobicContact CD2-CE2 4.02Å; L176-F296 HydrophobicContact CD2-CZ 4.3Å; M179-F296 HydrophobicContact CB-CD2 3.85Å; M179-F296 HydrophobicContact CB-CE2 3.67Å; M179-F296 HydrophobicContact CB-CZ 4.33Å; M179-F296 HydrophobicContact CG-CD2 3.93Å; M179-F296 HydrophobicContact CG-CE2 4.03Å; C292-F296 VanDerWaalsContact O-CD2 3.25Å; C292-F296 WeakPolarHBondContact O-CD2 3.39Å; C292-F296 PolarHBondContact O-N 3.12Å; L293-F296 PolarHBondContact O-N 3.4Å; F296-W299 HydrophobicContact CD1-CE3 4.25Å; F296-W299 HydrophobicContact CE1-CE3 4.26Å; F296-W299 HydrophobicContact CE1-CZ3 4.29Å; F296-W299 PolarHBondContact O-N 3.39Å; F296-G300 PolarHBondContact O-N 2.98Å; F296-Y427 HydrophobicContact CB-CD2 4.44Å; F296-Y427 HydrophobicContact CB-CE1 4.26Å; F296-Y427 HydrophobicContact CB-CE2 4.08Å
297	M	85.2	Confident	85.1	Confident	2 Å²	2	52 Å²	52	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-43.4	175	-74.1	177.7	70.5	0	0	111.7	L293 L294 W299 G300 S301 T305 T308 F424 Q428 F431	L293-M297 WeakPolarHBondContact O-CB 3.31Å; L293-M297 VanDerWaalsContact O-CG 3.26Å; L293-M297 WeakPolarHBondContact O-CG 3.33Å; L293-M297 PolarHBondContact O-N 3.02Å; L294-M297 PolarHBondContact O-N 2.94Å; M297-W299 VanDerWaalsContact C-N 3.31Å; M297-W299 PolarHBondContact O-N 3.09Å; M297-G300 PolarHBondContact O-N 3.45Å; M297-S301 PolarHBondContact O-N 2.98Å; M297-T305 HydrophobicContact CB-CG2 4.1Å; M297-T305 PolarHBondContact O-OG1 3.3Å; M297-T308 HydrophobicContact CE-CG2 3.93Å; M297-T308 VanDerWaalsContact CE-OG1 3.32Å; M297-T308 WeakPolarHBondContact CE-OG1 3.33Å; M297-F424 HydrophobicContact CB-CE2 4.24Å; M297-F424 HydrophobicContact CE-CE1 4.33Å; M297-F424 HydrophobicContact CE-CE2 3.86Å; M297-F424 HydrophobicContact CE-CZ 3.57Å; M297-F424 HydrophobicContact CG-CE2 4.39Å; M297-Q428 HydrophobicContact CE-CB 4.02Å; M297-Q428 HydrophobicContact CE-CG 4.32Å; M297-F431 HydrophobicContact SD-CB 3.91Å; M297-F431 HydrophobicContact SD-CD1 4.3Å; M297-F431 HydrophobicContact SD-CG 4.04Å
298	I	84.9	Confident	84.8	Confident	57 Å²	57	49.1 Å²	49.1	29%	0.292	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-40.8	176.1	-69.2	169.4	0	0	0	110.6	L294 A295 F302 T305	L294-I298 HydrophobicContact CD2-CD1 3.59Å; L294-I298 HydrophobicContact CG-CD1 4.32Å; L294-I298 VanDerWaalsContact O-CG1 3.28Å; L294-I298 WeakPolarHBondContact O-CG1 3.35Å; L294-I298 PolarHBondContact O-N 3.36Å; A295-I298 PolarHBondContact O-N 3.47Å; I298-F302 HydrophobicContact CG2-CD2 4.44Å; I298-T305 HydrophobicContact CG1-CG2 3.96Å; I298-T305 PolarHBondContact N-OG1 3.43Å
299	W	84.6	Confident	84.6	Confident	204 Å²	204	53 Å²	53	77%	0.773	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-42.6	176.4	-170	-0	0	0	0	111.7	A295 F296 M297	A295-W299 PolarHBondContact O-N 3.08Å; A295-W299 VanDerWaalsContact O-N 3.08Å; F296-W299 HydrophobicContact CD1-CE3 4.25Å; F296-W299 HydrophobicContact CE1-CE3 4.26Å; F296-W299 HydrophobicContact CE1-CZ3 4.29Å; F296-W299 PolarHBondContact O-N 3.39Å; M297-W299 VanDerWaalsContact C-N 3.31Å; M297-W299 PolarHBondContact O-N 3.09Å
300	G	78.6	Confident	84.3	Confident	42 Å²	42	56.8 Å²	56.8	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-55.6	-179.9	0	0	0	0	0	113.7	F296 M297	F296-G300 PolarHBondContact O-N 2.98Å; M297-G300 PolarHBondContact O-N 3.45Å
301	S	81.4	Confident	83.9	Confident	18 Å²	18	57.2 Å²	57.2	13%	0.126	30%	0.299	C	S	.	.			trans	-161.6	108.7	176.3	176.7	0	0	0	0	111.3	M297 Y303 L304 T305	M297-S301 PolarHBondContact O-N 2.98Å; S301-Y303 VanDerWaalsContact C-N 3.27Å; S301-Y303 PolarHBondContact O-N 3.35Å; S301-L304 PolarHBondContact O-N 2.68Å; S301-T305 PolarHBondContact O-N 3.47Å; S301-T305 PolarHBondContact O-OG1 3.08Å
302	F	81.6	Confident	83.5	Confident	99 Å²	99	52.9 Å²	52.9	43%	0.434	28%	0.276	S	S	.	.	H	α-helix	trans	-56.3	-39.3	177.2	-177.7	-101.4	0	0	0	113.1	L119 I298 T305 V306	L119-F302 HydrophobicContact CD2-CE1 3.85Å; L119-F302 HydrophobicContact CD2-CZ 4.31Å; I298-F302 HydrophobicContact CG2-CD2 4.44Å; F302-T305 PolarHBondContact O-N 3.21Å; F302-V306 HydrophobicContact CD1-CG2 4.31Å; F302-V306 HydrophobicContact CE1-CG2 3.88Å; F302-V306 HydrophobicContact CE2-CG2 4.28Å; F302-V306 HydrophobicContact CZ-CG2 3.87Å; F302-V306 WeakPolarHBondContact O-CG2 3.27Å; F302-V306 PolarHBondContact O-N 3.18Å
303	Y	80.8	Confident	83.1	Confident	131 Å²	131	56 Å²	56	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-47.9	-179.5	-178.8	-99.5	0	0	0	111.6	S301 T305 V306 V307 L410	S301-Y303 VanDerWaalsContact C-N 3.27Å; S301-Y303 PolarHBondContact O-N 3.35Å; Y303-T305 VanDerWaalsContact C-N 3.32Å; Y303-T305 PolarHBondContact O-N 3.49Å; Y303-V306 PolarHBondContact O-N 3.21Å; Y303-V307 HydrophobicContact CE1-CG2 4.19Å; Y303-V307 WeakPolarHBondContact O-CG2 3.48Å; Y303-V307 PolarHBondContact O-N 2.89Å; Y303-V307 VanDerWaalsContact O-N 3.16Å; Y303-L410 HydrophobicContact CD1-CD1 4.03Å; Y303-L410 HydrophobicContact CD1-CD2 3.96Å; Y303-L410 HydrophobicContact CE1-CD1 3.98Å
304	L	79.9	Confident	82.5	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-67.6	-34.8	178.4	-64.8	173.5	0	0	0	111.1	S301 V306 V307 T308 L410 L421 F424	S301-L304 PolarHBondContact O-N 2.68Å; L304-V306 PolarHBondContact O-N 2.9Å; L304-V307 PolarHBondContact O-N 2.66Å; L304-T308 VanDerWaalsContact O-CG2 3.31Å; L304-T308 WeakPolarHBondContact O-CG2 3.44Å; L304-T308 PolarHBondContact O-N 2.68Å; L304-T308 PolarHBondContact O-OG1 3.12Å; L304-L410 HydrophobicContact CD1-CD2 4.44Å; L304-L410 HydrophobicContact CD2-CD2 4.32Å; L304-L410 HydrophobicContact CG-CD2 4.13Å; L304-L421 HydrophobicContact CD1-CD1 4.29Å; L304-F424 HydrophobicContact CB-CD1 4Å; L304-F424 HydrophobicContact CB-CD2 4Å; L304-F424 HydrophobicContact CB-CE1 3.5Å; L304-F424 VanDerWaalsContact CB-CE1 3.5Å; L304-F424 HydrophobicContact CB-CE2 3.48Å; L304-F424 VanDerWaalsContact CB-CE2 3.48Å; L304-F424 HydrophobicContact CB-CG 4.25Å; L304-F424 HydrophobicContact CB-CZ 3.22Å; L304-F424 HydrophobicContact CD1-CD1 3.94Å; L304-F424 HydrophobicContact CD1-CD2 4.29Å; L304-F424 HydrophobicContact CD1-CE1 4.28Å; L304-F424 HydrophobicContact CD1-CG 3.97Å; L304-F424 HydrophobicContact CG-CE1 4.41Å; L304-F424 HydrophobicContact CG-CZ 4.49Å; L304-F424 WeakPolarHBondContact O-CZ 3.21Å
305	T	84.9	Confident	82.1	Confident	13 Å²	13	59.8 Å²	59.8	8%	0.08	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-45.2	174.4	-44.6	0	0	0	0	112	M297 I298 S301 F302 Y303 V307 T308 L309	M297-T305 HydrophobicContact CB-CG2 4.1Å; M297-T305 PolarHBondContact O-OG1 3.3Å; I298-T305 HydrophobicContact CG1-CG2 3.96Å; I298-T305 PolarHBondContact N-OG1 3.43Å; S301-T305 PolarHBondContact O-N 3.47Å; S301-T305 PolarHBondContact O-OG1 3.08Å; F302-T305 PolarHBondContact O-N 3.21Å; Y303-T305 VanDerWaalsContact C-N 3.32Å; Y303-T305 PolarHBondContact O-N 3.49Å; T305-V307 VanDerWaalsContact C-N 3.33Å; T305-V307 PolarHBondContact O-N 3.34Å; T305-T308 WeakPolarHBondContact CA-OG1 3.42Å; T305-T308 PolarHBondContact O-N 3.02Å; T305-T308 PolarHBondContact O-OG1 3.16Å; T305-L309 PolarHBondContact O-N 3.49Å
306	V	83.9	Confident	81.6	Confident	64 Å²	64	58.9 Å²	58.9	39%	0.388	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-42.4	178.3	172.5	0	0	0	0	111	F302 Y303 L304 T308 L309 L310	F302-V306 HydrophobicContact CD1-CG2 4.31Å; F302-V306 HydrophobicContact CE1-CG2 3.88Å; F302-V306 HydrophobicContact CE2-CG2 4.28Å; F302-V306 HydrophobicContact CZ-CG2 3.87Å; F302-V306 WeakPolarHBondContact O-CG2 3.27Å; F302-V306 PolarHBondContact O-N 3.18Å; Y303-V306 PolarHBondContact O-N 3.21Å; L304-V306 PolarHBondContact O-N 2.9Å; V306-T308 VanDerWaalsContact C-N 3.32Å; V306-T308 PolarHBondContact O-N 3.32Å; V306-L309 PolarHBondContact O-N 2.98Å; V306-L310 WeakPolarHBondContact O-CB 3.37Å; V306-L310 PolarHBondContact O-N 3.36Å
307	V	82.3	Confident	81.2	Confident	32 Å²	32	62.1 Å²	62.1	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-58.5	-45.5	174.6	172	0	0	0	0	110.8	Y303 L304 T305 L310 S311 L406	Y303-V307 HydrophobicContact CE1-CG2 4.19Å; Y303-V307 WeakPolarHBondContact O-CG2 3.48Å; Y303-V307 PolarHBondContact O-N 2.89Å; Y303-V307 VanDerWaalsContact O-N 3.16Å; L304-V307 PolarHBondContact O-N 2.66Å; T305-V307 VanDerWaalsContact C-N 3.33Å; T305-V307 PolarHBondContact O-N 3.34Å; V307-L310 PolarHBondContact O-N 3.33Å; V307-S311 WeakPolarHBondContact O-CB 3.45Å; V307-S311 PolarHBondContact O-N 3.41Å; V307-S311 VanDerWaalsContact O-N 3.08Å; V307-L406 HydrophobicContact CG1-CD1 3.72Å
308	T	82.2	Confident	80.9	Confident	4 Å²	4	67 Å²	67	3%	0.025	35%	0.345	C	S	.	.	H	α-helix	trans	-62.4	-45.7	177.5	58.4	0	0	0	0	111.9	M297 L304 T305 V306 L310 S311 L312 I403 F424 Q428	M297-T308 HydrophobicContact CE-CG2 3.93Å; M297-T308 VanDerWaalsContact CE-OG1 3.32Å; M297-T308 WeakPolarHBondContact CE-OG1 3.33Å; L304-T308 VanDerWaalsContact O-CG2 3.31Å; L304-T308 WeakPolarHBondContact O-CG2 3.44Å; L304-T308 PolarHBondContact O-N 2.68Å; L304-T308 PolarHBondContact O-OG1 3.12Å; T305-T308 WeakPolarHBondContact CA-OG1 3.42Å; T305-T308 PolarHBondContact O-N 3.02Å; T305-T308 PolarHBondContact O-OG1 3.16Å; V306-T308 VanDerWaalsContact C-N 3.32Å; V306-T308 PolarHBondContact O-N 3.32Å; T308-L310 VanDerWaalsContact C-N 3.31Å; T308-L310 PolarHBondContact O-N 3.42Å; T308-S311 PolarHBondContact O-N 3.03Å; T308-S311 VanDerWaalsContact O-N 3.09Å; T308-S311 PolarHBondContact O-OG 3.32Å; T308-L312 WeakPolarHBondContact O-CG 3.41Å; T308-L312 PolarHBondContact O-N 2.98Å; T308-I403 HydrophobicContact CG2-CD1 3.64Å; T308-F424 HydrophobicContact CG2-CE1 3.75Å; T308-F424 HydrophobicContact CG2-CZ 3.66Å; T308-Q428 HydrophobicContact CG2-CB 4.47Å; T308-Q428 HydrophobicContact CG2-CG 3.63Å
309	L	82.7	Confident	80.6	Confident	93 Å²	93	64.8 Å²	64.8	49%	0.487	34%	0.335	S	S	.	.	H	α-helix	trans	-63.2	-38.6	-180	-165.1	73.1	0	0	0	111.8	T305 V306 S311 L312 P313	T305-L309 PolarHBondContact O-N 3.49Å; V306-L309 PolarHBondContact O-N 2.98Å; L309-S311 VanDerWaalsContact C-N 3.27Å; L309-S311 PolarHBondContact O-N 3.03Å; L309-L312 HydrophobicContact CD1-CD1 3.89Å; L309-L312 PolarHBondContact O-N 2.71Å; L309-P313 VanDerWaalsContact O-CD 3.28Å; L309-P313 WeakPolarHBondContact O-CD 3.45Å
310	L	83.3	Confident	80.3	Confident	131 Å²	131	62.7 Å²	62.7	69%	0.686	33%	0.327	S	S	*	.	H	α-helix	trans	-68.4	-27.3	176.8	-169.2	66.5	0	0	0	112.5	V306 V307 T308 P313	V306-L310 WeakPolarHBondContact O-CB 3.37Å; V306-L310 PolarHBondContact O-N 3.36Å; V307-L310 PolarHBondContact O-N 3.33Å; T308-L310 VanDerWaalsContact C-N 3.31Å; T308-L310 PolarHBondContact O-N 3.42Å; L310-P313 WeakPolarHBondContact O-CD 3.44Å
311	S	79.8	Confident	80.4	Confident	20 Å²	20	69.6 Å²	69.6	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-82.1	-21.6	178.5	74.8	0	0	0	0	114.4	V307 T308 L309 L314 L315 L399	V307-S311 WeakPolarHBondContact O-CB 3.45Å; V307-S311 PolarHBondContact O-N 3.41Å; V307-S311 VanDerWaalsContact O-N 3.08Å; T308-S311 PolarHBondContact O-N 3.03Å; T308-S311 VanDerWaalsContact O-N 3.09Å; T308-S311 PolarHBondContact O-OG 3.32Å; L309-S311 VanDerWaalsContact C-N 3.27Å; L309-S311 PolarHBondContact O-N 3.03Å; S311-L314 WeakPolarHBondContact O-CB 3.44Å; S311-L314 PolarHBondContact O-N 3.03Å; S311-L315 PolarHBondContact O-N 3.46Å; S311-L399 VanDerWaalsContact CB-CD1 3.44Å; S311-L399 WeakPolarHBondContact OG-CD1 3.14Å
312	L	80.5	Confident	80.5	Confident	19 Å²	19	71.3 Å²	71.3	10%	0.099	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-45.8	-179.1	-62.4	169	0	0	0	113.2	T308 L309 L314 L315 F316 F431	T308-L312 WeakPolarHBondContact O-CG 3.41Å; T308-L312 PolarHBondContact O-N 2.98Å; L309-L312 HydrophobicContact CD1-CD1 3.89Å; L309-L312 PolarHBondContact O-N 2.71Å; L312-L314 PolarHBondContact O-N 3.13Å; L312-L315 PolarHBondContact O-N 2.91Å; L312-L315 VanDerWaalsContact O-N 3.13Å; L312-F316 HydrophobicContact CB-CD2 4.33Å; L312-F316 HydrophobicContact CB-CE2 4.23Å; L312-F316 HydrophobicContact CD2-CE2 4.07Å; L312-F316 WeakPolarHBondContact O-CD2 3.35Å; L312-F316 PolarHBondContact O-N 3.41Å; L312-F431 HydrophobicContact CD1-CE1 3.78Å; L312-F431 HydrophobicContact CD1-CZ 4.44Å; L312-F431 HydrophobicContact CD2-CE1 4.45Å
313	P	78.4	Confident	80.4	Confident	85 Å²	85	66.9 Å²	66.9	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-57.3	-39.4	176.6	-24.6	34.4	0	0	0	112.2	L309 L310 F316 L317	L309-P313 VanDerWaalsContact O-CD 3.28Å; L309-P313 WeakPolarHBondContact O-CD 3.45Å; L310-P313 WeakPolarHBondContact O-CD 3.44Å; P313-F316 PolarHBondContact O-N 3.37Å; P313-L317 WeakPolarHBondContact O-CB 3.42Å; P313-L317 PolarHBondContact O-N 2.96Å
314	L	76.9	Confident	80.5	Confident	131 Å²	131	67.1 Å²	67.1	69%	0.686	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-42.8	177.4	-177	64.9	0	0	0	111.3	S311 L312 F316	S311-L314 WeakPolarHBondContact O-CB 3.44Å; S311-L314 PolarHBondContact O-N 3.03Å; L312-L314 PolarHBondContact O-N 3.13Å; L314-F316 VanDerWaalsContact C-N 3.34Å; L314-F316 PolarHBondContact O-N 3.16Å
315	L	79.2	Confident	80.8	Confident	9 Å²	9	70.7 Å²	70.7	5%	0.047	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-39.2	179.1	-170.1	148.3	0	0	0	112.1	S311 L312 P319 M392 L399 T432	S311-L315 PolarHBondContact O-N 3.46Å; L312-L315 PolarHBondContact O-N 2.91Å; L312-L315 VanDerWaalsContact O-N 3.13Å; L315-P319 WeakPolarHBondContact O-CD 3.26Å; L315-P319 VanDerWaalsContact O-CG 3.25Å; L315-P319 WeakPolarHBondContact O-CG 3.47Å; L315-M392 HydrophobicContact CD2-CE 3.96Å; L315-M392 HydrophobicContact CD2-SD 4.3Å; L315-L399 HydrophobicContact CD1-CB 4.41Å; L315-L399 HydrophobicContact CD1-CD2 3.45Å; L315-L399 VanDerWaalsContact CD1-CD2 3.45Å; L315-T432 HydrophobicContact CD1-CG2 3.89Å; L315-T432 HydrophobicContact CD2-CG2 4.45Å
316	F	75.8	Confident	80.9	Confident	38 Å²	38	73 Å²	73	17%	0.167	36%	0.363	C	S	.	.	H	α-helix	trans	-93.7	-24.6	-175.9	-65	-64.2	0	0	0	115	L312 P313 L314 L318 R320 M392 V435 E436 L439	L312-F316 HydrophobicContact CB-CD2 4.33Å; L312-F316 HydrophobicContact CB-CE2 4.23Å; L312-F316 HydrophobicContact CD2-CE2 4.07Å; L312-F316 WeakPolarHBondContact O-CD2 3.35Å; L312-F316 PolarHBondContact O-N 3.41Å; P313-F316 PolarHBondContact O-N 3.37Å; L314-F316 VanDerWaalsContact C-N 3.34Å; L314-F316 PolarHBondContact O-N 3.16Å; F316-L318 PolarHBondContact O-N 2.96Å; F316-R320 WeakPolarHBondContact O-CB 3.46Å; F316-R320 PolarHBondContact O-N 2.92Å; F316-R320 VanDerWaalsContact O-N 3.12Å; F316-M392 HydrophobicContact CE1-CE 4.19Å; F316-V435 HydrophobicContact CE2-CB 4.43Å; F316-V435 HydrophobicContact CE2-CG1 3.54Å; F316-V435 HydrophobicContact CZ-CB 4.25Å; F316-V435 HydrophobicContact CZ-CG1 3.67Å; F316-E436 HydrophobicContact CE1-CB 4.22Å; F316-E436 HydrophobicContact CZ-CB 4.45Å; F316-L439 HydrophobicContact CB-CD1 4.46Å; F316-L439 HydrophobicContact CD1-CD1 3.58Å; F316-L439 HydrophobicContact CD2-CD1 3.69Å; F316-L439 HydrophobicContact CE1-CD1 3.59Å; F316-L439 HydrophobicContact CE2-CD1 3.71Å; F316-L439 HydrophobicContact CG-CD1 3.64Å; F316-L439 HydrophobicContact CZ-CD1 3.66Å
317	L	79.2	Confident	80.8	Confident	110 Å²	110	75.5 Å²	75.5	58%	0.576	37%	0.37	S	S	*	.	H	α-helix	trans	-66.4	-41.4	-174.6	-168.9	77.5	0	0	0	112.3	P313 R321	P313-L317 WeakPolarHBondContact O-CB 3.42Å; P313-L317 PolarHBondContact O-N 2.96Å; L317-R321 PolarHBondContact O-N 3.16Å
318	L	78.4	Confident	81.1	Confident	104 Å²	104	76.8 Å²	76.8	55%	0.545	38%	0.381	S	S	.	.	H	α-helix	trans	-71.4	-51.7	-176.3	-172.5	73.9	0	0	0	111.7	F316 R320 R321 L322 T391	F316-L318 PolarHBondContact O-N 2.96Å; L318-R320 VanDerWaalsContact C-N 3.29Å; L318-R320 PolarHBondContact O-N 3.36Å; L318-R321 PolarHBondContact O-N 3.26Å; L318-L322 PolarHBondContact O-N 3.11Å; L318-T391 HydrophobicContact CD2-CG2 3.54Å; L318-T391 HydrophobicContact CG-CG2 3.79Å
319	P	78.1	Confident	81.4	Confident	12 Å²	12	78.1 Å²	78.1	8%	0.078	39%	0.387	C	S	.	.	H	α-helix	trans	-58.8	-38	173.6	-24.3	35.4	0	0	0	112.7	L315 R321 L322 G323 M392	L315-P319 WeakPolarHBondContact O-CD 3.26Å; L315-P319 VanDerWaalsContact O-CG 3.25Å; L315-P319 WeakPolarHBondContact O-CG 3.47Å; P319-R321 VanDerWaalsContact C-N 3.28Å; P319-R321 PolarHBondContact O-N 3.3Å; P319-L322 PolarHBondContact O-N 3.25Å; P319-L322 VanDerWaalsContact O-N 3.16Å; P319-G323 PolarHBondContact O-N 3.29Å; P319-M392 HydrophobicContact CB-SD 4.11Å; P319-M392 HydrophobicContact CG-CB 4.5Å; P319-M392 HydrophobicContact CG-SD 3.67Å
320	R	79.1	Confident	81.7	Confident	159 Å²	159	74.8 Å²	74.8	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-59.6	-35	179.6	-178.7	177.5	179.1	134.4	5.3	113.5	F316 L318 K324	F316-R320 WeakPolarHBondContact O-CB 3.46Å; F316-R320 PolarHBondContact O-N 2.92Å; F316-R320 VanDerWaalsContact O-N 3.12Å; L318-R320 VanDerWaalsContact C-N 3.29Å; L318-R320 PolarHBondContact O-N 3.36Å; R320-K324 PolarHBondContact O-N 3.08Å
321	R	80.9	Confident	81.9	Confident	187 Å²	187	73 Å²	73	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-71.6	-40.4	177.7	-73.1	-157.4	-178.8	-172.1	3.1	111.7	L317 L318 P319	L317-R321 PolarHBondContact O-N 3.16Å; L318-R321 PolarHBondContact O-N 3.26Å; P319-R321 VanDerWaalsContact C-N 3.28Å; P319-R321 PolarHBondContact O-N 3.3Å
322	L	82.1	Confident	82.4	Confident	55 Å²	55	77.7 Å²	77.7	29%	0.288	39%	0.386	S	S	.	.	H	α-helix	trans	-69.7	-41.5	177.7	-65	171.8	0	0	0	111.7	L318 P319 K324 V325 Y326 T387 T391	L318-L322 PolarHBondContact O-N 3.11Å; P319-L322 PolarHBondContact O-N 3.25Å; P319-L322 VanDerWaalsContact O-N 3.16Å; L322-K324 PolarHBondContact O-N 3Å; L322-V325 WeakPolarHBondContact O-CA 3.39Å; L322-V325 WeakPolarHBondContact O-CB 3.41Å; L322-V325 PolarHBondContact O-N 3.07Å; L322-Y326 PolarHBondContact O-N 3.49Å; L322-Y326 VanDerWaalsContact O-N 3.07Å; L322-T387 HydrophobicContact CD1-CG2 4.34Å; L322-T387 HydrophobicContact CD2-CG2 4.49Å; L322-T391 HydrophobicContact CD1-CG2 3.67Å; L322-T391 WeakPolarHBondContact CD1-OG1 3.46Å
323	G	80.8	Confident	82.9	Confident	6 Å²	6	77.5 Å²	77.5	6%	0.062	39%	0.385	C	S	.	.	H	α-helix	trans	-60.1	-30.6	177.5	0	0	0	0	0	113.5	P319 V325 Y326 Q327	P319-G323 PolarHBondContact O-N 3.29Å; G323-V325 VanDerWaalsContact C-N 3.33Å; G323-V325 PolarHBondContact O-N 2.88Å; G323-Y326 PolarHBondContact O-N 3.49Å; G323-Q327 WeakPolarHBondContact O-CB 3.42Å; G323-Q327 VanDerWaalsContact O-CG 3.29Å; G323-Q327 WeakPolarHBondContact O-CG 3.44Å; G323-Q327 PolarHBondContact O-N 2.89Å
324	K	82.8	Confident	83.4	Confident	135 Å²	135	79.7 Å²	79.7	59%	0.587	39%	0.388	S	S	*	.	H	α-helix	trans	-63.6	-39.1	171.8	-76.5	-174.5	176.4	-169.4	0	112.7	R320 L322 S328	R320-K324 PolarHBondContact O-N 3.08Å; L322-K324 PolarHBondContact O-N 3Å; K324-S328 WeakPolarHBondContact O-CB 3.17Å; K324-S328 PolarHBondContact O-N 3.15Å
325	V	86	Confident	84.1	Confident	77 Å²	77	78.5 Å²	78.5	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-49.2	177.5	179.9	0	0	0	0	108.7	L322 G323 Q327 S328 L329	L322-V325 WeakPolarHBondContact O-CA 3.39Å; L322-V325 WeakPolarHBondContact O-CB 3.41Å; L322-V325 PolarHBondContact O-N 3.07Å; G323-V325 VanDerWaalsContact C-N 3.33Å; G323-V325 PolarHBondContact O-N 2.88Å; V325-Q327 PolarHBondContact O-N 2.98Å; V325-S328 PolarHBondContact O-N 3.48Å; V325-S328 PolarHBondContact O-OG 3.29Å; V325-L329 HydrophobicContact CG1-CD1 3.87Å; V325-L329 WeakPolarHBondContact O-CD1 3.31Å; V325-L329 PolarHBondContact O-N 2.93Å; V325-L329 VanDerWaalsContact O-N 3.1Å
326	Y	86.2	Confident	84.6	Confident	63 Å²	63	78.9 Å²	78.9	25%	0.247	38%	0.383	C	S	.	.	H	α-helix	trans	-53.6	-52.6	174.9	170	-114.5	0	0	0	112.2	L322 G323 S328 L329 A330 E381 A384 Y385 E388	L322-Y326 PolarHBondContact O-N 3.49Å; L322-Y326 VanDerWaalsContact O-N 3.07Å; G323-Y326 PolarHBondContact O-N 3.49Å; Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 2.84Å; Y326-L329 PolarHBondContact O-N 2.86Å; Y326-A330 PolarHBondContact O-N 2.9Å; Y326-E381 HydrophobicContact CD2-CG 4.03Å; Y326-E381 HydrophobicContact CE2-CG 3.65Å; Y326-A384 HydrophobicContact CD2-CB 4.43Å; Y326-Y385 HydrophobicContact CE2-CD2 4.31Å; Y326-E388 WeakPolarHBondContact CB-OE2 3.46Å; Y326-E388 WeakPolarHBondContact CD1-OE2 3.27Å
327	Q	82.9	Confident	85.4	Confident	115 Å²	115	81 Å²	81	54%	0.537	40%	0.395	S	S	.	.	H	α-helix	trans	-56.2	-42.2	177.6	-76	177.3	-3.9	0	0	112.8	G323 V325 L329 A330 V331	G323-Q327 WeakPolarHBondContact O-CB 3.42Å; G323-Q327 VanDerWaalsContact O-CG 3.29Å; G323-Q327 WeakPolarHBondContact O-CG 3.44Å; G323-Q327 PolarHBondContact O-N 2.89Å; V325-Q327 PolarHBondContact O-N 2.98Å; Q327-L329 VanDerWaalsContact C-N 3.29Å; Q327-L329 PolarHBondContact O-N 2.82Å; Q327-A330 PolarHBondContact O-N 3.01Å; Q327-V331 WeakPolarHBondContact O-CG2 3.5Å; Q327-V331 PolarHBondContact O-N 3.48Å; Q327-V331 VanDerWaalsContact O-N 3.1Å
328	S	88.3	Confident	85.8	Confident	59 Å²	59	78.5 Å²	78.5	41%	0.413	39%	0.39	S	S	.	.	H	α-helix	trans	-66.6	-30.7	178.9	75.8	0	0	0	0	113.3	K324 V325 Y326 K332	K324-S328 WeakPolarHBondContact O-CB 3.17Å; K324-S328 PolarHBondContact O-N 3.15Å; V325-S328 PolarHBondContact O-N 3.48Å; V325-S328 PolarHBondContact O-OG 3.29Å; Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 2.84Å; S328-K332 WeakPolarHBondContact O-CG 3.12Å
329	L	89	Confident	86.4	Confident	32 Å²	32	78.3 Å²	78.3	17%	0.168	39%	0.385	C	S	.	.	H	α-helix	trans	-76.6	-42.7	174.8	-88.3	79.4	0	0	0	111.2	V325 Y326 Q327 V331 K332 V333 K380 E381	V325-L329 HydrophobicContact CG1-CD1 3.87Å; V325-L329 WeakPolarHBondContact O-CD1 3.31Å; V325-L329 PolarHBondContact O-N 2.93Å; V325-L329 VanDerWaalsContact O-N 3.1Å; Y326-L329 PolarHBondContact O-N 2.86Å; Q327-L329 VanDerWaalsContact C-N 3.29Å; Q327-L329 PolarHBondContact O-N 2.82Å; L329-V331 VanDerWaalsContact C-N 3.28Å; L329-V331 PolarHBondContact O-N 3.32Å; L329-K332 WeakPolarHBondContact O-CB 3.47Å; L329-K332 PolarHBondContact O-N 3.14Å; L329-V333 PolarHBondContact O-N 2.91Å; L329-K380 VanDerWaalsContact CD2-C 3.41Å; L329-K380 HydrophobicContact CD2-CB 3.42Å; L329-K380 VanDerWaalsContact CD2-CB 3.42Å; L329-E381 HydrophobicContact CB-CB 4.31Å
330	A	87.6	Confident	87.1	Confident	24 Å²	24	77.9 Å²	77.9	20%	0.198	38%	0.382	C	S	.	.	H	α-helix	trans	-57	-41.6	177.3	0	0	0	0	0	111.7	Y326 Q327 K332 V333 Q334	Y326-A330 PolarHBondContact O-N 2.9Å; Q327-A330 PolarHBondContact O-N 3.01Å; A330-K332 PolarHBondContact O-N 2.87Å; A330-V333 PolarHBondContact O-N 2.86Å; A330-Q334 WeakPolarHBondContact O-CB 3.39Å; A330-Q334 PolarHBondContact O-N 3.23Å
331	V	88.3	Confident	87.7	Confident	93 Å²	93	73.5 Å²	73.5	56%	0.564	37%	0.373	S	S	*	.	H	α-helix	trans	-60.7	-42.7	174.7	172	0	0	0	0	111.8	Q327 L329 Q334 E335	Q327-V331 WeakPolarHBondContact O-CG2 3.5Å; Q327-V331 PolarHBondContact O-N 3.48Å; Q327-V331 VanDerWaalsContact O-N 3.1Å; L329-V331 VanDerWaalsContact C-N 3.28Å; L329-V331 PolarHBondContact O-N 3.32Å; V331-Q334 PolarHBondContact O-N 3.41Å; V331-E335 PolarHBondContact O-N 3.25Å
332	K	90.4	Very high	88.2	Confident	119 Å²	119	70.9 Å²	70.9	52%	0.517	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-37	178.7	-67.1	175	-179.6	179.5	0	112.2	S328 L329 A330 E335 S336 L377	S328-K332 WeakPolarHBondContact O-CG 3.12Å; L329-K332 WeakPolarHBondContact O-CB 3.47Å; L329-K332 PolarHBondContact O-N 3.14Å; A330-K332 PolarHBondContact O-N 2.87Å; K332-E335 PolarHBondContact O-N 3.13Å; K332-S336 PolarHBondContact O-N 3.29Å; K332-L377 HydrophobicContact CB-CD2 3.59Å
333	V	91.6	Very high	88.7	Confident	15 Å²	15	69 Å²	69	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-43.7	174.1	171	0	0	0	0	110.3	L329 A330 E335 S336 L337 M374 L377 E381	L329-V333 PolarHBondContact O-N 2.91Å; A330-V333 PolarHBondContact O-N 2.86Å; V333-E335 PolarHBondContact O-N 3.18Å; V333-S336 PolarHBondContact O-N 3.34Å; V333-L337 WeakPolarHBondContact O-CB 3.35Å; V333-L337 PolarHBondContact O-N 3.26Å; V333-M374 HydrophobicContact CG1-CG 4.49Å; V333-M374 HydrophobicContact CG1-SD 4.45Å; V333-L377 HydrophobicContact CG2-CB 3.69Å; V333-E381 VanDerWaalsContact CB-OE2 3.29Å; V333-E381 WeakPolarHBondContact CB-OE2 3.07Å; V333-E381 WeakPolarHBondContact CG1-OE2 3.32Å; V333-E381 HydrophobicContact CG2-CB 4.28Å; V333-E381 WeakPolarHBondContact CG2-OE2 3.26Å
334	Q	87.9	Confident	89.3	Confident	131 Å²	131	70 Å²	70	61%	0.612	37%	0.368	S	S	*	.	H	α-helix	trans	-62.4	-39.5	176.3	-170.2	172.8	-1.3	0	0	112.5	A330 V331 L337 A338	A330-Q334 WeakPolarHBondContact O-CB 3.39Å; A330-Q334 PolarHBondContact O-N 3.23Å; V331-Q334 PolarHBondContact O-N 3.41Å; Q334-L337 PolarHBondContact O-N 3.2Å; Q334-A338 PolarHBondContact O-N 3.46Å
335	E	90.6	Very high	89.7	Confident	106 Å²	106	69 Å²	69	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-42.1	174.7	-166.1	-165	146.1	0	0	112	V331 K332 V333 L337 A338 K339	V331-E335 PolarHBondContact O-N 3.25Å; K332-E335 PolarHBondContact O-N 3.13Å; V333-E335 PolarHBondContact O-N 3.18Å; E335-L337 VanDerWaalsContact C-N 3.33Å; E335-A338 PolarHBondContact O-N 3.33Å; E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 3.4Å; E335-K339 VanDerWaalsContact O-N 3.14Å; E335-K339 WeakPolarHBondContact OE1-CE 3.3Å; E335-K339 IonicContact OE1-NZ 3.65Å; E335-K339 PolarHBondContact OE1-NZ 3.37Å
336	S	91.2	Very high	90	Very high	17 Å²	17	70.8 Å²	70.8	12%	0.119	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-38.9	175.3	-167.8	0	0	0	0	111.9	K332 V333 K339 S340	K332-S336 PolarHBondContact O-N 3.29Å; V333-S336 PolarHBondContact O-N 3.34Å; S336-K339 PolarHBondContact O-N 3.12Å; S336-S340 PolarHBondContact O-N 3.33Å; S336-S340 VanDerWaalsContact O-N 3.14Å
337	L	91.9	Very high	90.4	Very high	83 Å²	83	68.6 Å²	68.6	44%	0.435	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-47.1	175	-178.7	65.1	0	0	0	110.5	V333 Q334 E335 K339 S340 T341 M374	V333-L337 WeakPolarHBondContact O-CB 3.35Å; V333-L337 PolarHBondContact O-N 3.26Å; Q334-L337 PolarHBondContact O-N 3.2Å; E335-L337 VanDerWaalsContact C-N 3.33Å; L337-K339 VanDerWaalsContact C-N 3.29Å; L337-K339 PolarHBondContact O-N 3.28Å; L337-S340 PolarHBondContact O-N 2.88Å; L337-S340 PolarHBondContact O-OG 2.94Å; L337-T341 PolarHBondContact O-N 3.25Å; L337-T341 PolarHBondContact O-OG1 3.25Å; L337-T341 VanDerWaalsContact O-OG1 3.13Å; L337-M374 HydrophobicContact CB-SD 4.24Å; L337-M374 HydrophobicContact CD1-SD 4.36Å
338	A	88.5	Confident	90.9	Very high	57 Å²	57	69 Å²	69	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-56.9	-41.1	177.3	0	0	0	0	0	112.4	Q334 E335 S340 T341 Q342	Q334-A338 PolarHBondContact O-N 3.46Å; E335-A338 PolarHBondContact O-N 3.33Å; A338-S340 PolarHBondContact O-N 3.31Å; A338-T341 PolarHBondContact O-N 3.01Å; A338-Q342 WeakPolarHBondContact O-CB 3.25Å; A338-Q342 PolarHBondContact O-N 3.07Å
339	K	90.6	Very high	91.1	Very high	100 Å²	100	71 Å²	71	44%	0.435	39%	0.385	S	S	.	.	H	α-helix	trans	-62.1	-40.9	174.1	-70	171.6	-172.9	164.8	0	112.3	E335 S336 L337 Q342 V343	E335-K339 WeakPolarHBondContact O-CG 3.32Å; E335-K339 PolarHBondContact O-N 3.4Å; E335-K339 VanDerWaalsContact O-N 3.14Å; E335-K339 WeakPolarHBondContact OE1-CE 3.3Å; E335-K339 IonicContact OE1-NZ 3.65Å; E335-K339 PolarHBondContact OE1-NZ 3.37Å; S336-K339 PolarHBondContact O-N 3.12Å; L337-K339 VanDerWaalsContact C-N 3.29Å; L337-K339 PolarHBondContact O-N 3.28Å; K339-Q342 PolarHBondContact O-N 3.5Å; K339-V343 PolarHBondContact O-N 3.02Å
340	S	92.1	Very high	91.3	Very high	3 Å²	3	71.1 Å²	71.1	2%	0.021	39%	0.391	C	S	.	.	H	α-helix	trans	-67.7	-40.9	176.3	71.3	0	0	0	0	112.3	S336 L337 A338 Q342 V343 A344 F367	S336-S340 PolarHBondContact O-N 3.33Å; S336-S340 VanDerWaalsContact O-N 3.14Å; L337-S340 PolarHBondContact O-N 2.88Å; L337-S340 PolarHBondContact O-OG 2.94Å; A338-S340 PolarHBondContact O-N 3.31Å; S340-Q342 VanDerWaalsContact C-N 3.31Å; S340-Q342 PolarHBondContact O-N 3.24Å; S340-V343 PolarHBondContact O-N 3.32Å; S340-A344 PolarHBondContact O-N 3.49Å; S340-A344 VanDerWaalsContact O-N 3.11Å; S340-F367 WeakPolarHBondContact O-CE2 3.22Å
341	T	91.9	Very high	91.7	Very high	66 Å²	66	73.3 Å²	73.3	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-38.6	174.9	-56.1	0	0	0	0	111.4	L337 A338 V343 A344 L345	L337-T341 PolarHBondContact O-N 3.25Å; L337-T341 PolarHBondContact O-OG1 3.25Å; L337-T341 VanDerWaalsContact O-OG1 3.13Å; A338-T341 PolarHBondContact O-N 3.01Å; T341-V343 PolarHBondContact O-N 2.87Å; T341-A344 PolarHBondContact O-N 3.32Å; T341-L345 HydrophobicContact CG2-CD1 4.11Å; T341-L345 HydrophobicContact CG2-CG 4.36Å; T341-L345 WeakPolarHBondContact O-CB 3.48Å; T341-L345 WeakPolarHBondContact O-CG 3.32Å; T341-L345 PolarHBondContact O-N 3.49Å
342	Q	91.1	Very high	92.1	Very high	132 Å²	132	73.7 Å²	73.7	62%	0.617	40%	0.403	S	S	*	.	H	α-helix	trans	-60.9	-43.8	176.1	-175	178.7	-3	0	0	112.1	A338 K339 S340 A344 L345 E346	A338-Q342 WeakPolarHBondContact O-CB 3.25Å; A338-Q342 PolarHBondContact O-N 3.07Å; K339-Q342 PolarHBondContact O-N 3.5Å; S340-Q342 VanDerWaalsContact C-N 3.31Å; S340-Q342 PolarHBondContact O-N 3.24Å; Q342-A344 VanDerWaalsContact C-N 3.34Å; Q342-A344 PolarHBondContact O-N 2.73Å; Q342-L345 PolarHBondContact O-N 3.06Å; Q342-E346 WeakPolarHBondContact O-CB 3.37Å; Q342-E346 PolarHBondContact O-N 3.41Å
343	V	92.4	Very high	92.4	Very high	15 Å²	15	71.6 Å²	71.6	9%	0.091	40%	0.4	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.5	173.9	0	0	0	0	111	K339 S340 T341 E346 A347 K366 K370	K339-V343 PolarHBondContact O-N 3.02Å; S340-V343 PolarHBondContact O-N 3.32Å; T341-V343 PolarHBondContact O-N 2.87Å; V343-E346 PolarHBondContact O-N 3.11Å; V343-A347 PolarHBondContact O-N 3.14Å; V343-K366 HydrophobicContact CG1-CD 4.06Å; V343-K366 HydrophobicContact CG1-CG 4.12Å; V343-K370 HydrophobicContact CG2-CG 4.43Å
344	A	93.6	Very high	92.7	Very high	29 Å²	29	71.7 Å²	71.7	24%	0.24	40%	0.4	C	S	.	.	H	α-helix	trans	-63.5	-42.1	176.9	0	0	0	0	0	112.2	S340 T341 Q342 L348 F367	S340-A344 PolarHBondContact O-N 3.49Å; S340-A344 VanDerWaalsContact O-N 3.11Å; T341-A344 PolarHBondContact O-N 3.32Å; Q342-A344 VanDerWaalsContact C-N 3.34Å; Q342-A344 PolarHBondContact O-N 2.73Å; A344-L348 VanDerWaalsContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 2.89Å; A344-F367 HydrophobicContact CB-CD2 4.23Å; A344-F367 HydrophobicContact CB-CE2 3.97Å
345	L	91.6	Very high	93.1	Very high	114 Å²	114	72.9 Å²	72.9	60%	0.597	40%	0.399	S	S	*	.	H	α-helix	trans	-62.5	-45	176.7	-76	170.8	0	0	0	111.7	T341 Q342 S349	T341-L345 HydrophobicContact CG2-CD1 4.11Å; T341-L345 HydrophobicContact CG2-CG 4.36Å; T341-L345 WeakPolarHBondContact O-CB 3.48Å; T341-L345 WeakPolarHBondContact O-CG 3.32Å; T341-L345 PolarHBondContact O-N 3.49Å; Q342-L345 PolarHBondContact O-N 3.06Å; L345-S349 WeakPolarHBondContact O-CB 3.44Å; L345-S349 PolarHBondContact O-N 3.47Å; L345-S349 PolarHBondContact O-OG 3.25Å
346	E	92.5	Very high	93.5	Very high	114 Å²	114	72 Å²	72	53%	0.533	41%	0.405	S	S	.	.	H	α-helix	trans	-58.7	-52.2	177.3	-173.3	178.6	-164.5	0	0	110.9	Q342 V343 L348 S349 A350 K366	Q342-E346 WeakPolarHBondContact O-CB 3.37Å; Q342-E346 PolarHBondContact O-N 3.41Å; V343-E346 PolarHBondContact O-N 3.11Å; E346-L348 PolarHBondContact O-N 3.38Å; E346-S349 PolarHBondContact O-N 2.95Å; E346-S349 PolarHBondContact O-OG 3.21Å; E346-A350 PolarHBondContact O-N 2.92Å; E346-K366 IonicContact OE2-NZ 3.95Å
347	A	93.4	Very high	93.8	Very high	17 Å²	17	78.6 Å²	78.6	14%	0.14	43%	0.432	C	S	.	.	H	α-helix	trans	-63.2	-43.7	-179.6	0	0	0	0	0	113.1	V343 A350 M351 E363	V343-A347 PolarHBondContact O-N 3.14Å; A347-A350 CarbonylContact O-C 3.56Å; A347-M351 PolarHBondContact O-N 3.12Å; A347-E363 HydrophobicContact CB-CB 4.22Å; A347-E363 HydrophobicContact CB-CG 4.12Å
348	L	94.5	Very high	94	Very high	124 Å²	124	78.3 Å²	78.3	65%	0.649	44%	0.441	S	S	*	.	H	α-helix	trans	-73.7	-35.1	-178.8	-68.3	173.8	0	0	0	112.7	A344 E346 A350 M351	A344-L348 VanDerWaalsContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CB 3.28Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 2.89Å; E346-L348 PolarHBondContact O-N 3.38Å; L348-A350 VanDerWaalsContact C-N 3.28Å; L348-A350 PolarHBondContact O-N 3.43Å; L348-M351 WeakPolarHBondContact O-CB 3.49Å; L348-M351 PolarHBondContact O-N 2.9Å
349	S	92.3	Very high	94.4	Very high	99 Å²	99	79 Å²	79	69%	0.692	44%	0.437	S	S	*	.	H	α-helix	trans	-67.1	-31.9	176.7	67.1	0	0	0	0	112.3	L345 E346	L345-S349 WeakPolarHBondContact O-CB 3.44Å; L345-S349 PolarHBondContact O-N 3.47Å; L345-S349 PolarHBondContact O-OG 3.25Å; E346-S349 PolarHBondContact O-N 2.95Å; E346-S349 PolarHBondContact O-OG 3.21Å
350	A	94.3	Very high	94.7	Very high	36 Å²	36	77.3 Å²	77.3	30%	0.298	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	31.9	177.5	0	0	0	0	0	112.6	E346 A347 L348 P352 T353 V354	E346-A350 PolarHBondContact O-N 2.92Å; A347-A350 CarbonylContact O-C 3.56Å; L348-A350 VanDerWaalsContact C-N 3.28Å; L348-A350 PolarHBondContact O-N 3.43Å; A350-P352 VanDerWaalsContact C-CD 3.45Å; A350-P352 VanDerWaalsContact C-N 3.35Å; A350-T353 WeakPolarHBondContact O-CA 3.48Å; A350-T353 VanDerWaalsContact O-CB 3.26Å; A350-T353 WeakPolarHBondContact O-CB 3.5Å; A350-T353 PolarHBondContact O-N 2.95Å; A350-V354 PolarHBondContact O-N 2.66Å
351	M	94.8	Very high	94.9	Very high	70 Å²	70	83.2 Å²	83.2	35%	0.345	46%	0.458	S	S	.	.	H	α-helix	trans	-53.9	-40	-175.1	-166.1	66.2	-170.7	0	0	114.4	A347 L348 T353 V354 R355	A347-M351 PolarHBondContact O-N 3.12Å; L348-M351 WeakPolarHBondContact O-CB 3.49Å; L348-M351 PolarHBondContact O-N 2.9Å; M351-T353 VanDerWaalsContact C-N 3.27Å; M351-T353 PolarHBondContact O-N 2.98Å; M351-V354 PolarHBondContact O-N 2.6Å; M351-R355 HydrophobicContact CE-CG 4.02Å; M351-R355 HydrophobicContact CG-CG 4.49Å; M351-R355 WeakPolarHBondContact O-CB 3.36Å; M351-R355 WeakPolarHBondContact O-CG 3.47Å; M351-R355 PolarHBondContact O-N 2.98Å
352	P	96.7	Very high	95.1	Very high	101 Å²	101	81.6 Å²	81.6	66%	0.656	45%	0.454	S	S	*	.	H	α-helix	trans	-59.8	-36.8	174.5	-24.8	35.8	0	0	0	113	A350 S356	A350-P352 VanDerWaalsContact C-CD 3.45Å; A350-P352 VanDerWaalsContact C-N 3.35Å; P352-S356 VanDerWaalsContact O-CB 3.32Å; P352-S356 WeakPolarHBondContact O-CB 3.29Å; P352-S356 PolarHBondContact O-N 2.85Å; P352-S356 PolarHBondContact O-OG 3.49Å
353	T	97.1	Very high	95.3	Very high	74 Å²	74	77.3 Å²	77.3	45%	0.454	43%	0.434	S	S	.	.	H	α-helix	trans	-68.6	-46.9	176.1	-50.5	0	0	0	0	110.9	A350 M351 R355 S356 F357	A350-T353 WeakPolarHBondContact O-CA 3.48Å; A350-T353 VanDerWaalsContact O-CB 3.26Å; A350-T353 WeakPolarHBondContact O-CB 3.5Å; A350-T353 PolarHBondContact O-N 2.95Å; M351-T353 VanDerWaalsContact C-N 3.27Å; M351-T353 PolarHBondContact O-N 2.98Å; T353-R355 VanDerWaalsContact C-N 3.27Å; T353-R355 PolarHBondContact O-N 3.46Å; T353-S356 WeakPolarHBondContact CA-OG 3.31Å; T353-S356 PolarHBondContact O-N 3Å; T353-S356 PolarHBondContact O-OG 3.27Å; T353-F357 HydrophobicContact CG2-CD2 3.73Å; T353-F357 HydrophobicContact CG2-CE2 3.75Å; T353-F357 VanDerWaalsContact O-CD2 3.23Å; T353-F357 WeakPolarHBondContact O-CD2 3.29Å; T353-F357 PolarHBondContact O-N 2.85Å
354	V	97.6	Very high	95.5	Very high	17 Å²	17	78.7 Å²	78.7	10%	0.103	45%	0.447	C	S	.	.	H	α-helix	trans	-58.1	-43.2	176.9	-179.9	0	0	0	0	110.7	A350 M351 A358 N359 E360 E363	A350-V354 PolarHBondContact O-N 2.66Å; M351-V354 PolarHBondContact O-N 2.6Å; V354-A358 PolarHBondContact O-N 2.66Å; V354-A358 VanDerWaalsContact O-N 3.12Å; V354-N359 PolarHBondContact O-N 2.76Å; V354-E360 HydrophobicContact CG1-CG 4.21Å; V354-E363 HydrophobicContact CG1-CG 4.33Å; V354-E363 HydrophobicContact CG2-CG 4.4Å
355	R	96.9	Very high	95.6	Very high	156 Å²	156	81.9 Å²	81.9	59%	0.589	46%	0.457	S	S	*	.	H	α-helix	trans	-66.6	-42.9	175.3	-73.2	-58.2	-163.6	169.1	-0.5	112.9	M351 T353 F357 A358 E360	M351-R355 HydrophobicContact CE-CG 4.02Å; M351-R355 HydrophobicContact CG-CG 4.49Å; M351-R355 WeakPolarHBondContact O-CB 3.36Å; M351-R355 WeakPolarHBondContact O-CG 3.47Å; M351-R355 PolarHBondContact O-N 2.98Å; T353-R355 VanDerWaalsContact C-N 3.27Å; T353-R355 PolarHBondContact O-N 3.46Å; R355-F357 PolarHBondContact O-N 3.46Å; R355-A358 PolarHBondContact O-N 3.46Å; R355-A358 VanDerWaalsContact O-N 3.14Å; R355-E360 WeakPolarHBondContact CD-OE1 3.24Å; R355-E360 IonicContact CZ-OE1 2.85Å; R355-E360 IonicContact NE-OE1 3.71Å; R355-E360 IonicContact NH1-OE1 3.79Å; R355-E360 PolarHBondContact NH1-OE1 3.25Å
356	S	97.7	Very high	95.8	Very high	87 Å²	87	80 Å²	80	61%	0.608	44%	0.444	S	S	*	.	H	α-helix	trans	-65	-29.6	-178.6	67.4	0	0	0	0	112.6	P352 T353	P352-S356 VanDerWaalsContact O-CB 3.32Å; P352-S356 WeakPolarHBondContact O-CB 3.29Å; P352-S356 PolarHBondContact O-N 2.85Å; P352-S356 PolarHBondContact O-OG 3.49Å; T353-S356 WeakPolarHBondContact CA-OG 3.31Å; T353-S356 PolarHBondContact O-N 3Å; T353-S356 PolarHBondContact O-OG 3.27Å
357	F	97.4	Very high	95.9	Very high	157 Å²	157	78 Å²	78	69%	0.689	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	2.4	176.4	-70.5	-73.6	0	0	0	113.9	T353 R355 N359	T353-F357 HydrophobicContact CG2-CD2 3.73Å; T353-F357 HydrophobicContact CG2-CE2 3.75Å; T353-F357 VanDerWaalsContact O-CD2 3.23Å; T353-F357 WeakPolarHBondContact O-CD2 3.29Å; T353-F357 PolarHBondContact O-N 2.85Å; R355-F357 PolarHBondContact O-N 3.46Å; F357-N359 PolarHBondContact O-N 3.26Å
358	A	96.9	Very high	96	Very high	77 Å²	77	82.9 Å²	82.9	64%	0.636	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	39.3	-177	0	0	0	0	0	113.7	V354 R355 E360	V354-A358 PolarHBondContact O-N 2.66Å; V354-A358 VanDerWaalsContact O-N 3.12Å; R355-A358 PolarHBondContact O-N 3.46Å; R355-A358 VanDerWaalsContact O-N 3.14Å; A358-E360 VanDerWaalsContact CA-OE2 3.27Å; A358-E360 WeakPolarHBondContact CA-OE2 3.42Å
359	N	96.4	Very high	96.1	Very high	71 Å²	71	82.1 Å²	82.1	38%	0.38	44%	0.442	S	S	.	.			trans	-100.8	24.2	-174.3	-166.5	44.1	0	0	0	113.3	V354 F357 E361 G362 E363	V354-N359 PolarHBondContact O-N 2.76Å; F357-N359 PolarHBondContact O-N 3.26Å; N359-E361 VanDerWaalsContact C-N 3.34Å; N359-E361 PolarHBondContact O-N 3.11Å; N359-G362 PolarHBondContact O-N 3.01Å; N359-E363 PolarHBondContact ND2-OE1 3.49Å; N359-E363 PolarHBondContact O-N 3.48Å; N359-E363 VanDerWaalsContact O-N 3.08Å
360	E	96.8	Very high	96.1	Very high	64 Å²	64	80.1 Å²	80.1	30%	0.299	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-42.8	-177.4	-58.8	92.6	147.3	0	0	112	V354 R355 A358 A364	V354-E360 HydrophobicContact CG1-CG 4.21Å; R355-E360 WeakPolarHBondContact CD-OE1 3.24Å; R355-E360 IonicContact CZ-OE1 2.85Å; R355-E360 IonicContact NE-OE1 3.71Å; R355-E360 IonicContact NH1-OE1 3.79Å; R355-E360 PolarHBondContact NH1-OE1 3.25Å; A358-E360 VanDerWaalsContact CA-OE2 3.27Å; A358-E360 WeakPolarHBondContact CA-OE2 3.42Å; E360-A364 WeakPolarHBondContact O-CB 3.18Å; E360-A364 PolarHBondContact O-N 3.41Å
361	E	96.9	Very high	96.1	Very high	128 Å²	128	81.2 Å²	81.2	60%	0.598	42%	0.421	S	S	*	.	H	α-helix	trans	-70.7	-33.3	179.3	-166	61.1	-146.2	0	0	111.8	N359 A364 Q365	N359-E361 VanDerWaalsContact C-N 3.34Å; N359-E361 PolarHBondContact O-N 3.11Å; E361-A364 PolarHBondContact O-N 3.12Å; E361-Q365 WeakPolarHBondContact O-CB 3.28Å; E361-Q365 PolarHBondContact O-N 2.85Å
362	G	95.6	Very high	96.1	Very high	32 Å²	32	82.7 Å²	82.7	33%	0.33	43%	0.427	S	S	.	.	H	α-helix	trans	-64.3	-46.7	175.9	0	0	0	0	0	112	N359 Q365 K366	N359-G362 PolarHBondContact O-N 3.01Å; G362-Q365 PolarHBondContact O-N 3.41Å; G362-K366 WeakPolarHBondContact O-CB 3.35Å; G362-K366 PolarHBondContact O-N 2.98Å
363	E	96.3	Very high	95.8	Very high	41 Å²	41	81.7 Å²	81.7	19%	0.192	41%	0.414	C	S	.	.	H	α-helix	trans	-67.3	-37.3	174.7	-68.1	-55.8	147.7	0	0	112.1	A347 V354 N359 Q365 K366 F367	A347-E363 HydrophobicContact CB-CB 4.22Å; A347-E363 HydrophobicContact CB-CG 4.12Å; V354-E363 HydrophobicContact CG1-CG 4.33Å; V354-E363 HydrophobicContact CG2-CG 4.4Å; N359-E363 PolarHBondContact ND2-OE1 3.49Å; N359-E363 PolarHBondContact O-N 3.48Å; N359-E363 VanDerWaalsContact O-N 3.08Å; E363-Q365 VanDerWaalsContact C-N 3.35Å; E363-Q365 PolarHBondContact O-N 2.99Å; E363-K366 PolarHBondContact O-N 2.92Å; E363-K366 IonicContact OE2-NZ 3.34Å; E363-F367 WeakPolarHBondContact O-CB 3.47Å; E363-F367 PolarHBondContact O-N 3.35Å
364	A	95.5	Very high	95.7	Very high	44 Å²	44	79.5 Å²	79.5	36%	0.364	40%	0.399	S	S	.	.	H	α-helix	trans	-61.7	-41.6	174.2	0	0	0	0	0	112.1	E360 E361 F367 R368	E360-A364 WeakPolarHBondContact O-CB 3.18Å; E360-A364 PolarHBondContact O-N 3.41Å; E361-A364 PolarHBondContact O-N 3.12Å; A364-F367 PolarHBondContact O-N 3.03Å; A364-R368 WeakPolarHBondContact O-CB 3.16Å; A364-R368 PolarHBondContact O-N 3.1Å
365	Q	96.6	Very high	95.4	Very high	96 Å²	96	84.3 Å²	84.3	45%	0.449	42%	0.418	S	S	.	.	H	α-helix	trans	-68.6	-40.8	177.1	-175	64	7.5	0	0	112	E361 G362 E363 F367 R368 Q369	E361-Q365 WeakPolarHBondContact O-CB 3.28Å; E361-Q365 PolarHBondContact O-N 2.85Å; G362-Q365 PolarHBondContact O-N 3.41Å; E363-Q365 VanDerWaalsContact C-N 3.35Å; E363-Q365 PolarHBondContact O-N 2.99Å; Q365-F367 VanDerWaalsContact C-N 3.33Å; Q365-F367 PolarHBondContact O-N 3.47Å; Q365-R368 WeakPolarHBondContact O-CB 3.48Å; Q365-R368 PolarHBondContact O-N 2.95Å; Q365-Q369 PolarHBondContact O-N 2.7Å
366	K	94.8	Very high	95.3	Very high	76 Å²	76	80 Å²	80	33%	0.33	41%	0.411	S	S	.	.	H	α-helix	trans	-60.3	-42.7	174.2	-174.9	-178	170.7	-165.7	0	111.4	V343 E346 G362 E363 Q369 K370	V343-K366 HydrophobicContact CG1-CD 4.06Å; V343-K366 HydrophobicContact CG1-CG 4.12Å; E346-K366 IonicContact OE2-NZ 3.95Å; G362-K366 WeakPolarHBondContact O-CB 3.35Å; G362-K366 PolarHBondContact O-N 2.98Å; E363-K366 PolarHBondContact O-N 2.92Å; E363-K366 IonicContact OE2-NZ 3.34Å; K366-Q369 PolarHBondContact O-N 3.24Å; K366-K370 PolarHBondContact O-N 3.34Å
367	F	95.6	Very high	95	Very high	72 Å²	72	78.6 Å²	78.6	32%	0.316	40%	0.396	S	S	.	.	H	α-helix	trans	-65.2	-43.5	174	-173.4	-103.5	0	0	0	112	S340 A344 E363 A364 Q365 Q369 K370 L371	S340-F367 WeakPolarHBondContact O-CE2 3.22Å; A344-F367 HydrophobicContact CB-CD2 4.23Å; A344-F367 HydrophobicContact CB-CE2 3.97Å; E363-F367 WeakPolarHBondContact O-CB 3.47Å; E363-F367 PolarHBondContact O-N 3.35Å; A364-F367 PolarHBondContact O-N 3.03Å; Q365-F367 VanDerWaalsContact C-N 3.33Å; Q365-F367 PolarHBondContact O-N 3.47Å; F367-Q369 VanDerWaalsContact C-N 3.34Å; F367-Q369 PolarHBondContact O-N 2.74Å; F367-K370 PolarHBondContact O-N 3.5Å; F367-L371 HydrophobicContact CD1-CD1 3.84Å; F367-L371 HydrophobicContact CD1-CG 4.26Å; F367-L371 HydrophobicContact CE1-CD1 3.48Å; F367-L371 VanDerWaalsContact CE1-CD1 3.48Å; F367-L371 HydrophobicContact CE1-CD2 4.36Å; F367-L371 HydrophobicContact CE1-CG 3.97Å; F367-L371 HydrophobicContact CZ-CD1 4.23Å; F367-L371 HydrophobicContact CZ-CD2 4.3Å; F367-L371 HydrophobicContact CZ-CG 4.32Å; F367-L371 PolarHBondContact O-N 3.02Å
368	R	95.7	Very high	94.7	Very high	119 Å²	119	74.6 Å²	74.6	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-44.3	175.4	-175.5	-179.8	-69.6	137.3	-3.1	111.8	A364 Q365 K370 L371 E372	A364-R368 WeakPolarHBondContact O-CB 3.16Å; A364-R368 PolarHBondContact O-N 3.1Å; Q365-R368 WeakPolarHBondContact O-CB 3.48Å; Q365-R368 PolarHBondContact O-N 2.95Å; R368-K370 VanDerWaalsContact C-N 3.33Å; R368-K370 PolarHBondContact O-N 3.17Å; R368-L371 WeakPolarHBondContact O-CB 3.44Å; R368-L371 PolarHBondContact O-N 3.5Å; R368-E372 WeakPolarHBondContact O-CG 3.33Å; R368-E372 PolarHBondContact O-N 3.49Å
369	Q	95.3	Very high	94.6	Very high	107 Å²	107	78.2 Å²	78.2	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-59.2	-43.6	176.6	-175.4	-179.8	1	0	0	111.7	Q365 K366 F367 L371 E372 E373	Q365-Q369 PolarHBondContact O-N 2.7Å; K366-Q369 PolarHBondContact O-N 3.24Å; F367-Q369 VanDerWaalsContact C-N 3.34Å; F367-Q369 PolarHBondContact O-N 2.74Å; Q369-L371 VanDerWaalsContact C-N 3.33Å; Q369-L371 PolarHBondContact O-N 3.19Å; Q369-E372 PolarHBondContact O-N 3.31Å; Q369-E372 VanDerWaalsContact O-N 3.16Å; Q369-E373 WeakPolarHBondContact O-CG 3.25Å; Q369-E373 PolarHBondContact O-N 3.48Å
370	K	93.3	Very high	94.4	Very high	57 Å²	57	81.5 Å²	81.5	25%	0.248	39%	0.394	C	S	.	.	H	α-helix	trans	-63.9	-37.2	176.5	-69.8	-72.7	156.6	-146.8	0	112.6	V343 K366 F367 R368 E373 M374	V343-K370 HydrophobicContact CG2-CG 4.43Å; K366-K370 PolarHBondContact O-N 3.34Å; F367-K370 PolarHBondContact O-N 3.5Å; R368-K370 VanDerWaalsContact C-N 3.33Å; R368-K370 PolarHBondContact O-N 3.17Å; K370-E373 IonicContact NZ-OE1 2.94Å; K370-E373 PolarHBondContact NZ-OE1 3.02Å; K370-E373 IonicContact NZ-OE2 3.91Å; K370-E373 PolarHBondContact NZ-OE2 3.15Å; K370-M374 PolarHBondContact O-N 3.37Å
371	L	93.9	Very high	94.1	Very high	60 Å²	60	79.9 Å²	79.9	31%	0.314	39%	0.386	S	S	.	.	H	α-helix	trans	-67	-37.5	173	-68.6	178.6	0	0	0	112.1	F367 R368 Q369 M374 K375	F367-L371 HydrophobicContact CD1-CD1 3.84Å; F367-L371 HydrophobicContact CD1-CG 4.26Å; F367-L371 HydrophobicContact CE1-CD1 3.48Å; F367-L371 VanDerWaalsContact CE1-CD1 3.48Å; F367-L371 HydrophobicContact CE1-CD2 4.36Å; F367-L371 HydrophobicContact CE1-CG 3.97Å; F367-L371 HydrophobicContact CZ-CD1 4.23Å; F367-L371 HydrophobicContact CZ-CD2 4.3Å; F367-L371 HydrophobicContact CZ-CG 4.32Å; F367-L371 PolarHBondContact O-N 3.02Å; R368-L371 WeakPolarHBondContact O-CB 3.44Å; R368-L371 PolarHBondContact O-N 3.5Å; Q369-L371 VanDerWaalsContact C-N 3.33Å; Q369-L371 PolarHBondContact O-N 3.19Å; L371-M374 HydrophobicContact CD2-CE 4.38Å; L371-M374 WeakPolarHBondContact O-CB 3.27Å; L371-M374 PolarHBondContact O-N 2.94Å; L371-K375 WeakPolarHBondContact O-CG 3.28Å; L371-K375 PolarHBondContact O-N 3.29Å
372	E	94.7	Very high	93.9	Very high	100 Å²	100	76.1 Å²	76.1	47%	0.467	38%	0.378	S	S	.	.	H	α-helix	trans	-68.4	-37.2	177.2	-72.7	-171.5	161.4	0	0	113.1	R368 Q369 M374 K375 P376	R368-E372 WeakPolarHBondContact O-CG 3.33Å; R368-E372 PolarHBondContact O-N 3.49Å; Q369-E372 PolarHBondContact O-N 3.31Å; Q369-E372 VanDerWaalsContact O-N 3.16Å; E372-M374 PolarHBondContact O-N 2.91Å; E372-K375 HydrophobicContact CG-CD 4.37Å; E372-K375 PolarHBondContact O-N 3.34Å; E372-K375 IonicContact OE1-NZ 2.89Å; E372-P376 WeakPolarHBondContact O-CD 3.47Å
373	E	91.8	Very high	93.8	Very high	81 Å²	81	80.2 Å²	80.2	38%	0.379	39%	0.391	S	S	.	.	H	α-helix	trans	-59.5	-34.7	169.8	-72	171.4	-168.3	0	0	111.7	Q369 K370 P376 L377	Q369-E373 WeakPolarHBondContact O-CG 3.25Å; Q369-E373 PolarHBondContact O-N 3.48Å; K370-E373 IonicContact NZ-OE1 2.94Å; K370-E373 PolarHBondContact NZ-OE1 3.02Å; K370-E373 IonicContact NZ-OE2 3.91Å; K370-E373 PolarHBondContact NZ-OE2 3.15Å; E373-P376 WeakPolarHBondContact O-CD 3.27Å; E373-L377 WeakPolarHBondContact O-CD1 3.46Å
374	M	93.1	Very high	93.5	Very high	27 Å²	27	79.2 Å²	79.2	13%	0.133	39%	0.39	C	S	.	.	H	α-helix	trans	-76.4	-34.6	179.4	-168.9	-176.5	76.2	0	0	113.4	V333 L337 K370 L371 E372 L377 N378	V333-M374 HydrophobicContact CG1-CG 4.49Å; V333-M374 HydrophobicContact CG1-SD 4.45Å; L337-M374 HydrophobicContact CB-SD 4.24Å; L337-M374 HydrophobicContact CD1-SD 4.36Å; K370-M374 PolarHBondContact O-N 3.37Å; L371-M374 HydrophobicContact CD2-CE 4.38Å; L371-M374 WeakPolarHBondContact O-CB 3.27Å; L371-M374 PolarHBondContact O-N 2.94Å; E372-M374 PolarHBondContact O-N 2.91Å; M374-L377 PolarHBondContact O-N 2.7Å; M374-L377 VanDerWaalsContact O-N 3.08Å; M374-N378 PolarHBondContact O-N 3.2Å
375	K	93.1	Very high	93.1	Very high	118 Å²	118	83 Å²	83	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-47.2	-50.5	-177.2	-79.2	176.5	-173.6	169.2	0	114.7	L371 E372 L377 N378 K379	L371-K375 WeakPolarHBondContact O-CG 3.28Å; L371-K375 PolarHBondContact O-N 3.29Å; E372-K375 HydrophobicContact CG-CD 4.37Å; E372-K375 PolarHBondContact O-N 3.34Å; E372-K375 IonicContact OE1-NZ 2.89Å; K375-L377 VanDerWaalsContact C-N 3.34Å; K375-L377 PolarHBondContact O-N 2.92Å; K375-N378 PolarHBondContact O-N 3.27Å; K375-K379 WeakPolarHBondContact O-CG 3.35Å; K375-K379 PolarHBondContact O-N 2.95Å
376	P	94.4	Very high	92.9	Very high	66 Å²	66	82 Å²	82	43%	0.429	40%	0.396	S	S	.	.	H	α-helix	trans	-67.5	-32.2	-178.8	25.8	-34.5	0	0	0	113	E372 E373 K380	E372-P376 WeakPolarHBondContact O-CD 3.47Å; E373-P376 WeakPolarHBondContact O-CD 3.27Å; P376-K380 WeakPolarHBondContact O-CG 3.31Å; P376-K380 PolarHBondContact O-N 3.13Å
377	L	91.4	Very high	92.6	Very high	57 Å²	57	81.7 Å²	81.7	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-67.1	-45.9	173.6	-79.7	85	0	0	0	110.6	K332 V333 E373 M374 K375 K379 K380 E381	K332-L377 HydrophobicContact CB-CD2 3.59Å; V333-L377 HydrophobicContact CG2-CB 3.69Å; E373-L377 WeakPolarHBondContact O-CD1 3.46Å; M374-L377 PolarHBondContact O-N 2.7Å; M374-L377 VanDerWaalsContact O-N 3.08Å; K375-L377 VanDerWaalsContact C-N 3.34Å; K375-L377 PolarHBondContact O-N 2.92Å; L377-K379 VanDerWaalsContact C-N 3.31Å; L377-K379 PolarHBondContact O-N 2.82Å; L377-K380 PolarHBondContact O-N 2.86Å; L377-K380 VanDerWaalsContact O-N 3.08Å; L377-E381 PolarHBondContact O-N 3.41Å
378	N	91.4	Very high	92.1	Very high	73 Å²	73	80.7 Å²	80.7	39%	0.39	40%	0.397	S	S	.	.	H	α-helix	trans	-62.6	-38.3	-179.7	-157.9	1.3	0	0	0	111.7	M374 K375 K380 E381 A382	M374-N378 PolarHBondContact O-N 3.2Å; K375-N378 PolarHBondContact O-N 3.27Å; N378-K380 PolarHBondContact O-N 3.38Å; N378-E381 PolarHBondContact O-N 3.35Å; N378-A382 WeakPolarHBondContact O-CB 3.27Å; N378-A382 PolarHBondContact O-N 2.76Å
379	K	93.6	Very high	91.6	Very high	153 Å²	153	77.7 Å²	77.7	67%	0.665	39%	0.391	S	S	*	.	H	α-helix	trans	-60	-44	171.4	-75.6	-177.9	178.9	-177.6	0	112.6	K375 L377 A382 L383	K375-K379 WeakPolarHBondContact O-CG 3.35Å; K375-K379 PolarHBondContact O-N 2.95Å; L377-K379 VanDerWaalsContact C-N 3.31Å; L377-K379 PolarHBondContact O-N 2.82Å; K379-A382 PolarHBondContact O-N 3.38Å; K379-L383 WeakPolarHBondContact O-CG 3.33Å; K379-L383 PolarHBondContact O-N 3.02Å; K379-L383 VanDerWaalsContact O-N 3.08Å
380	K	92.3	Very high	91.3	Very high	140 Å²	140	81.3 Å²	81.3	61%	0.609	40%	0.401	S	S	*	.	H	α-helix	trans	-67.4	-38.2	177.7	-70.6	176.9	177.9	177.4	0	111.6	L329 P376 L377 N378 L383 A384	L329-K380 VanDerWaalsContact CD2-C 3.41Å; L329-K380 HydrophobicContact CD2-CB 3.42Å; L329-K380 VanDerWaalsContact CD2-CB 3.42Å; P376-K380 WeakPolarHBondContact O-CG 3.31Å; P376-K380 PolarHBondContact O-N 3.13Å; L377-K380 PolarHBondContact O-N 2.86Å; L377-K380 VanDerWaalsContact O-N 3.08Å; N378-K380 PolarHBondContact O-N 3.38Å; K380-L383 PolarHBondContact O-N 3.29Å; K380-A384 WeakPolarHBondContact O-CB 3.19Å; K380-A384 PolarHBondContact O-N 2.67Å
381	E	91.4	Very high	90.9	Very high	30 Å²	30	80 Å²	80	14%	0.14	40%	0.398	C	S	.	.	H	α-helix	trans	-62.5	-48.2	174.6	-177	-174.4	177.2	0	0	111	Y326 L329 V333 L377 N378 L383 A384 Y385	Y326-E381 HydrophobicContact CD2-CG 4.03Å; Y326-E381 HydrophobicContact CE2-CG 3.65Å; L329-E381 HydrophobicContact CB-CB 4.31Å; V333-E381 VanDerWaalsContact CB-OE2 3.29Å; V333-E381 WeakPolarHBondContact CB-OE2 3.07Å; V333-E381 WeakPolarHBondContact CG1-OE2 3.32Å; V333-E381 HydrophobicContact CG2-CB 4.28Å; V333-E381 WeakPolarHBondContact CG2-OE2 3.26Å; L377-E381 PolarHBondContact O-N 3.41Å; N378-E381 PolarHBondContact O-N 3.35Å; E381-L383 VanDerWaalsContact C-N 3.32Å; E381-L383 PolarHBondContact O-N 3.46Å; E381-A384 WeakPolarHBondContact O-CB 3.44Å; E381-A384 PolarHBondContact O-N 2.88Å; E381-A384 VanDerWaalsContact O-N 3.11Å; E381-Y385 WeakPolarHBondContact O-CB 3.05Å; E381-Y385 PolarHBondContact O-N 3.2Å
382	A	91.9	Very high	90.3	Very high	50 Å²	50	79.1 Å²	79.1	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-58.6	-42.9	177.9	0	0	0	0	0	112	N378 K379 Y385 V386	N378-A382 WeakPolarHBondContact O-CB 3.27Å; N378-A382 PolarHBondContact O-N 2.76Å; K379-A382 PolarHBondContact O-N 3.38Å; A382-Y385 PolarHBondContact O-N 2.83Å; A382-V386 WeakPolarHBondContact O-CG2 3.38Å; A382-V386 PolarHBondContact O-N 2.83Å
383	L	92.9	Very high	89.8	Confident	118 Å²	118	78 Å²	78	62%	0.618	40%	0.395	S	S	*	.	H	α-helix	trans	-64.4	-41.7	174.6	-73.9	172	0	0	0	112.3	K379 K380 E381 V386 T387	K379-L383 WeakPolarHBondContact O-CG 3.33Å; K379-L383 PolarHBondContact O-N 3.02Å; K379-L383 VanDerWaalsContact O-N 3.08Å; K380-L383 PolarHBondContact O-N 3.29Å; E381-L383 VanDerWaalsContact C-N 3.32Å; E381-L383 PolarHBondContact O-N 3.46Å; L383-V386 PolarHBondContact O-N 3.43Å; L383-T387 WeakPolarHBondContact O-CB 3.22Å; L383-T387 PolarHBondContact O-N 3.26Å; L383-T387 PolarHBondContact O-OG1 3.43Å
384	A	90.1	Very high	89.5	Confident	20 Å²	20	78.5 Å²	78.5	17%	0.165	40%	0.404	C	S	.	.	H	α-helix	trans	-62.9	-42.7	176.5	0	0	0	0	0	111.5	Y326 K380 E381 T387 E388	Y326-A384 HydrophobicContact CD2-CB 4.43Å; K380-A384 WeakPolarHBondContact O-CB 3.19Å; K380-A384 PolarHBondContact O-N 2.67Å; E381-A384 WeakPolarHBondContact O-CB 3.44Å; E381-A384 PolarHBondContact O-N 2.88Å; E381-A384 VanDerWaalsContact O-N 3.11Å; A384-T387 PolarHBondContact O-N 2.88Å; A384-E388 PolarHBondContact O-N 3.43Å
385	Y	88.4	Confident	89	Confident	124 Å²	124	78.2 Å²	78.2	49%	0.486	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-50.4	175.6	172.9	-102.8	0	0	0	112	Y326 E381 A382 T387 E388 V389	Y326-Y385 HydrophobicContact CE2-CD2 4.31Å; E381-Y385 WeakPolarHBondContact O-CB 3.05Å; E381-Y385 PolarHBondContact O-N 3.2Å; A382-Y385 PolarHBondContact O-N 2.83Å; Y385-T387 VanDerWaalsContact C-N 3.27Å; Y385-T387 PolarHBondContact O-N 3Å; Y385-E388 PolarHBondContact O-N 3.28Å; Y385-E388 VanDerWaalsContact O-N 3.17Å; Y385-V389 HydrophobicContact CD1-CG2 4.45Å; Y385-V389 HydrophobicContact CD2-CG2 4.17Å; Y385-V389 HydrophobicContact CE1-CG2 4.02Å; Y385-V389 HydrophobicContact CE2-CG2 3.7Å; Y385-V389 WeakPolarHBondContact O-CG2 3.19Å; Y385-V389 PolarHBondContact O-N 3.27Å
386	V	91.4	Very high	88.4	Confident	73 Å²	73	73.6 Å²	73.6	44%	0.442	39%	0.39	S	S	.	.	H	α-helix	trans	-58.4	-43.1	177.6	172.1	0	0	0	0	110.7	A382 L383 E388 V389 W390	A382-V386 WeakPolarHBondContact O-CG2 3.38Å; A382-V386 PolarHBondContact O-N 2.83Å; L383-V386 PolarHBondContact O-N 3.43Å; V386-E388 PolarHBondContact O-N 2.97Å; V386-V389 PolarHBondContact O-N 3.38Å; V386-W390 WeakPolarHBondContact O-CB 3.5Å; V386-W390 VanDerWaalsContact O-CD1 3.31Å; V386-W390 PolarHBondContact O-N 2.84Å
387	T	89.3	Confident	87.9	Confident	71 Å²	71	76.7 Å²	76.7	44%	0.436	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-41.4	178.5	-53.8	0	0	0	0	111.8	L322 L383 A384 Y385 T391	L322-T387 HydrophobicContact CD1-CG2 4.34Å; L322-T387 HydrophobicContact CD2-CG2 4.49Å; L383-T387 WeakPolarHBondContact O-CB 3.22Å; L383-T387 PolarHBondContact O-N 3.26Å; L383-T387 PolarHBondContact O-OG1 3.43Å; A384-T387 PolarHBondContact O-N 2.88Å; Y385-T387 VanDerWaalsContact C-N 3.27Å; Y385-T387 PolarHBondContact O-N 3Å; T387-T391 VanDerWaalsContact O-CB 3.29Å; T387-T391 WeakPolarHBondContact O-CB 3.43Å; T387-T391 PolarHBondContact O-N 2.94Å; T387-T391 PolarHBondContact O-OG1 3.38Å
388	E	84.8	Confident	87.5	Confident	50 Å²	50	79.7 Å²	79.7	23%	0.234	42%	0.416	C	S	.	.	H	α-helix	trans	-62.9	-52.1	176	-179.5	176.4	-175.7	0	0	111.7	Y326 A384 Y385 V386 W390 T391 M392	Y326-E388 WeakPolarHBondContact CB-OE2 3.46Å; Y326-E388 WeakPolarHBondContact CD1-OE2 3.27Å; A384-E388 PolarHBondContact O-N 3.43Å; Y385-E388 PolarHBondContact O-N 3.28Å; Y385-E388 VanDerWaalsContact O-N 3.17Å; V386-E388 PolarHBondContact O-N 2.97Å; E388-W390 VanDerWaalsContact C-N 3.35Å; E388-W390 PolarHBondContact O-N 2.92Å; E388-T391 PolarHBondContact O-N 3.03Å; E388-M392 PolarHBondContact O-N 3.49Å
389	V	84.9	Confident	87.1	Confident	56 Å²	56	77.3 Å²	77.3	34%	0.339	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-43.3	-179.3	173.3	0	0	0	0	111.4	Y385 V386 M392 S393	Y385-V389 HydrophobicContact CD1-CG2 4.45Å; Y385-V389 HydrophobicContact CD2-CG2 4.17Å; Y385-V389 HydrophobicContact CE1-CG2 4.02Å; Y385-V389 HydrophobicContact CE2-CG2 3.7Å; Y385-V389 WeakPolarHBondContact O-CG2 3.19Å; Y385-V389 PolarHBondContact O-N 3.27Å; V386-V389 PolarHBondContact O-N 3.38Å; V389-M392 PolarHBondContact O-N 3.47Å; V389-S393 WeakPolarHBondContact O-CB 3.36Å; V389-S393 PolarHBondContact O-N 2.89Å; V389-S393 PolarHBondContact O-OG 3.32Å
390	W	88.4	Confident	86.4	Confident	184 Å²	184	75.7 Å²	75.7	70%	0.697	40%	0.397	S	S	*	.	H	α-helix	trans	-65.6	-43.6	177.1	-88.6	58.4	0	0	0	112	V386 E388 M392 S393 V394	V386-W390 WeakPolarHBondContact O-CB 3.5Å; V386-W390 VanDerWaalsContact O-CD1 3.31Å; V386-W390 PolarHBondContact O-N 2.84Å; E388-W390 VanDerWaalsContact C-N 3.35Å; E388-W390 PolarHBondContact O-N 2.92Å; W390-M392 VanDerWaalsContact C-N 3.33Å; W390-M392 PolarHBondContact O-N 3.27Å; W390-S393 PolarHBondContact O-N 3.05Å; W390-V394 WeakPolarHBondContact O-CB 3.1Å; W390-V394 WeakPolarHBondContact O-CG2 3.45Å; W390-V394 PolarHBondContact O-N 3.05Å
391	T	85.3	Confident	86.1	Confident	30 Å²	30	73.2 Å²	73.2	18%	0.184	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-42	178.7	-57.8	0	0	0	0	111.3	L318 L322 T387 E388 S395	L318-T391 HydrophobicContact CD2-CG2 3.54Å; L318-T391 HydrophobicContact CG-CG2 3.79Å; L322-T391 HydrophobicContact CD1-CG2 3.67Å; L322-T391 WeakPolarHBondContact CD1-OG1 3.46Å; T387-T391 VanDerWaalsContact O-CB 3.29Å; T387-T391 WeakPolarHBondContact O-CB 3.43Å; T387-T391 PolarHBondContact O-N 2.94Å; T387-T391 PolarHBondContact O-OG1 3.38Å; E388-T391 PolarHBondContact O-N 3.03Å; T391-S395 VanDerWaalsContact O-CB 3.3Å; T391-S395 WeakPolarHBondContact O-CB 3.23Å; T391-S395 PolarHBondContact O-N 3.41Å; T391-S395 PolarHBondContact O-OG 2.87Å
392	M	82.3	Confident	85.7	Confident	41 Å²	41	73.2 Å²	73.2	20%	0.202	40%	0.401	C	S	.	.	H	α-helix	trans	-61.1	-47.2	174.6	-170.1	61.1	172.8	0	0	111.1	L315 F316 P319 E388 V389 W390 S395 G396 E436	L315-M392 HydrophobicContact CD2-CE 3.96Å; L315-M392 HydrophobicContact CD2-SD 4.3Å; F316-M392 HydrophobicContact CE1-CE 4.19Å; P319-M392 HydrophobicContact CB-SD 4.11Å; P319-M392 HydrophobicContact CG-CB 4.5Å; P319-M392 HydrophobicContact CG-SD 3.67Å; E388-M392 PolarHBondContact O-N 3.49Å; V389-M392 PolarHBondContact O-N 3.47Å; W390-M392 VanDerWaalsContact C-N 3.33Å; W390-M392 PolarHBondContact O-N 3.27Å; M392-S395 PolarHBondContact O-N 2.95Å; M392-S395 PolarHBondContact O-OG 2.9Å; M392-G396 PolarHBondContact O-N 3.19Å; M392-E436 VanDerWaalsContact CE-CD 3.41Å; M392-E436 HydrophobicContact CE-CG 3.84Å; M392-E436 VanDerWaalsContact CE-OE1 3.27Å; M392-E436 WeakPolarHBondContact CE-OE1 3.26Å
393	S	83.2	Confident	85.3	Confident	76 Å²	76	71 Å²	71	53%	0.531	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-47.1	179.9	-60.6	0	0	0	0	112.9	V389 W390 G396 M397	V389-S393 WeakPolarHBondContact O-CB 3.36Å; V389-S393 PolarHBondContact O-N 2.89Å; V389-S393 PolarHBondContact O-OG 3.32Å; W390-S393 PolarHBondContact O-N 3.05Å; S393-G396 PolarHBondContact O-N 3.46Å; S393-M397 WeakPolarHBondContact O-CB 3.29Å; S393-M397 PolarHBondContact O-N 3.46Å
394	V	85.9	Confident	84.8	Confident	91 Å²	91	70.8 Å²	70.8	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-65.4	-42.8	179.1	171.7	0	0	0	0	111.1	W390 G396 M397 L398	W390-V394 WeakPolarHBondContact O-CB 3.1Å; W390-V394 WeakPolarHBondContact O-CG2 3.45Å; W390-V394 PolarHBondContact O-N 3.05Å; V394-G396 VanDerWaalsContact C-N 3.34Å; V394-G396 PolarHBondContact O-N 2.94Å; V394-M397 PolarHBondContact O-N 2.75Å; V394-L398 WeakPolarHBondContact O-CB 3.42Å; V394-L398 PolarHBondContact O-N 3.48Å
395	S	82.2	Confident	84.7	Confident	21 Å²	21	77 Å²	77	15%	0.147	40%	0.402	C	S	.	.	H	α-helix	trans	-62.4	-41.2	177.7	71.9	0	0	0	0	112.2	T391 M392 L398 L399	T391-S395 VanDerWaalsContact O-CB 3.3Å; T391-S395 WeakPolarHBondContact O-CB 3.23Å; T391-S395 PolarHBondContact O-N 3.41Å; T391-S395 PolarHBondContact O-OG 2.87Å; M392-S395 PolarHBondContact O-N 2.95Å; M392-S395 PolarHBondContact O-OG 2.9Å; S395-L398 PolarHBondContact O-N 3.48Å; S395-L399 PolarHBondContact O-N 2.73Å
396	G	80.7	Confident	84.5	Confident	21 Å²	21	73.8 Å²	73.8	22%	0.216	39%	0.392	C	S	.	.	H	α-helix	trans	-65.3	-37.3	174.5	0	0	0	0	0	112.8	M392 S393 V394 K400	M392-G396 PolarHBondContact O-N 3.19Å; S393-G396 PolarHBondContact O-N 3.46Å; V394-G396 VanDerWaalsContact C-N 3.34Å; V394-G396 PolarHBondContact O-N 2.94Å; G396-K400 WeakPolarHBondContact O-CG 3.37Å; G396-K400 PolarHBondContact O-N 2.97Å; G396-K400 VanDerWaalsContact O-N 3.16Å
397	M	83.5	Confident	84.2	Confident	131 Å²	131	70.4 Å²	70.4	65%	0.645	37%	0.372	S	S	*	.	H	α-helix	trans	-70.4	-41.7	176.9	-167.1	157.2	169.1	0	0	112.2	S393 V394 L399 K400 V401	S393-M397 WeakPolarHBondContact O-CB 3.29Å; S393-M397 PolarHBondContact O-N 3.46Å; V394-M397 PolarHBondContact O-N 2.75Å; M397-L399 VanDerWaalsContact C-N 3.28Å; M397-L399 PolarHBondContact O-N 3.12Å; M397-K400 WeakPolarHBondContact O-CB 3.35Å; M397-K400 PolarHBondContact O-N 3.48Å; M397-V401 WeakPolarHBondContact O-CG2 3.37Å; M397-V401 PolarHBondContact O-N 3.13Å
398	L	84.2	Confident	83.9	Confident	121 Å²	121	68.2 Å²	68.2	63%	0.634	36%	0.363	S	S	*	.	H	α-helix	trans	-59.1	-41.2	174.3	-176	64.2	0	0	0	111.4	V394 S395 V401 G402	V394-L398 WeakPolarHBondContact O-CB 3.42Å; V394-L398 PolarHBondContact O-N 3.48Å; S395-L398 PolarHBondContact O-N 3.48Å; L398-V401 PolarHBondContact O-N 3.16Å; L398-G402 PolarHBondContact O-N 3.38Å
399	L	81.8	Confident	83.9	Confident	23 Å²	23	69.2 Å²	69.2	12%	0.12	37%	0.368	C	S	.	.	H	α-helix	trans	-62.2	-44.2	175.5	179.4	58.1	0	0	0	112.3	S311 L315 S395 M397 V401 G402 I403	S311-L399 VanDerWaalsContact CB-CD1 3.44Å; S311-L399 WeakPolarHBondContact OG-CD1 3.14Å; L315-L399 HydrophobicContact CD1-CB 4.41Å; L315-L399 HydrophobicContact CD1-CD2 3.45Å; L315-L399 VanDerWaalsContact CD1-CD2 3.45Å; S395-L399 PolarHBondContact O-N 2.73Å; M397-L399 VanDerWaalsContact C-N 3.28Å; M397-L399 PolarHBondContact O-N 3.12Å; L399-V401 PolarHBondContact O-N 3.34Å; L399-G402 PolarHBondContact O-N 3.38Å; L399-I403 HydrophobicContact CD1-CD1 3.49Å; L399-I403 VanDerWaalsContact CD1-CD1 3.49Å; L399-I403 HydrophobicContact CD1-CG1 4.21Å; L399-I403 HydrophobicContact CG-CD1 3.9Å; L399-I403 PolarHBondContact O-N 3.46Å
400	K	80.5	Confident	83.8	Confident	119 Å²	119	67.7 Å²	67.7	52%	0.517	36%	0.358	S	S	.	.	H	α-helix	trans	-59.3	-46.2	176.9	-70.8	171.1	-170.9	176.6	0	111.5	G396 M397 I403 L404	G396-K400 WeakPolarHBondContact O-CG 3.37Å; G396-K400 PolarHBondContact O-N 2.97Å; G396-K400 VanDerWaalsContact O-N 3.16Å; M397-K400 WeakPolarHBondContact O-CB 3.35Å; M397-K400 PolarHBondContact O-N 3.48Å; K400-I403 PolarHBondContact O-N 3.31Å; K400-L404 WeakPolarHBondContact O-CB 3.42Å; K400-L404 PolarHBondContact O-N 2.77Å
401	V	85.3	Confident	83.7	Confident	87 Å²	87	61.2 Å²	61.2	53%	0.527	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-44.2	177.9	174.9	0	0	0	0	110.9	M397 L398 L399 I403 L404 Y405	M397-V401 WeakPolarHBondContact O-CG2 3.37Å; M397-V401 PolarHBondContact O-N 3.13Å; L398-V401 PolarHBondContact O-N 3.16Å; L399-V401 PolarHBondContact O-N 3.34Å; V401-I403 VanDerWaalsContact C-N 3.32Å; V401-I403 PolarHBondContact O-N 2.97Å; V401-L404 PolarHBondContact O-N 3.29Å; V401-Y405 WeakPolarHBondContact O-CB 3.04Å; V401-Y405 PolarHBondContact O-N 3.23Å
402	G	83.8	Confident	83.7	Confident	31 Å²	31	66.1 Å²	66.1	32%	0.32	37%	0.368	S	S	.	.	H	α-helix	trans	-60.1	-40.6	178.3	0	0	0	0	0	113.1	L398 L399 Y405 L406	L398-G402 PolarHBondContact O-N 3.38Å; L399-G402 PolarHBondContact O-N 3.38Å; G402-Y405 PolarHBondContact O-N 3.49Å; G402-L406 WeakPolarHBondContact O-CG 3.18Å; G402-L406 PolarHBondContact O-N 2.86Å
403	I	81.9	Confident	83.8	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-78	-34.3	-179.7	-70.9	163.3	0	0	0	112.1	T308 L399 K400 V401 Y405 G407 F424 Q428	T308-I403 HydrophobicContact CG2-CD1 3.64Å; L399-I403 HydrophobicContact CD1-CD1 3.49Å; L399-I403 VanDerWaalsContact CD1-CD1 3.49Å; L399-I403 HydrophobicContact CD1-CG1 4.21Å; L399-I403 HydrophobicContact CG-CD1 3.9Å; L399-I403 PolarHBondContact O-N 3.46Å; K400-I403 PolarHBondContact O-N 3.31Å; V401-I403 VanDerWaalsContact C-N 3.32Å; V401-I403 PolarHBondContact O-N 2.97Å; I403-Y405 VanDerWaalsContact C-N 3.3Å; I403-Y405 PolarHBondContact O-N 3.49Å; I403-G407 WeakPolarHBondContact O-CA 3.34Å; I403-G407 PolarHBondContact O-N 2.99Å; I403-F424 HydrophobicContact CG2-CD1 4.47Å; I403-F424 HydrophobicContact CG2-CE1 4.26Å; I403-Q428 HydrophobicContact CD1-CG 4.33Å
404	L	83.4	Confident	83.6	Confident	112 Å²	112	72.7 Å²	72.7	59%	0.586	40%	0.399	S	S	*	.	H	α-helix	trans	-61.8	-41	171	-174.2	63.8	0	0	0	111.2	K400 V401 G408	K400-L404 WeakPolarHBondContact O-CB 3.42Å; K400-L404 PolarHBondContact O-N 2.77Å; V401-L404 PolarHBondContact O-N 3.29Å; L404-G408 WeakPolarHBondContact O-CA 3.3Å; L404-G408 PolarHBondContact O-N 3.49Å
405	Y	87	Confident	83.2	Confident	152 Å²	152	71.9 Å²	71.9	60%	0.596	40%	0.402	S	S	*	.	H	α-helix	trans	-65.1	-51.9	177	-177.2	-97.4	0	0	0	112.2	V401 G402 I403 G408 Q409	V401-Y405 WeakPolarHBondContact O-CB 3.04Å; V401-Y405 PolarHBondContact O-N 3.23Å; G402-Y405 PolarHBondContact O-N 3.49Å; I403-Y405 VanDerWaalsContact C-N 3.3Å; I403-Y405 PolarHBondContact O-N 3.49Å; Y405-G408 PolarHBondContact O-N 3.48Å; Y405-Q409 PolarHBondContact O-N 3.31Å; Y405-Q409 PolarHBondContact OH-NE2 2.81Å; Y405-Q409 VanDerWaalsContact OH-NE2 3.16Å
406	L	85.5	Confident	83.1	Confident	56 Å²	56	71.8 Å²	71.8	29%	0.293	40%	0.401	S	S	.	.	H	α-helix	trans	-67.7	-41.6	-179.4	-69.6	171.8	0	0	0	112.4	V307 G402 Q409 L410	V307-L406 HydrophobicContact CG1-CD1 3.72Å; G402-L406 WeakPolarHBondContact O-CG 3.18Å; G402-L406 PolarHBondContact O-N 2.86Å; L406-Q409 PolarHBondContact O-N 3.34Å; L406-L410 PolarHBondContact O-N 3.23Å
407	G	84.1	Confident	83.2	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-41.1	175	0	0	0	0	0	112.1	I403 Q409 L410 V411	I403-G407 WeakPolarHBondContact O-CA 3.34Å; I403-G407 PolarHBondContact O-N 2.99Å; G407-Q409 PolarHBondContact O-N 3.45Å; G407-L410 WeakPolarHBondContact O-CB 3.47Å; G407-L410 PolarHBondContact O-N 3.44Å; G407-L410 VanDerWaalsContact O-N 3.11Å; G407-V411 WeakPolarHBondContact O-CG2 3.46Å; G407-V411 PolarHBondContact O-N 3.39Å
408	G	83.9	Confident	83.3	Confident	25 Å²	25	68.3 Å²	68.3	26%	0.258	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-42.8	173.9	0	0	0	0	0	112.6	L404 Y405 L410 V411 V412	L404-G408 WeakPolarHBondContact O-CA 3.3Å; L404-G408 PolarHBondContact O-N 3.49Å; Y405-G408 PolarHBondContact O-N 3.48Å; G408-L410 VanDerWaalsContact C-N 3.29Å; G408-L410 PolarHBondContact O-N 2.98Å; G408-V411 PolarHBondContact O-N 2.92Å; G408-V412 WeakPolarHBondContact O-CG2 3.09Å; G408-V412 PolarHBondContact O-N 3.14Å
409	Q	84.8	Confident	83.3	Confident	72 Å²	72	62.5 Å²	62.5	34%	0.336	36%	0.356	S	S	.	.	H	α-helix	trans	-62.1	-35.1	173.1	-72.3	-160.9	-6.6	0	0	112.9	Y405 L406 G407 R413	Y405-Q409 PolarHBondContact O-N 3.31Å; Y405-Q409 PolarHBondContact OH-NE2 2.81Å; Y405-Q409 VanDerWaalsContact OH-NE2 3.16Å; L406-Q409 PolarHBondContact O-N 3.34Å; G407-Q409 PolarHBondContact O-N 3.45Å; Q409-R413 VanDerWaalsContact O-CG 3.29Å; Q409-R413 WeakPolarHBondContact O-CG 3.38Å; Q409-R413 PolarHBondContact O-N 2.98Å; Q409-R413 VanDerWaalsContact O-N 3.12Å
410	L	83	Confident	83.4	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-67.3	-36.6	174.9	-110.3	69.1	0	0	0	112.5	Y303 L304 L406 G407 G408 R413 G414 A415 V416	Y303-L410 HydrophobicContact CD1-CD1 4.03Å; Y303-L410 HydrophobicContact CD1-CD2 3.96Å; Y303-L410 HydrophobicContact CE1-CD1 3.98Å; L304-L410 HydrophobicContact CD1-CD2 4.44Å; L304-L410 HydrophobicContact CD2-CD2 4.32Å; L304-L410 HydrophobicContact CG-CD2 4.13Å; L406-L410 PolarHBondContact O-N 3.23Å; G407-L410 WeakPolarHBondContact O-CB 3.47Å; G407-L410 PolarHBondContact O-N 3.44Å; G407-L410 VanDerWaalsContact O-N 3.11Å; G408-L410 VanDerWaalsContact C-N 3.29Å; G408-L410 PolarHBondContact O-N 2.98Å; L410-R413 PolarHBondContact O-N 3.33Å; L410-G414 PolarHBondContact O-N 2.92Å; L410-A415 HydrophobicContact CG-CB 4.44Å; L410-A415 PolarHBondContact O-N 2.98Å; L410-A415 VanDerWaalsContact O-N 3.08Å; L410-V416 HydrophobicContact CB-CG2 4.4Å; L410-V416 HydrophobicContact CD2-CG2 3.83Å; L410-V416 HydrophobicContact CG-CG2 4.47Å
411	V	85.6	Confident	83.7	Confident	47 Å²	47	60.1 Å²	60.1	29%	0.285	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-44.3	175.1	173.9	0	0	0	0	110.9	G407 G408 R413 G414 L421	G407-V411 WeakPolarHBondContact O-CG2 3.46Å; G407-V411 PolarHBondContact O-N 3.39Å; G408-V411 PolarHBondContact O-N 2.92Å; V411-R413 PolarHBondContact O-N 2.97Å; V411-G414 PolarHBondContact O-N 3.35Å; V411-L421 HydrophobicContact CG2-CB 4.02Å; V411-L421 HydrophobicContact CG2-CD2 3.63Å; V411-L421 HydrophobicContact CG2-CG 4.38Å
412	V	85.8	Confident	83.8	Confident	133 Å²	133	58.4 Å²	58.4	81%	0.806	34%	0.338	S	S	*	.	H	α-helix	trans	-60.3	-34.5	176.5	172.7	0	0	0	0	111.7	G408 G414	G408-V412 WeakPolarHBondContact O-CG2 3.09Å; G408-V412 PolarHBondContact O-N 3.14Å; V412-G414 PolarHBondContact O-N 2.94Å
413	R	84.5	Confident	84.1	Confident	190 Å²	190	57.3 Å²	57.3	72%	0.717	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-2	175.2	-69.3	175.5	-174.4	-174	3.8	114	Q409 L410 V411 A415	Q409-R413 VanDerWaalsContact O-CG 3.29Å; Q409-R413 WeakPolarHBondContact O-CG 3.38Å; Q409-R413 PolarHBondContact O-N 2.98Å; Q409-R413 VanDerWaalsContact O-N 3.12Å; L410-R413 PolarHBondContact O-N 3.33Å; V411-R413 PolarHBondContact O-N 2.97Å; R413-A415 PolarHBondContact O-N 2.9Å
414	G	77.5	Confident	84.4	Confident	65 Å²	65	57.3 Å²	57.3	67%	0.67	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	12	-179.2	0	0	0	0	0	115	L410 V411 V412	L410-G414 PolarHBondContact O-N 2.92Å; V411-G414 PolarHBondContact O-N 3.35Å; V412-G414 PolarHBondContact O-N 2.94Å
415	A	77.3	Confident	84.6	Confident	74 Å²	74	54.6 Å²	54.6	61%	0.612	31%	0.313	S	S	*	.	S	Bend	trans	-79.8	-22.7	-177.2	0	0	0	0	0	113.1	L410 R413	L410-A415 HydrophobicContact CG-CB 4.44Å; L410-A415 PolarHBondContact O-N 2.98Å; L410-A415 VanDerWaalsContact O-N 3.08Å; R413-A415 PolarHBondContact O-N 2.9Å
416	V	80.4	Confident	84.8	Confident	19 Å²	19	50 Å²	50	12%	0.115	30%	0.299	C	S	.	.	S	Bend	trans	-140.9	139.4	-179.3	-177.8	0	0	0	0	109	L410 N420	L410-V416 HydrophobicContact CB-CG2 4.4Å; L410-V416 HydrophobicContact CD2-CG2 3.83Å; L410-V416 HydrophobicContact CG-CG2 4.47Å; V416-N420 HydrophobicContact CG1-CB 3.6Å
417	S	83.9	Confident	85	Confident	39 Å²	39	47.8 Å²	47.8	27%	0.273	29%	0.286	S	S	.	.			trans	-71.4	157.1	174.2	71.8	0	0	0	0	111.9	D190 G419 N420 L421	D190-S417 WeakPolarHBondContact OD1-CB 3.34Å; D190-S417 PolarHBondContact OD1-OG 3.48Å; D190-S417 WeakPolarHBondContact OD2-CB 3.49Å; D190-S417 PolarHBondContact OD2-OG 3.11Å; S417-G419 VanDerWaalsContact C-N 3.27Å; S417-G419 PolarHBondContact O-N 3.44Å; S417-N420 PolarHBondContact O-N 2.95Å; S417-N420 WeakPolarHBondContact OG-CB 3.41Å; S417-N420 VanDerWaalsContact OG-CG 3.3Å; S417-N420 PolarHBondContact OG-N 2.96Å; S417-N420 VanDerWaalsContact OG-N 3.08Å; S417-L421 PolarHBondContact O-N 3.33Å
418	S	84.1	Confident	85.1	Confident	40 Å²	40	48.1 Å²	48.1	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-37.6	175	45	0	0	0	0	111.9	D190 L193 L421 V422	D190-S418 PolarHBondContact OD1-OG 3.02Å; L193-S418 WeakPolarHBondContact CD1-OG 3.44Å; S418-L421 WeakPolarHBondContact O-CB 3.48Å; S418-L421 PolarHBondContact O-N 2.94Å; S418-V422 WeakPolarHBondContact O-CG2 3.36Å; S418-V422 PolarHBondContact O-N 2.66Å
419	G	84.2	Confident	85.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-43.7	174.7	0	0	0	0	0	113.5	G186 D190 S417 L421 V422 S423	G186-G419 WeakPolarHBondContact CA-O 3.23Å; G186-G419 WeakPolarHBondContact O-CA 3.43Å; D190-G419 VanDerWaalsContact CG-CA 3.49Å; D190-G419 VanDerWaalsContact OD1-CA 3.29Å; D190-G419 WeakPolarHBondContact OD1-CA 3.43Å; D190-G419 PolarHBondContact OD1-N 3.16Å; S417-G419 VanDerWaalsContact C-N 3.27Å; S417-G419 PolarHBondContact O-N 3.44Å; G419-L421 VanDerWaalsContact C-N 3.27Å; G419-L421 PolarHBondContact O-N 3.2Å; G419-V422 PolarHBondContact O-N 2.86Å; G419-S423 PolarHBondContact O-N 3.23Å; G419-S423 PolarHBondContact O-OG 3.3Å
420	N	84.8	Confident	85.5	Confident	73 Å²	73	48.3 Å²	48.3	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-34.4	174.4	-76.3	-8.6	0	0	0	111.8	V416 S417 F424	V416-N420 HydrophobicContact CG1-CB 3.6Å; S417-N420 PolarHBondContact O-N 2.95Å; S417-N420 WeakPolarHBondContact OG-CB 3.41Å; S417-N420 VanDerWaalsContact OG-CG 3.3Å; S417-N420 PolarHBondContact OG-N 2.96Å; S417-N420 VanDerWaalsContact OG-N 3.08Å; N420-F424 VanDerWaalsContact O-CB 3.25Å; N420-F424 WeakPolarHBondContact O-CB 3.26Å; N420-F424 PolarHBondContact O-N 2.93Å
421	L	86.3	Confident	85.8	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.099	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-43.3	172.8	-179.4	63.5	0	0	0	111.5	L304 V411 S417 S418 G419 F424 V425	L304-L421 HydrophobicContact CD1-CD1 4.29Å; V411-L421 HydrophobicContact CG2-CB 4.02Å; V411-L421 HydrophobicContact CG2-CD2 3.63Å; V411-L421 HydrophobicContact CG2-CG 4.38Å; S417-L421 PolarHBondContact O-N 3.33Å; S418-L421 WeakPolarHBondContact O-CB 3.48Å; S418-L421 PolarHBondContact O-N 2.94Å; G419-L421 VanDerWaalsContact C-N 3.27Å; G419-L421 PolarHBondContact O-N 3.2Å; L421-F424 PolarHBondContact O-N 3.47Å; L421-V425 HydrophobicContact CD1-CG2 4.36Å; L421-V425 WeakPolarHBondContact O-CG2 3.37Å; L421-V425 PolarHBondContact O-N 3.4Å
422	V	88.9	Confident	85.7	Confident	50 Å²	50	46.7 Å²	46.7	30%	0.303	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-48.4	175.6	170.6	0	0	0	0	111.3	T185 T189 S418 G419 F424 V425 L426	T185-V422 HydrophobicContact CG2-CG1 4.15Å; T189-V422 HydrophobicContact CG2-CG2 4.18Å; S418-V422 WeakPolarHBondContact O-CG2 3.36Å; S418-V422 PolarHBondContact O-N 2.66Å; G419-V422 PolarHBondContact O-N 2.86Å; V422-F424 VanDerWaalsContact C-N 3.28Å; V422-F424 PolarHBondContact O-N 3.48Å; V422-V425 PolarHBondContact O-N 3.02Å; V422-L426 HydrophobicContact CG1-CD1 4.11Å; V422-L426 WeakPolarHBondContact O-CG 3.44Å; V422-L426 PolarHBondContact O-N 3.35Å
423	S	88.7	Confident	85.7	Confident	9 Å²	9	47.9 Å²	47.9	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-56.6	-44	174.2	-65.8	0	0	0	0	111.5	P182 G186 G419 L426 Y427	P182-S423 WeakPolarHBondContact O-CB 3.49Å; P182-S423 PolarHBondContact O-OG 3.06Å; G186-S423 VanDerWaalsContact CA-OG 3.29Å; G186-S423 WeakPolarHBondContact CA-OG 3.48Å; G186-S423 PolarHBondContact N-OG 3.03Å; G419-S423 PolarHBondContact O-N 3.23Å; G419-S423 PolarHBondContact O-OG 3.3Å; S423-L426 PolarHBondContact O-N 3.01Å; S423-Y427 WeakPolarHBondContact O-CD2 3.13Å; S423-Y427 PolarHBondContact O-N 3.08Å
424	F	88.8	Confident	85.9	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-46.6	179.2	-174.2	-86.3	0	0	0	112.4	M297 L304 T308 I403 N420 L421 V422 L426 Y427 Q428	M297-F424 HydrophobicContact CB-CE2 4.24Å; M297-F424 HydrophobicContact CE-CE1 4.33Å; M297-F424 HydrophobicContact CE-CE2 3.86Å; M297-F424 HydrophobicContact CE-CZ 3.57Å; M297-F424 HydrophobicContact CG-CE2 4.39Å; L304-F424 HydrophobicContact CB-CD1 4Å; L304-F424 HydrophobicContact CB-CD2 4Å; L304-F424 HydrophobicContact CB-CE1 3.5Å; L304-F424 VanDerWaalsContact CB-CE1 3.5Å; L304-F424 HydrophobicContact CB-CE2 3.48Å; L304-F424 VanDerWaalsContact CB-CE2 3.48Å; L304-F424 HydrophobicContact CB-CG 4.25Å; L304-F424 HydrophobicContact CB-CZ 3.22Å; L304-F424 HydrophobicContact CD1-CD1 3.94Å; L304-F424 HydrophobicContact CD1-CD2 4.29Å; L304-F424 HydrophobicContact CD1-CE1 4.28Å; L304-F424 HydrophobicContact CD1-CG 3.97Å; L304-F424 HydrophobicContact CG-CE1 4.41Å; L304-F424 HydrophobicContact CG-CZ 4.49Å; L304-F424 WeakPolarHBondContact O-CZ 3.21Å; T308-F424 HydrophobicContact CG2-CE1 3.75Å; T308-F424 HydrophobicContact CG2-CZ 3.66Å; I403-F424 HydrophobicContact CG2-CD1 4.47Å; I403-F424 HydrophobicContact CG2-CE1 4.26Å; N420-F424 VanDerWaalsContact O-CB 3.25Å; N420-F424 WeakPolarHBondContact O-CB 3.26Å; N420-F424 PolarHBondContact O-N 2.93Å; L421-F424 PolarHBondContact O-N 3.47Å; V422-F424 VanDerWaalsContact C-N 3.28Å; V422-F424 PolarHBondContact O-N 3.48Å; F424-L426 VanDerWaalsContact C-N 3.32Å; F424-L426 PolarHBondContact O-N 3.36Å; F424-Y427 PolarHBondContact O-N 3.41Å; F424-Q428 HydrophobicContact CE1-CB 4.31Å; F424-Q428 VanDerWaalsContact O-CB 3.26Å; F424-Q428 WeakPolarHBondContact O-CB 3.38Å; F424-Q428 PolarHBondContact O-N 3.33Å
425	V	87.9	Confident	86.3	Confident	54 Å²	54	37.2 Å²	37.2	33%	0.327	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-40.9	178.5	170.3	0	0	0	0	111.1	L421 V422 Q428 L429	L421-V425 HydrophobicContact CD1-CG2 4.36Å; L421-V425 WeakPolarHBondContact O-CG2 3.37Å; L421-V425 PolarHBondContact O-N 3.4Å; V422-V425 PolarHBondContact O-N 3.02Å; V425-Q428 PolarHBondContact O-N 2.84Å; V425-L429 WeakPolarHBondContact O-CB 3.46Å; V425-L429 PolarHBondContact O-N 2.98Å
426	L	89.9	Confident	86.6	Confident	55 Å²	55	37.6 Å²	37.6	29%	0.288	20%	0.196	S	C	.	.	H	α-helix	trans	-65.6	-45.6	176.5	-71.5	175.5	0	0	0	112	P182 T185 V422 S423 F424 Q428 L429 Q430	P182-L426 HydrophobicContact CB-CB 3.75Å; P182-L426 HydrophobicContact CB-CD1 4.21Å; P182-L426 HydrophobicContact CG-CB 4.14Å; T185-L426 HydrophobicContact CG2-CD1 3.9Å; V422-L426 HydrophobicContact CG1-CD1 4.11Å; V422-L426 WeakPolarHBondContact O-CG 3.44Å; V422-L426 PolarHBondContact O-N 3.35Å; S423-L426 PolarHBondContact O-N 3.01Å; F424-L426 VanDerWaalsContact C-N 3.32Å; F424-L426 PolarHBondContact O-N 3.36Å; L426-Q428 PolarHBondContact O-N 2.95Å; L426-L429 PolarHBondContact O-N 2.79Å; L426-Q430 WeakPolarHBondContact O-CG 3.46Å; L426-Q430 PolarHBondContact O-N 2.94Å; L426-Q430 VanDerWaalsContact O-N 3.12Å
427	Y	90.3	Very high	86.9	Confident	10 Å²	10	38.5 Å²	38.5	4%	0.039	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-44.3	175.3	-73.7	-47.5	0	0	0	112	M179 P182 F183 L293 F296 S423 F424 L429 Q430 F431	M179-Y427 HydrophobicContact CB-CE1 4.19Å; M179-Y427 WeakPolarHBondContact O-CE1 3.46Å; M179-Y427 PolarHBondContact O-OH 2.85Å; M179-Y427 HydrophobicContact SD-CD1 4.31Å; M179-Y427 HydrophobicContact SD-CE1 4.14Å; P182-Y427 HydrophobicContact CB-CD1 3.73Å; P182-Y427 HydrophobicContact CB-CD2 4.31Å; P182-Y427 HydrophobicContact CB-CE1 3.51Å; P182-Y427 HydrophobicContact CB-CE2 4.1Å; P182-Y427 HydrophobicContact CB-CG 4.14Å; P182-Y427 HydrophobicContact CG-CD1 3.72Å; P182-Y427 HydrophobicContact CG-CE1 3.57Å; F183-Y427 WeakPolarHBondContact CB-OH 3.4Å; F183-Y427 PolarHBondContact N-OH 2.84Å; L293-Y427 HydrophobicContact CD2-CD1 3.59Å; L293-Y427 HydrophobicContact CD2-CE1 4.43Å; L293-Y427 HydrophobicContact CD2-CG 4.34Å; F296-Y427 HydrophobicContact CB-CD2 4.44Å; F296-Y427 HydrophobicContact CB-CE1 4.26Å; F296-Y427 HydrophobicContact CB-CE2 4.08Å; S423-Y427 WeakPolarHBondContact O-CD2 3.13Å; S423-Y427 PolarHBondContact O-N 3.08Å; F424-Y427 PolarHBondContact O-N 3.41Å; Y427-L429 PolarHBondContact O-N 3.37Å; Y427-Q430 PolarHBondContact O-N 2.84Å; Y427-F431 VanDerWaalsContact O-CB 3.26Å; Y427-F431 WeakPolarHBondContact O-CB 3.46Å; Y427-F431 PolarHBondContact O-N 3.01Å
428	Q	87.3	Confident	87	Confident	9 Å²	9	38.9 Å²	38.9	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-42	177.4	-177.6	-144.8	-29	0	0	112.2	M297 T308 I403 F424 V425 L426 Q430 F431 T432	M297-Q428 HydrophobicContact CE-CB 4.02Å; M297-Q428 HydrophobicContact CE-CG 4.32Å; T308-Q428 HydrophobicContact CG2-CB 4.47Å; T308-Q428 HydrophobicContact CG2-CG 3.63Å; I403-Q428 HydrophobicContact CD1-CG 4.33Å; F424-Q428 HydrophobicContact CE1-CB 4.31Å; F424-Q428 VanDerWaalsContact O-CB 3.26Å; F424-Q428 WeakPolarHBondContact O-CB 3.38Å; F424-Q428 PolarHBondContact O-N 3.33Å; V425-Q428 PolarHBondContact O-N 2.84Å; L426-Q428 PolarHBondContact O-N 2.95Å; Q428-Q430 VanDerWaalsContact C-N 3.33Å; Q428-Q430 PolarHBondContact O-N 3.42Å; Q428-F431 PolarHBondContact O-N 3.48Å; Q428-T432 WeakPolarHBondContact O-CB 3.47Å; Q428-T432 PolarHBondContact O-N 3.04Å; Q428-T432 PolarHBondContact O-OG1 3.44Å
429	L	86.4	Confident	86.9	Confident	59 Å²	59	41.2 Å²	41.2	31%	0.309	21%	0.209	S	C	.	.	H	α-helix	trans	-60.9	-45.5	177.9	-176.3	70.4	0	0	0	110.8	V425 L426 Y427 R433	V425-L429 WeakPolarHBondContact O-CB 3.46Å; V425-L429 PolarHBondContact O-N 2.98Å; L426-L429 PolarHBondContact O-N 2.79Å; Y427-L429 PolarHBondContact O-N 3.37Å; L429-R433 PolarHBondContact O-N 2.94Å
430	Q	89.8	Confident	86.8	Confident	41 Å²	41	44.7 Å²	44.7	19%	0.192	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-39.2	176.5	-66.9	-170.9	18.5	0	0	112	L293 L426 Y427 Q428 R433 A434	L293-Q430 HydrophobicContact CD1-CB 3.94Å; L293-Q430 HydrophobicContact CD2-CB 4.02Å; L426-Q430 WeakPolarHBondContact O-CG 3.46Å; L426-Q430 PolarHBondContact O-N 2.94Å; L426-Q430 VanDerWaalsContact O-N 3.12Å; Y427-Q430 PolarHBondContact O-N 2.84Å; Q428-Q430 VanDerWaalsContact C-N 3.33Å; Q428-Q430 PolarHBondContact O-N 3.42Å; Q430-R433 PolarHBondContact O-N 3.36Å; Q430-A434 WeakPolarHBondContact O-CB 3.24Å; Q430-A434 PolarHBondContact O-N 3.25Å
431	F	88.9	Confident	86.8	Confident	16 Å²	16	41.5 Å²	41.5	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-42	179	-179.6	-103.4	0	0	0	111.9	L293 L294 M297 L312 Y427 Q428 R433 A434 V435	L293-F431 HydrophobicContact CB-CB 4.27Å; L293-F431 HydrophobicContact CB-CD2 3.97Å; L293-F431 HydrophobicContact CD1-CB 4.18Å; L294-F431 HydrophobicContact CB-CE2 4.09Å; L294-F431 HydrophobicContact CD1-CE2 4.17Å; L294-F431 HydrophobicContact CD1-CZ 4.04Å; M297-F431 HydrophobicContact SD-CB 3.91Å; M297-F431 HydrophobicContact SD-CD1 4.3Å; M297-F431 HydrophobicContact SD-CG 4.04Å; L312-F431 HydrophobicContact CD1-CE1 3.78Å; L312-F431 HydrophobicContact CD1-CZ 4.44Å; L312-F431 HydrophobicContact CD2-CE1 4.45Å; Y427-F431 VanDerWaalsContact O-CB 3.26Å; Y427-F431 WeakPolarHBondContact O-CB 3.46Å; Y427-F431 PolarHBondContact O-N 3.01Å; Q428-F431 PolarHBondContact O-N 3.48Å; F431-R433 VanDerWaalsContact C-N 3.32Å; F431-R433 PolarHBondContact O-N 3.07Å; F431-A434 PolarHBondContact O-N 3.18Å; F431-V435 HydrophobicContact CD1-CG2 4.25Å; F431-V435 HydrophobicContact CD2-CG2 4.4Å; F431-V435 HydrophobicContact CE1-CG2 3.82Å; F431-V435 HydrophobicContact CE2-CG2 3.98Å; F431-V435 HydrophobicContact CZ-CG2 3.67Å; F431-V435 WeakPolarHBondContact O-CG2 3.4Å; F431-V435 PolarHBondContact O-N 3.28Å
432	T	84.5	Confident	86.3	Confident	21 Å²	21	46.4 Å²	46.4	13%	0.129	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-44.5	177	-51.8	0	0	0	0	110.7	L315 Q428 V435 E436	L315-T432 HydrophobicContact CD1-CG2 3.89Å; L315-T432 HydrophobicContact CD2-CG2 4.45Å; Q428-T432 WeakPolarHBondContact O-CB 3.47Å; Q428-T432 PolarHBondContact O-N 3.04Å; Q428-T432 PolarHBondContact O-OG1 3.44Å; T432-V435 PolarHBondContact O-N 3.14Å; T432-E436 WeakPolarHBondContact O-CB 3.38Å; T432-E436 PolarHBondContact O-N 3.49Å
433	R	86.2	Confident	85.7	Confident	159 Å²	159	47 Å²	47	60%	0.6	24%	0.239	S	C	*	.	H	α-helix	trans	-63.2	-43.3	174	-72.7	-176.2	179.6	170.9	-0.2	112.4	L429 Q430 F431 V435 E436 V437	L429-R433 PolarHBondContact O-N 2.94Å; Q430-R433 PolarHBondContact O-N 3.36Å; F431-R433 VanDerWaalsContact C-N 3.32Å; F431-R433 PolarHBondContact O-N 3.07Å; R433-V435 VanDerWaalsContact C-N 3.34Å; R433-V435 PolarHBondContact O-N 3.49Å; R433-E436 WeakPolarHBondContact O-CB 3.17Å; R433-E436 PolarHBondContact O-N 3.01Å; R433-V437 WeakPolarHBondContact O-CG2 3.35Å; R433-V437 PolarHBondContact O-N 3.04Å
434	A	88.9	Confident	85.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-43.5	179.1	0	0	0	0	0	111.9	Y286 L293 Q430 F431 L438	Y286-A434 HydrophobicContact CD1-CB 3.85Å; L293-A434 HydrophobicContact CD1-CB 4.41Å; Q430-A434 WeakPolarHBondContact O-CB 3.24Å; Q430-A434 PolarHBondContact O-N 3.25Å; F431-A434 PolarHBondContact O-N 3.18Å; A434-L438 WeakPolarHBondContact O-CB 3.13Å; A434-L438 PolarHBondContact O-N 3.38Å
435	V	85.5	Confident	84.7	Confident	30 Å²	30	49.4 Å²	49.4	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-41.1	175.5	176.4	0	0	0	0	111.3	F316 F431 T432 R433 L438 L439	F316-V435 HydrophobicContact CE2-CB 4.43Å; F316-V435 HydrophobicContact CE2-CG1 3.54Å; F316-V435 HydrophobicContact CZ-CB 4.25Å; F316-V435 HydrophobicContact CZ-CG1 3.67Å; F431-V435 HydrophobicContact CD1-CG2 4.25Å; F431-V435 HydrophobicContact CD2-CG2 4.4Å; F431-V435 HydrophobicContact CE1-CG2 3.82Å; F431-V435 HydrophobicContact CE2-CG2 3.98Å; F431-V435 HydrophobicContact CZ-CG2 3.67Å; F431-V435 WeakPolarHBondContact O-CG2 3.4Å; F431-V435 PolarHBondContact O-N 3.28Å; T432-V435 PolarHBondContact O-N 3.14Å; R433-V435 VanDerWaalsContact C-N 3.34Å; R433-V435 PolarHBondContact O-N 3.49Å; V435-L438 PolarHBondContact O-N 3.14Å; V435-L439 HydrophobicContact CG1-CD1 3.92Å; V435-L439 HydrophobicContact CG1-CG 4.25Å; V435-L439 WeakPolarHBondContact O-CB 3.25Å; V435-L439 VanDerWaalsContact O-CG 3.27Å; V435-L439 WeakPolarHBondContact O-CG 3.31Å; V435-L439 PolarHBondContact O-N 3.39Å
436	E	83.5	Confident	84.1	Confident	82 Å²	82	52.1 Å²	52.1	38%	0.383	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-48.5	176.8	-179.8	179.8	-174.2	0	0	111.9	F316 M392 T432 R433 L439 S440	F316-E436 HydrophobicContact CE1-CB 4.22Å; F316-E436 HydrophobicContact CZ-CB 4.45Å; M392-E436 VanDerWaalsContact CE-CD 3.41Å; M392-E436 HydrophobicContact CE-CG 3.84Å; M392-E436 VanDerWaalsContact CE-OE1 3.27Å; M392-E436 WeakPolarHBondContact CE-OE1 3.26Å; T432-E436 WeakPolarHBondContact O-CB 3.38Å; T432-E436 PolarHBondContact O-N 3.49Å; R433-E436 WeakPolarHBondContact O-CB 3.17Å; R433-E436 PolarHBondContact O-N 3.01Å; E436-L439 PolarHBondContact O-N 3.3Å; E436-S440 PolarHBondContact O-N 3.45Å
437	V	87.1	Confident	83.6	Confident	38 Å²	38	57.1 Å²	57.1	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-43.4	175.9	177.4	0	0	0	0	110.8	Y286 R433 L439 S440 I441	Y286-V437 HydrophobicContact CD1-CB 4.35Å; Y286-V437 HydrophobicContact CD2-CB 4.1Å; Y286-V437 HydrophobicContact CD2-CG1 3.48Å; Y286-V437 VanDerWaalsContact CD2-CG1 3.48Å; Y286-V437 HydrophobicContact CE1-CB 4.38Å; Y286-V437 HydrophobicContact CE1-CG2 4.3Å; Y286-V437 HydrophobicContact CE2-CB 4.19Å; Y286-V437 HydrophobicContact CE2-CG1 3.57Å; Y286-V437 HydrophobicContact CE2-CG2 4.38Å; Y286-V437 HydrophobicContact CG-CB 4.18Å; Y286-V437 HydrophobicContact CG-CG1 4.03Å; R433-V437 WeakPolarHBondContact O-CG2 3.35Å; R433-V437 PolarHBondContact O-N 3.04Å; V437-L439 VanDerWaalsContact C-N 3.26Å; V437-L439 PolarHBondContact O-N 3.27Å; V437-S440 PolarHBondContact O-N 3.47Å; V437-S440 VanDerWaalsContact O-N 3.13Å; V437-S440 PolarHBondContact O-OG 3.32Å; V437-I441 HydrophobicContact CG1-CD1 4.18Å; V437-I441 VanDerWaalsContact O-CG1 3.31Å; V437-I441 WeakPolarHBondContact O-CG1 3.29Å; V437-I441 PolarHBondContact O-N 3.06Å; V437-I441 VanDerWaalsContact O-N 3.11Å
438	L	85.8	Confident	83.2	Confident	47 Å²	47	57.1 Å²	57.1	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-37.3	178.6	-164	68.3	0	0	0	112.4	F283 L287 A434 V435	F283-L438 HydrophobicContact CD2-CD1 3.4Å; F283-L438 VanDerWaalsContact CD2-CD1 3.4Å; F283-L438 HydrophobicContact CE2-CD1 3.67Å; F283-L438 HydrophobicContact CG-CD1 4.3Å; L287-L438 HydrophobicContact CB-CD1 4.5Å; L287-L438 HydrophobicContact CD1-CD2 4.31Å; A434-L438 WeakPolarHBondContact O-CB 3.13Å; A434-L438 PolarHBondContact O-N 3.38Å; V435-L438 PolarHBondContact O-N 3.14Å
439	L	82	Confident	82.9	Confident	89 Å²	89	56.9 Å²	56.9	47%	0.466	28%	0.283	S	S	.	.	H	α-helix	trans	-71.6	-32.3	176.6	-72	173.7	0	0	0	112.9	F316 V435 E436 V437 I441 P443	F316-L439 HydrophobicContact CB-CD1 4.46Å; F316-L439 HydrophobicContact CD1-CD1 3.58Å; F316-L439 HydrophobicContact CD2-CD1 3.69Å; F316-L439 HydrophobicContact CE1-CD1 3.59Å; F316-L439 HydrophobicContact CE2-CD1 3.71Å; F316-L439 HydrophobicContact CG-CD1 3.64Å; F316-L439 HydrophobicContact CZ-CD1 3.66Å; V435-L439 HydrophobicContact CG1-CD1 3.92Å; V435-L439 HydrophobicContact CG1-CG 4.25Å; V435-L439 WeakPolarHBondContact O-CB 3.25Å; V435-L439 VanDerWaalsContact O-CG 3.27Å; V435-L439 WeakPolarHBondContact O-CG 3.31Å; V435-L439 PolarHBondContact O-N 3.39Å; E436-L439 PolarHBondContact O-N 3.3Å; V437-L439 VanDerWaalsContact C-N 3.26Å; V437-L439 PolarHBondContact O-N 3.27Å; L439-I441 VanDerWaalsContact C-N 3.35Å; L439-P443 WeakPolarHBondContact O-CD 3.02Å
440	S	80.8	Confident	82.5	Confident	73 Å²	73	56 Å²	56	51%	0.51	29%	0.288	S	S	.	.	H	α-helix	trans	-76	-22.8	177.8	76.2	0	0	0	0	113.1	E436 V437 Y442 P443	E436-S440 PolarHBondContact O-N 3.45Å; V437-S440 PolarHBondContact O-N 3.47Å; V437-S440 VanDerWaalsContact O-N 3.13Å; V437-S440 PolarHBondContact O-OG 3.32Å; S440-Y442 VanDerWaalsContact C-N 3.34Å; S440-Y442 PolarHBondContact O-N 3.38Å; S440-P443 WeakPolarHBondContact O-CD 3.25Å
441	I	84.4	Confident	81.9	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-36.1	176.1	-69.6	165.8	0	0	0	111.7	K279 L282 F283 V437 L439 S444 M445	K279-I441 HydrophobicContact CB-CG2 4.18Å; L282-I441 HydrophobicContact CB-CD1 3.76Å; L282-I441 HydrophobicContact CB-CG1 4.5Å; F283-I441 HydrophobicContact CB-CD1 4.18Å; F283-I441 HydrophobicContact CB-CG2 4.39Å; V437-I441 HydrophobicContact CG1-CD1 4.18Å; V437-I441 VanDerWaalsContact O-CG1 3.31Å; V437-I441 WeakPolarHBondContact O-CG1 3.29Å; V437-I441 PolarHBondContact O-N 3.06Å; V437-I441 VanDerWaalsContact O-N 3.11Å; L439-I441 VanDerWaalsContact C-N 3.35Å; I441-S444 PolarHBondContact O-N 3.1Å; I441-M445 HydrophobicContact CG2-CB 4.44Å; I441-M445 HydrophobicContact CG2-CE 4.28Å; I441-M445 WeakPolarHBondContact O-CB 3.47Å; I441-M445 PolarHBondContact O-N 3.44Å
442	Y	76.4	Confident	81.7	Confident	121 Å²	121	55.6 Å²	55.6	48%	0.475	29%	0.294	S	S	.	.	H	α-helix	trans	-58.8	-54.1	-172	174.5	-91	0	0	0	114.1	F137 S440 S444 M445 Q446	F137-Y442 AromaticContact CE1-CD2 3.88Å; F137-Y442 HydrophobicContact CE1-CD2 3.88Å; F137-Y442 HydrophobicContact CE1-CE2 4.18Å; F137-Y442 AromaticContact CZ-CD2 3.95Å; F137-Y442 HydrophobicContact CZ-CD2 3.95Å; F137-Y442 HydrophobicContact CZ-CE2 4.2Å; S440-Y442 VanDerWaalsContact C-N 3.34Å; S440-Y442 PolarHBondContact O-N 3.38Å; Y442-S444 VanDerWaalsContact C-N 3.27Å; Y442-S444 PolarHBondContact O-N 2.88Å; Y442-M445 PolarHBondContact O-N 3.39Å; Y442-Q446 PolarHBondContact O-N 2.89Å
443	P	75.9	Confident	81.5	Confident	64 Å²	64	59.2 Å²	59.2	42%	0.416	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-36.5	178	-21.6	33.4	0	0	0	112.6	L439 S440 K447	L439-P443 WeakPolarHBondContact O-CD 3.02Å; S440-P443 WeakPolarHBondContact O-CD 3.25Å; P443-K447 WeakPolarHBondContact O-CB 3.32Å; P443-K447 PolarHBondContact O-N 2.67Å
444	S	76.9	Confident	81.1	Confident	37 Å²	37	57.2 Å²	57.2	26%	0.259	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-44.3	178.5	-168.7	0	0	0	0	111.6	K279 I441 Y442 Q446 K447 S448	K279-S444 VanDerWaalsContact CE-OG 3.24Å; K279-S444 WeakPolarHBondContact CE-OG 3.41Å; I441-S444 PolarHBondContact O-N 3.1Å; Y442-S444 VanDerWaalsContact C-N 3.27Å; Y442-S444 PolarHBondContact O-N 2.88Å; S444-Q446 VanDerWaalsContact C-N 3.34Å; S444-K447 WeakPolarHBondContact O-CB 3.31Å; S444-K447 PolarHBondContact O-N 2.88Å; S444-S448 PolarHBondContact O-N 3.29Å; S444-S448 PolarHBondContact O-OG 3.45Å; S444-S448 VanDerWaalsContact O-OG 3.1Å
445	M	79.9	Confident	80.9	Confident	25 Å²	25	57.7 Å²	57.7	12%	0.123	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-42.9	177.8	-166.4	70.8	87.5	0	0	110.5	L150 K279 L280 I441 Y442 K447 S448 V449	L150-M445 HydrophobicContact CD1-CG 4.35Å; L150-M445 HydrophobicContact CD2-SD 4.29Å; K279-M445 HydrophobicContact CB-CE 3.63Å; K279-M445 HydrophobicContact CB-SD 4.05Å; L280-M445 HydrophobicContact CB-CE 4.4Å; I441-M445 HydrophobicContact CG2-CB 4.44Å; I441-M445 HydrophobicContact CG2-CE 4.28Å; I441-M445 WeakPolarHBondContact O-CB 3.47Å; I441-M445 PolarHBondContact O-N 3.44Å; Y442-M445 PolarHBondContact O-N 3.39Å; M445-K447 VanDerWaalsContact C-N 3.31Å; M445-K447 PolarHBondContact O-N 3.48Å; M445-S448 PolarHBondContact O-N 2.94Å; M445-V449 VanDerWaalsContact O-CG2 3.27Å; M445-V449 WeakPolarHBondContact O-CG2 3.5Å; M445-V449 PolarHBondContact O-N 3.13Å
446	Q	76.4	Confident	80.8	Confident	111 Å²	111	56.8 Å²	56.8	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-61.3	-40.1	175.8	-171.8	175.8	6.2	0	0	112	Y442 S444 V449 G450	Y442-Q446 PolarHBondContact O-N 2.89Å; S444-Q446 VanDerWaalsContact C-N 3.34Å; Q446-V449 PolarHBondContact O-N 3.35Å; Q446-G450 PolarHBondContact O-N 3.11Å
447	K	79	Confident	80.8	Confident	161 Å²	161	58.8 Å²	58.8	70%	0.7	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-45.9	174.6	-175.3	-177.6	176.9	-175	0	111.6	P443 S444 M445 V449 G450 A451	P443-K447 WeakPolarHBondContact O-CB 3.32Å; P443-K447 PolarHBondContact O-N 2.67Å; S444-K447 WeakPolarHBondContact O-CB 3.31Å; S444-K447 PolarHBondContact O-N 2.88Å; M445-K447 VanDerWaalsContact C-N 3.31Å; M445-K447 PolarHBondContact O-N 3.48Å; K447-V449 VanDerWaalsContact C-N 3.33Å; K447-V449 PolarHBondContact O-N 2.86Å; K447-G450 PolarHBondContact O-N 3.31Å; K447-A451 PolarHBondContact O-N 2.93Å
448	S	82.3	Confident	80.5	Confident	9 Å²	9	58 Å²	58	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-36.8	179	-58.5	0	0	0	0	112.5	S275 S444 M445 A451 S452	S275-S448 VanDerWaalsContact CB-OG 3.22Å; S275-S448 WeakPolarHBondContact CB-OG 3.16Å; S444-S448 PolarHBondContact O-N 3.29Å; S444-S448 PolarHBondContact O-OG 3.45Å; S444-S448 VanDerWaalsContact O-OG 3.1Å; M445-S448 PolarHBondContact O-N 2.94Å; S448-A451 PolarHBondContact O-N 3.49Å; S448-S452 PolarHBondContact O-N 3.05Å
449	V	80.6	Confident	80.5	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.03	30%	0.302	C	S	.	.	H	α-helix	trans	-70.1	-39.3	175.2	177	0	0	0	0	112	A146 M149 L150 M445 Q446 K447 A451 S452 E453	A146-V449 VanDerWaalsContact CA-CG1 3.49Å; A146-V449 HydrophobicContact CB-CB 4.26Å; A146-V449 HydrophobicContact CB-CG1 3.6Å; M149-V449 HydrophobicContact CB-CG1 3.83Å; M149-V449 HydrophobicContact CG-CG1 4.33Å; M149-V449 HydrophobicContact SD-CG1 3.66Å; L150-V449 HydrophobicContact CD1-CG2 4.07Å; L150-V449 HydrophobicContact CD2-CG2 3.88Å; L150-V449 HydrophobicContact CG-CG2 3.72Å; M445-V449 VanDerWaalsContact O-CG2 3.27Å; M445-V449 WeakPolarHBondContact O-CG2 3.5Å; M445-V449 PolarHBondContact O-N 3.13Å; Q446-V449 PolarHBondContact O-N 3.35Å; K447-V449 VanDerWaalsContact C-N 3.33Å; K447-V449 PolarHBondContact O-N 2.86Å; V449-A451 VanDerWaalsContact C-N 3.25Å; V449-A451 PolarHBondContact O-N 3.25Å; V449-S452 PolarHBondContact O-N 3.32Å; V449-S452 VanDerWaalsContact O-N 3.16Å; V449-S452 PolarHBondContact O-OG 3.34Å; V449-E453 PolarHBondContact O-N 2.93Å; V449-E453 VanDerWaalsContact O-N 3.16Å
450	G	77.5	Confident	80.8	Confident	41 Å²	41	56.3 Å²	56.3	42%	0.423	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-32.2	172.5	0	0	0	0	0	113.1	Q446 K447	Q446-G450 PolarHBondContact O-N 3.11Å; K447-G450 PolarHBondContact O-N 3.31Å
451	A	78.3	Confident	81	Confident	46 Å²	46	57.4 Å²	57.4	38%	0.38	29%	0.288	S	S	.	.	H	α-helix	trans	-73.1	-34.9	173.1	0	0	0	0	0	112.4	V272 K447 S448 V449 E453 K454	V272-A451 HydrophobicContact CG2-CB 3.64Å; K447-A451 PolarHBondContact O-N 2.93Å; S448-A451 PolarHBondContact O-N 3.49Å; V449-A451 VanDerWaalsContact C-N 3.25Å; V449-A451 PolarHBondContact O-N 3.25Å; A451-E453 VanDerWaalsContact C-N 3.28Å; A451-E453 PolarHBondContact O-N 3.29Å; A451-K454 PolarHBondContact O-N 3Å
452	S	83.4	Confident	80.8	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-25.1	178	79.6	0	0	0	0	113.4	V272 S448 V449 K454 I455 F456	V272-S452 VanDerWaalsContact CG1-CB 3.47Å; S448-S452 PolarHBondContact O-N 3.05Å; V449-S452 PolarHBondContact O-N 3.32Å; V449-S452 VanDerWaalsContact O-N 3.16Å; V449-S452 PolarHBondContact O-OG 3.34Å; S452-K454 PolarHBondContact O-N 2.92Å; S452-I455 WeakPolarHBondContact O-CB 3.36Å; S452-I455 PolarHBondContact O-N 3.21Å; S452-F456 WeakPolarHBondContact O-CD2 3.46Å; S452-F456 PolarHBondContact O-N 2.91Å
453	E	81.8	Confident	80.9	Confident	97 Å²	97	58.7 Å²	58.7	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-52.2	-42.3	176.1	-176.4	166.1	-157.9	0	0	112.2	M149 V449 A451 F456 E457	M149-E453 HydrophobicContact CE-CB 3.56Å; M149-E453 HydrophobicContact CE-CG 3.48Å; M149-E453 VanDerWaalsContact CE-CG 3.48Å; M149-E453 HydrophobicContact SD-CB 3.93Å; V449-E453 PolarHBondContact O-N 2.93Å; V449-E453 VanDerWaalsContact O-N 3.16Å; A451-E453 VanDerWaalsContact C-N 3.28Å; A451-E453 PolarHBondContact O-N 3.29Å; E453-F456 CarbonylContact O-C 3.49Å; E453-F456 PolarHBondContact O-N 3.33Å; E453-E457 PolarHBondContact O-N 3.34Å
454	K	76.3	Confident	80.4	Confident	117 Å²	117	61 Å²	61	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-39.8	177.4	-66	-178.5	-177.3	176	0	112	A451 S452 F456 E457 Y458	A451-K454 PolarHBondContact O-N 3Å; S452-K454 PolarHBondContact O-N 2.92Å; K454-F456 VanDerWaalsContact C-N 3.3Å; K454-F456 PolarHBondContact O-N 2.84Å; K454-E457 WeakPolarHBondContact O-CB 3.38Å; K454-E457 PolarHBondContact O-N 3.24Å; K454-E457 VanDerWaalsContact O-N 3.14Å; K454-Y458 WeakPolarHBondContact O-CD2 3.43Å; K454-Y458 PolarHBondContact O-N 3.37Å; K454-Y458 VanDerWaalsContact O-N 3.17Å
455	I	84.3	Confident	79.6	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.062	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-41.9	176.7	-59.6	166.5	0	0	0	109.9	V241 T269 V272 S452 E457 Y458 L459	V241-I455 HydrophobicContact CG1-CG2 4.41Å; V241-I455 HydrophobicContact CG2-CG2 3.49Å; V241-I455 VanDerWaalsContact CG2-CG2 3.49Å; T269-I455 HydrophobicContact CG2-CD1 4.45Å; V272-I455 HydrophobicContact CB-CD1 3.78Å; V272-I455 HydrophobicContact CG1-CD1 3.98Å; V272-I455 HydrophobicContact CG2-CD1 3.81Å; S452-I455 WeakPolarHBondContact O-CB 3.36Å; S452-I455 PolarHBondContact O-N 3.21Å; I455-E457 VanDerWaalsContact C-N 3.29Å; I455-E457 PolarHBondContact O-N 3.32Å; I455-Y458 WeakPolarHBondContact O-CB 3.23Å; I455-Y458 PolarHBondContact O-N 3.04Å; I455-L459 HydrophobicContact CG2-CD1 4.36Å; I455-L459 PolarHBondContact O-N 3.35Å
456	F	83.4	Confident	78.6	Confident	10 Å²	10	63.6 Å²	63.6	4%	0.044	35%	0.345	C	S	.	.	H	α-helix	trans	-68	-28.4	174	-78.7	-67.6	0	0	0	112.9	M149 R152 M153 F156 S452 E453 K454 Y458 L459 D460	M149-F456 HydrophobicContact CB-CE2 4.42Å; M149-F456 HydrophobicContact CG-CD2 4.49Å; R152-F456 HydrophobicContact CB-CE1 4.02Å; R152-F456 HydrophobicContact CB-CZ 3.89Å; M153-F456 HydrophobicContact CG-CE2 3.54Å; M153-F456 HydrophobicContact CG-CZ 3.46Å; M153-F456 VanDerWaalsContact CG-CZ 3.46Å; M153-F456 HydrophobicContact SD-CE2 4.15Å; F156-F456 HydrophobicContact CE2-CE1 4.14Å; F156-F456 HydrophobicContact CE2-CZ 4.39Å; S452-F456 WeakPolarHBondContact O-CD2 3.46Å; S452-F456 PolarHBondContact O-N 2.91Å; E453-F456 CarbonylContact O-C 3.49Å; E453-F456 PolarHBondContact O-N 3.33Å; K454-F456 VanDerWaalsContact C-N 3.3Å; K454-F456 PolarHBondContact O-N 2.84Å; F456-Y458 VanDerWaalsContact C-N 3.31Å; F456-L459 HydrophobicContact CD1-CD1 3.97Å; F456-L459 HydrophobicContact CE1-CD1 4.13Å; F456-L459 PolarHBondContact O-N 3.45Å; F456-D460 WeakPolarHBondContact O-CB 3.44Å; F456-D460 PolarHBondContact O-N 3.39Å
457	E	83.8	Confident	77.8	Confident	125 Å²	125	62 Å²	62	58%	0.584	34%	0.339	S	S	*	.	H	α-helix	trans	-60	-42.3	169.6	-167.1	-171.5	164.5	0	0	110.8	E453 K454 I455 R461	E453-E457 PolarHBondContact O-N 3.34Å; K454-E457 WeakPolarHBondContact O-CB 3.38Å; K454-E457 PolarHBondContact O-N 3.24Å; K454-E457 VanDerWaalsContact O-N 3.14Å; I455-E457 VanDerWaalsContact C-N 3.29Å; I455-E457 PolarHBondContact O-N 3.32Å; E457-R461 VanDerWaalsContact O-CB 3.23Å; E457-R461 WeakPolarHBondContact O-CB 3.43Å; E457-R461 PolarHBondContact O-N 2.97Å; E457-R461 VanDerWaalsContact O-N 3.09Å
458	Y	82.4	Confident	77.3	Confident	20 Å²	20	56.6 Å²	56.6	8%	0.078	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-42.5	173.4	-77.7	-88.8	0	0	0	113	V245 F252 R264 K454 I455 F456	V245-Y458 HydrophobicContact CG2-CD1 3.85Å; V245-Y458 HydrophobicContact CG2-CE1 4.4Å; F252-Y458 AromaticContact CE1-CE1 3.9Å; F252-Y458 HydrophobicContact CE1-CE1 3.9Å; F252-Y458 HydrophobicContact CE2-CE1 4.15Å; F252-Y458 HydrophobicContact CZ-CD1 4.03Å; F252-Y458 AromaticContact CZ-CE1 3.27Å; F252-Y458 HydrophobicContact CZ-CE1 3.27Å; R264-Y458 WeakPolarHBondContact CD-OH 3.48Å; R264-Y458 PolarHBondContact NH1-OH 3.48Å; K454-Y458 WeakPolarHBondContact O-CD2 3.43Å; K454-Y458 PolarHBondContact O-N 3.37Å; K454-Y458 VanDerWaalsContact O-N 3.17Å; I455-Y458 WeakPolarHBondContact O-CB 3.23Å; I455-Y458 PolarHBondContact O-N 3.04Å; F456-Y458 VanDerWaalsContact C-N 3.31Å
459	L	85.9	Confident	77.3	Confident	41 Å²	41	57.1 Å²	57.1	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-70.3	-37.2	-180	-74.7	168.4	0	0	0	113	F156 E240 V241 A244 I455 F456 R461	F156-L459 HydrophobicContact CZ-CD1 4.45Å; E240-L459 HydrophobicContact CB-CD2 4.21Å; V241-L459 HydrophobicContact CB-CD2 4.48Å; V241-L459 HydrophobicContact CG2-CD1 3.86Å; V241-L459 HydrophobicContact CG2-CD2 3.93Å; V241-L459 HydrophobicContact CG2-CG 3.9Å; A244-L459 HydrophobicContact CB-CD2 3.93Å; I455-L459 HydrophobicContact CG2-CD1 4.36Å; I455-L459 PolarHBondContact O-N 3.35Å; F456-L459 HydrophobicContact CD1-CD1 3.97Å; F456-L459 HydrophobicContact CE1-CD1 4.13Å; F456-L459 PolarHBondContact O-N 3.45Å; L459-R461 VanDerWaalsContact C-N 3.34Å
460	D	86.9	Confident	77.5	Confident	61 Å²	61	62.5 Å²	62.5	33%	0.326	37%	0.367	S	S	.	.	H	α-helix	trans	-83	-15.5	-178.1	-71.8	-5.1	0	0	0	112.3	K144 R152 F456 T462	K144-D460 IonicContact NZ-OD2 2.6Å; K144-D460 PolarHBondContact NZ-OD2 2.99Å; R152-D460 IonicContact CZ-OD1 3.65Å; R152-D460 IonicContact CZ-OD2 3.59Å; R152-D460 IonicContact NH1-OD1 3.89Å; R152-D460 PolarHBondContact NH1-OD1 3.46Å; R152-D460 IonicContact NH1-OD2 3.34Å; R152-D460 PolarHBondContact NH1-OD2 3.4Å; R152-D460 IonicContact NH2-OD1 2.77Å; R152-D460 PolarHBondContact NH2-OD1 2.88Å; R152-D460 IonicContact NH2-OD2 2.75Å; F456-D460 WeakPolarHBondContact O-CB 3.44Å; F456-D460 PolarHBondContact O-N 3.39Å; D460-T462 PolarHBondContact O-N 2.9Å
461	R	85.4	Confident	78.1	Confident	96 Å²	96	63.2 Å²	63.2	36%	0.362	36%	0.361	S	S	.	.			trans	-66.5	110.7	-179.8	-176.2	176	175.1	121.8	0.8	109.4	Q248 E249 E457 L459	Q248-R461 VanDerWaalsContact CD-NE 3.28Å; E249-R461 IonicContact OE1-CZ 2.68Å; E249-R461 IonicContact OE1-NE 3.82Å; E249-R461 IonicContact OE1-NH2 2.81Å; E249-R461 PolarHBondContact OE1-NH2 3.36Å; E457-R461 VanDerWaalsContact O-CB 3.23Å; E457-R461 WeakPolarHBondContact O-CB 3.43Å; E457-R461 PolarHBondContact O-N 2.97Å; E457-R461 VanDerWaalsContact O-N 3.09Å; L459-R461 VanDerWaalsContact C-N 3.34Å
462	T	80.4	Confident	78.6	Confident	115 Å²	115	63.9 Å²	63.9	71%	0.706	37%	0.366	S	S	*	.			trans	-76.8	131.2	167.2	52.9	0	0	0	0	109.1	D460	D460-T462 PolarHBondContact O-N 2.9Å
463	P	77.9	Confident	78.8	Confident	39 Å²	39	65.8 Å²	65.8	25%	0.253	38%	0.379	S	S	.	.			trans	-60.6	141.5	174.8	24.3	-31.3	0	0	0	110.8	E249 S465 L467	E249-P463 WeakPolarHBondContact OE2-CA 3.49Å; P463-S465 PolarHBondContact O-N 3.33Å; P463-L467 HydrophobicContact CB-CD1 4.46Å; P463-L467 HydrophobicContact CG-CD1 3.65Å
464	C	65.4	Low	78.7	Confident	113 Å²	113	69.6 Å²	69.6	76%	0.764	40%	0.401	S	S	*	.	S	Bend	trans	-66.5	-19.9	-175.1	-68.9	0	0	0	0	113.2	E249	E249-C464 PolarHBondContact OE2-N 3.29Å
465	S	59.9	Low	79	Confident	30 Å²	30	70.7 Å²	70.7	21%	0.21	41%	0.413	C	S	.	.	S	Bend	trans	-117	140.7	173.2	172.1	0	0	0	0	108.6	P463 L467 Q533	P463-S465 PolarHBondContact O-N 3.33Å; S465-L467 PolarHBondContact O-N 3.27Å; S465-Q533 PolarHBondContact OG-NE2 3.45Å
466	P	58.3	Low	79.2	Confident	86 Å²	86	70.6 Å²	70.6	56%	0.558	41%	0.412	S	S	*	.			trans	-54.5	132.3	164.3	25.1	-32	0	0	0	108.2	S468 V547	P466-S468 PolarHBondContact O-N 3.11Å; P466-V547 HydrophobicContact CG-CG1 4.49Å
467	L	60.3	Low	79.3	Confident	76 Å²	76	77.9 Å²	77.9	40%	0.398	44%	0.444	S	S	.	.	S	Bend	trans	-61.1	-28.5	179.4	-90.8	104.7	0	0	0	112.3	H247 P463 S465 H551	H247-L467 HydrophobicContact CB-CD1 3.95Å; H247-L467 HydrophobicContact CB-CD2 4.08Å; H247-L467 WeakPolarHBondContact O-CD1 3.41Å; P463-L467 HydrophobicContact CB-CD1 4.46Å; P463-L467 HydrophobicContact CG-CD1 3.65Å; S465-L467 PolarHBondContact O-N 3.27Å; L467-H551 WeakPolarHBondContact O-CB 3.23Å
468	S	69.3	Low	79.6	Confident	48 Å²	48	72 Å²	72	34%	0.336	42%	0.416	S	S	.	.			trans	-150.3	135.3	-170.5	-136.2	0	0	0	0	110.1	P466 D550 H551	P466-S468 PolarHBondContact O-N 3.11Å; S468-D550 VanDerWaalsContact OG-CA 3.29Å; S468-D550 WeakPolarHBondContact OG-CA 3.29Å; S468-D550 PolarHBondContact OG-OD1 3.41Å; S468-H551 PolarHBondContact OG-N 2.92Å
469	G	80.9	Confident	80.2	Confident	21 Å²	21	73 Å²	73	22%	0.216	42%	0.423	C	S	.	.			trans	-83	-170.7	157.5	0	0	0	0	0	111.2	Q548 Y549 D550	G469-Q548 CarbonylContact C-O 3.56Å; G469-Q548 VanDerWaalsContact CA-O 3.26Å; G469-Q548 WeakPolarHBondContact CA-O 3.48Å; G469-Y549 PolarHBondContact N-O 3.06Å; G469-D550 WeakPolarHBondContact O-CA 3.4Å
470	S	86.4	Confident	80.6	Confident	118 Å²	118	71.1 Å²	71.1	83%	0.825	41%	0.413	S	S	*	.	S	Bend	trans	-106.6	-4.8	-177.3	62.4	0	0	0	0	114.3	A472 Q548	S470-A472 PolarHBondContact O-N 3.13Å; S470-Q548 PolarHBondContact N-O 3.06Å; S470-Q548 VanDerWaalsContact N-O 3.14Å
471	L	88.3	Confident	81.1	Confident	56 Å²	56	72.1 Å²	72.1	29%	0.293	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-78.9	120.9	-177	-81.8	141.9	0	0	0	111.8	Q548 Y549 D550	L471-Q548 WeakPolarHBondContact CB-O 3.12Å; L471-Q548 HydrophobicContact CD1-CB 3.41Å; L471-Q548 VanDerWaalsContact CD1-CB 3.41Å; L471-Q548 HydrophobicContact CD1-CG 4.47Å; L471-Q548 PolarHBondContact N-O 3.2Å; L471-Y549 HydrophobicContact CB-CD1 4.26Å; L471-Y549 WeakPolarHBondContact O-CA 3.21Å; L471-D550 PolarHBondContact O-N 3.49Å
472	A	88.8	Confident	81.6	Confident	59 Å²	59	67.6 Å²	67.6	49%	0.488	40%	0.397	S	S	.	.			trans	-138.7	73.7	171.7	0	0	0	0	0	110.2	S470 Y553	S470-A472 PolarHBondContact O-N 3.13Å; A472-Y553 HydrophobicContact CB-CD1 4.39Å; A472-Y553 HydrophobicContact CB-CD2 3.82Å; A472-Y553 HydrophobicContact CB-CE2 4.42Å; A472-Y553 HydrophobicContact CB-CG 3.81Å
473	P	88.5	Confident	82.3	Confident	42 Å²	42	66.4 Å²	66.4	27%	0.273	38%	0.384	S	S	.	.			trans	-64.3	145.3	-177.9	22.5	-30.6	0	0	0	112.6	N475 Y549 Y553	P473-N475 VanDerWaalsContact C-N 3.33Å; P473-N475 PolarHBondContact O-N 2.98Å; P473-Y549 HydrophobicContact CG-CE1 3.91Å; P473-Y553 HydrophobicContact CG-CE1 4.03Å; P473-Y553 WeakPolarHBondContact O-CE2 3.39Å; P473-Y553 PolarHBondContact O-OH 3.08Å
474	L	80.7	Confident	83	Confident	177 Å²	177	69.4 Å²	69.4	93%	0.927	40%	0.398	S	S	*	.	S	Bend	trans	-67.1	-34.3	179.3	-74.4	158.1	0	0	0	112.7
475	N	82.5	Confident	84.5	Confident	140 Å²	140	64 Å²	64	75%	0.749	36%	0.361	S	S	*	.			trans	-124.2	119.4	-179.3	-74.2	-29	0	0	0	110.3	P473	P473-N475 VanDerWaalsContact C-N 3.33Å; P473-N475 PolarHBondContact O-N 2.98Å
476	M	86.7	Confident	86.1	Confident	9 Å²	9	63.6 Å²	63.6	4%	0.044	36%	0.358	C	S	.	.			trans	-107	130	173.5	-177	179.7	-74.1	0	0	109.7	L541 D542 Y549 Y553 Q557 R639	M476-L541 HydrophobicContact CE-CD2 3.53Å; M476-L541 HydrophobicContact CE-CG 4.33Å; M476-L541 HydrophobicContact SD-CD1 4.48Å; M476-L541 HydrophobicContact SD-CD2 3.88Å; M476-L541 HydrophobicContact SD-CG 4.39Å; M476-D542 VanDerWaalsContact CG-OD2 3.23Å; M476-D542 WeakPolarHBondContact CG-OD2 3.48Å; M476-Y549 HydrophobicContact CE-CE1 4.15Å; M476-Y553 HydrophobicContact CE-CD1 4.48Å; M476-Y553 HydrophobicContact CE-CE1 3.46Å; M476-Y553 VanDerWaalsContact CE-CE1 3.46Å; M476-Q557 HydrophobicContact CE-CB 3.77Å; M476-Q557 HydrophobicContact CE-CG 3.7Å; M476-Q557 HydrophobicContact SD-CB 3.5Å; M476-Q557 WeakPolarHBondContact SD-CB 3.4Å; M476-Q557 HydrophobicContact SD-CG 3.84Å; M476-R639 HydrophobicContact CB-CG 4.3Å; M476-R639 HydrophobicContact CG-CB 4.45Å; M476-R639 HydrophobicContact SD-CB 4.11Å
477	K	87.4	Confident	87.8	Confident	164 Å²	164	59.7 Å²	59.7	71%	0.713	33%	0.333	S	S	*	.			trans	-84.1	-34.9	176.1	-62.2	178.2	-177.9	176.4	0	110.8	P507 D542	K477-P507 VanDerWaalsContact O-CB 3.32Å; K477-P507 WeakPolarHBondContact O-CB 3.34Å; K477-D542 WeakPolarHBondContact CB-OD1 3.35Å; K477-D542 PolarHBondContact N-OD2 3.36Å
478	G	88.6	Confident	89.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.318	C	S	.	.			trans	89.8	21.8	177.8	0	0	0	0	0	114.2	D542 T672	G478-D542 PolarHBondContact N-OD1 3.45Å; G478-D542 PolarHBondContact N-OD2 2.98Å; G478-T672 WeakPolarHBondContact O-CB 3.37Å; G478-T672 PolarHBondContact O-OG1 3.21Å
479	L	94.5	Very high	90.2	Very high	42 Å²	42	57 Å²	57	22%	0.22	31%	0.312	C	S	.	.			trans	-79.3	117	175.3	-178.6	74.1	0	0	0	109.6	T504 L505 Y506 L541 D542	L479-T504 HydrophobicContact CD1-CG2 3.8Å; L479-L505 WeakPolarHBondContact CD1-O 3.28Å; L479-Y506 HydrophobicContact CD1-CD1 3.8Å; L479-Y506 HydrophobicContact CD1-CE1 4.19Å; L479-L541 CarbonylContact O-C 3.54Å; L479-D542 WeakPolarHBondContact CB-OD1 3.2Å; L479-D542 PolarHBondContact N-OD1 3.31Å; L479-D542 PolarHBondContact O-N 3.47Å
480	V	95.9	Very high	90.4	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.006	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134	177.5	-172.3	0	0	0	0	110.2	F482 T504 L505 L528 V539 L540 L541 L640	V480-F482 HydrophobicContact CG1-CD2 4.08Å; V480-F482 HydrophobicContact CG1-CE2 3.88Å; V480-T504 CarbonylContact O-C 3.47Å; V480-T504 VanDerWaalsContact O-CA 3.27Å; V480-T504 WeakPolarHBondContact O-CA 3.44Å; V480-T504 WeakPolarHBondContact O-CG2 3.36Å; V480-L505 HydrophobicContact CB-CB 3.98Å; V480-L505 HydrophobicContact CB-CD1 4.11Å; V480-L505 HydrophobicContact CB-CG 4.21Å; V480-L505 HydrophobicContact CG2-CB 4.33Å; V480-L505 HydrophobicContact CG2-CD1 4.2Å; V480-L505 PolarHBondContact N-O 3.05Å; V480-L505 PolarHBondContact O-N 3.03Å; V480-L528 HydrophobicContact CB-CD2 4.42Å; V480-L528 HydrophobicContact CG1-CD2 3.5Å; V480-L528 VanDerWaalsContact CG1-CD2 3.5Å; V480-L528 HydrophobicContact CG2-CD2 4.24Å; V480-V539 HydrophobicContact CG1-CG1 4.29Å; V480-L540 CarbonylContact C-O 3.51Å; V480-L540 WeakPolarHBondContact CA-O 3.4Å; V480-L541 HydrophobicContact CG2-CD1 3.82Å; V480-L640 HydrophobicContact CG2-CD1 4.31Å; V480-L640 HydrophobicContact CG2-CD2 3.91Å
481	K	96.1	Very high	90.3	Very high	82 Å²	82	55.8 Å²	55.8	36%	0.357	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.8	172.3	-63.3	-178.3	179.9	179.8	0	111.1	T504 L540	K481-T504 HydrophobicContact CG-CG2 3.91Å; K481-L540 HydrophobicContact CB-CB 4.36Å; K481-L540 PolarHBondContact N-O 3.47Å; K481-L540 PolarHBondContact O-N 3.17Å
482	F	96.1	Very high	90.1	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.009	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.4	164.7	-80.1	-109.4	0	0	0	108.2	V480 V485 L501 T502 F503 V524 L527 L528 V539	V480-F482 HydrophobicContact CG1-CD2 4.08Å; V480-F482 HydrophobicContact CG1-CE2 3.88Å; F482-V485 HydrophobicContact CB-CG2 4.16Å; F482-V485 HydrophobicContact CD1-CB 3.91Å; F482-V485 HydrophobicContact CD1-CG1 4.13Å; F482-V485 HydrophobicContact CD1-CG2 3.71Å; F482-V485 HydrophobicContact CE1-CG1 4.4Å; F482-V485 HydrophobicContact CG-CG2 4.31Å; F482-L501 HydrophobicContact CD1-CD2 4.13Å; F482-L501 HydrophobicContact CE1-CD2 4.48Å; F482-T502 WeakPolarHBondContact O-CA 3.49Å; F482-T502 WeakPolarHBondContact O-CG2 3.27Å; F482-F503 HydrophobicContact CB-CD1 3.96Å; F482-F503 HydrophobicContact CB-CE1 3.87Å; F482-F503 HydrophobicContact CB-CG 4.48Å; F482-F503 HydrophobicContact CB-CZ 4.36Å; F482-F503 AromaticContact CD1-CE1 3.94Å; F482-F503 HydrophobicContact CD1-CE1 3.94Å; F482-F503 HydrophobicContact CD1-CZ 4.23Å; F482-F503 HydrophobicContact CD2-CD1 4.4Å; F482-F503 HydrophobicContact CD2-CD2 4.43Å; F482-F503 AromaticContact CD2-CE1 3.68Å; F482-F503 HydrophobicContact CD2-CE1 3.68Å; F482-F503 AromaticContact CD2-CE2 3.74Å; F482-F503 HydrophobicContact CD2-CE2 3.74Å; F482-F503 AromaticContact CD2-CZ 3.3Å; F482-F503 HydrophobicContact CD2-CZ 3.3Å; F482-F503 HydrophobicContact CE1-CE1 4.45Å; F482-F503 HydrophobicContact CE1-CZ 4.42Å; F482-F503 HydrophobicContact CE2-CE1 4.2Å; F482-F503 HydrophobicContact CE2-CE2 4.08Å; F482-F503 AromaticContact CE2-CZ 3.52Å; F482-F503 HydrophobicContact CE2-CZ 3.52Å; F482-F503 HydrophobicContact CG-CD1 4.15Å; F482-F503 AromaticContact CG-CE1 3.55Å; F482-F503 HydrophobicContact CG-CE1 3.55Å; F482-F503 HydrophobicContact CG-CE2 4.41Å; F482-F503 AromaticContact CG-CZ 3.71Å; F482-F503 HydrophobicContact CG-CZ 3.71Å; F482-F503 HydrophobicContact CZ-CZ 4.11Å; F482-F503 PolarHBondContact N-O 3.44Å; F482-F503 PolarHBondContact O-N 3.04Å; F482-V524 HydrophobicContact CE1-CG1 4.39Å; F482-V524 HydrophobicContact CE2-CG1 4.47Å; F482-V524 HydrophobicContact CZ-CG1 3.96Å; F482-L527 HydrophobicContact CE1-CB 4.47Å; F482-L527 HydrophobicContact CE1-CD1 4.39Å; F482-L528 HydrophobicContact CE2-CD2 3.58Å; F482-L528 HydrophobicContact CE2-CG 3.95Å; F482-L528 HydrophobicContact CZ-CD2 3.92Å; F482-L528 HydrophobicContact CZ-CG 3.86Å; F482-V539 HydrophobicContact CD1-CG2 3.89Å; F482-V539 HydrophobicContact CD2-CG1 4.26Å; F482-V539 HydrophobicContact CE1-CG1 4.31Å; F482-V539 HydrophobicContact CE1-CG2 3.63Å; F482-V539 HydrophobicContact CE2-CG1 3.88Å; F482-V539 HydrophobicContact CG-CG2 4.48Å; F482-V539 HydrophobicContact CZ-CG1 3.88Å; F482-V539 HydrophobicContact CZ-CG2 4.02Å
483	Q	95	Very high	89.9	Confident	89 Å²	89	60.7 Å²	60.7	42%	0.416	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	104.6	179.4	-65.6	-178.7	-11.1	0	0	109.9	V485 G537 K538	Q483-V485 PolarHBondContact O-N 3.4Å; Q483-G537 VanDerWaalsContact O-CA 3.25Å; Q483-G537 WeakPolarHBondContact O-CA 3.42Å; Q483-K538 PolarHBondContact N-O 3.42Å; Q483-K538 PolarHBondContact O-N 3.04Å
484	D	94.2	Very high	89.9	Confident	103 Å²	103	66.2 Å²	66.2	55%	0.551	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.2	42	176.5	-164.5	32.9	0	0	0	113.5	S486 G500 L501 T502 G537	D484-S486 PolarHBondContact O-N 3.18Å; D484-G500 WeakPolarHBondContact OD1-CA 3.41Å; D484-L501 PolarHBondContact N-O 3.43Å; D484-T502 PolarHBondContact N-OG1 3.45Å; D484-G537 VanDerWaalsContact O-CA 3.29Å; D484-G537 WeakPolarHBondContact O-CA 3.37Å
485	V	95	Very high	90.3	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	120.5	-169.9	173.8	0	0	0	0	110.6	F482 Q483 G500 L501 L527 P534 G536 K538 V539	F482-V485 HydrophobicContact CB-CG2 4.16Å; F482-V485 HydrophobicContact CD1-CB 3.91Å; F482-V485 HydrophobicContact CD1-CG1 4.13Å; F482-V485 HydrophobicContact CD1-CG2 3.71Å; F482-V485 HydrophobicContact CE1-CG1 4.4Å; F482-V485 HydrophobicContact CG-CG2 4.31Å; Q483-V485 PolarHBondContact O-N 3.4Å; V485-G500 PolarHBondContact O-N 2.9Å; V485-L501 HydrophobicContact CB-CB 4.26Å; V485-L501 PolarHBondContact N-O 2.92Å; V485-L501 WeakPolarHBondContact O-CB 3.29Å; V485-L501 PolarHBondContact O-N 3.2Å; V485-L527 HydrophobicContact CG1-CD1 3.98Å; V485-P534 HydrophobicContact CG1-CB 3.79Å; V485-G536 WeakPolarHBondContact CA-O 3.25Å; V485-K538 VanDerWaalsContact CG2-O 3.27Å; V485-K538 WeakPolarHBondContact CG2-O 3.4Å; V485-V539 HydrophobicContact CG1-CG2 4.35Å; V485-V539 HydrophobicContact CG2-CG2 3.87Å
486	S	94.3	Very high	90.6	Very high	21 Å²	21	60.3 Å²	60.3	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	143.4	171.7	-59.4	0	0	0	0	109.8	D484 L498 G500 T535 G536	D484-S486 PolarHBondContact O-N 3.18Å; S486-L498 VanDerWaalsContact CA-O 3.3Å; S486-L498 WeakPolarHBondContact CA-O 3.2Å; S486-G500 PolarHBondContact OG-N 3.42Å; S486-T535 VanDerWaalsContact C-OG1 3.28Å; S486-T535 PolarHBondContact O-N 2.93Å; S486-T535 PolarHBondContact O-OG1 3.3Å; S486-G536 PolarHBondContact N-O 3.23Å; S486-G536 PolarHBondContact O-N 3.25Å; S486-G536 VanDerWaalsContact O-N 3.1Å
487	F	93.9	Very high	90.8	Very high	4 Å²	4	61.6 Å²	61.6	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	139.2	-178.4	-179.1	-100.7	0	0	0	112.9	Y489 V497 L498 T523 L527 Y532 Q533 T535	F487-Y489 AromaticContact CE1-CD1 3.77Å; F487-Y489 HydrophobicContact CE1-CD1 3.77Å; F487-Y489 AromaticContact CE1-CD2 3.84Å; F487-Y489 HydrophobicContact CE1-CD2 3.84Å; F487-Y489 AromaticContact CE1-CE1 3.8Å; F487-Y489 HydrophobicContact CE1-CE1 3.8Å; F487-Y489 AromaticContact CE1-CE2 3.86Å; F487-Y489 HydrophobicContact CE1-CE2 3.86Å; F487-Y489 AromaticContact CE1-CG 3.79Å; F487-Y489 HydrophobicContact CE1-CG 3.79Å; F487-Y489 AromaticContact CE1-CZ 3.84Å; F487-Y489 AromaticContact CZ-CD1 3.97Å; F487-Y489 HydrophobicContact CZ-CD1 3.97Å; F487-Y489 HydrophobicContact CZ-CE1 4.17Å; F487-Y489 HydrophobicContact CZ-CG 4.28Å; F487-V497 PolarHBondContact O-N 2.86Å; F487-L498 HydrophobicContact CB-CB 4.14Å; F487-L498 HydrophobicContact CB-CD1 4.16Å; F487-L498 HydrophobicContact CB-CG 4.33Å; F487-L498 PolarHBondContact N-O 2.92Å; F487-L498 PolarHBondContact O-N 3.42Å; F487-T523 HydrophobicContact CD1-CG2 3.3Å; F487-T523 HydrophobicContact CE1-CG2 3.6Å; F487-T523 HydrophobicContact CG-CG2 4.21Å; F487-L527 HydrophobicContact CB-CD1 4.19Å; F487-L527 HydrophobicContact CD2-CD2 3.88Å; F487-L527 HydrophobicContact CE2-CD2 4.15Å; F487-L527 HydrophobicContact CG-CD1 4.37Å; F487-L527 HydrophobicContact CG-CD2 4.28Å; F487-Y532 HydrophobicContact CE2-CG 4.22Å; F487-Y532 HydrophobicContact CZ-CD1 4.07Å; F487-Y532 HydrophobicContact CZ-CD2 4.38Å; F487-Y532 AromaticContact CZ-CG 3.77Å; F487-Y532 HydrophobicContact CZ-CG 3.77Å; F487-Q533 VanDerWaalsContact CD2-O 3.29Å; F487-Q533 WeakPolarHBondContact CD2-O 3.37Å; F487-Q533 VanDerWaalsContact CE2-O 3.28Å; F487-Q533 WeakPolarHBondContact CE2-O 3.27Å; F487-T535 VanDerWaalsContact CA-OG1 3.28Å; F487-T535 WeakPolarHBondContact CA-OG1 3.28Å; F487-T535 PolarHBondContact N-OG1 3.34Å
488	A	91.6	Very high	91.1	Very high	10 Å²	10	53.8 Å²	53.8	8%	0.083	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.7	169.4	0	0	0	0	0	109.6	P493 V495 T535	A488-P493 WeakPolarHBondContact CB-O 3.13Å; A488-V495 WeakPolarHBondContact CB-O 3.24Å; A488-T535 HydrophobicContact CB-CG2 4.44Å
489	Y	89.5	Confident	91.3	Very high	58 Å²	58	58.6 Å²	58.6	23%	0.227	31%	0.306	C	S	.	.			trans	-69.8	144.4	178.8	-77.8	-82	0	0	0	111.3	L254 F487 N491 H492 V497 T523 Y532	L254-Y489 HydrophobicContact CD1-CD1 4.1Å; F487-Y489 AromaticContact CE1-CD1 3.77Å; F487-Y489 HydrophobicContact CE1-CD1 3.77Å; F487-Y489 AromaticContact CE1-CD2 3.84Å; F487-Y489 HydrophobicContact CE1-CD2 3.84Å; F487-Y489 AromaticContact CE1-CE1 3.8Å; F487-Y489 HydrophobicContact CE1-CE1 3.8Å; F487-Y489 AromaticContact CE1-CE2 3.86Å; F487-Y489 HydrophobicContact CE1-CE2 3.86Å; F487-Y489 AromaticContact CE1-CG 3.79Å; F487-Y489 HydrophobicContact CE1-CG 3.79Å; F487-Y489 AromaticContact CE1-CZ 3.84Å; F487-Y489 AromaticContact CZ-CD1 3.97Å; F487-Y489 HydrophobicContact CZ-CD1 3.97Å; F487-Y489 HydrophobicContact CZ-CE1 4.17Å; F487-Y489 HydrophobicContact CZ-CG 4.28Å; Y489-N491 PolarHBondContact O-N 3.41Å; Y489-H492 CarbonylContact O-C 3.59Å; Y489-H492 PolarHBondContact O-N 2.87Å; Y489-V497 HydrophobicContact CD2-CG2 3.82Å; Y489-V497 HydrophobicContact CE2-CG2 4.01Å; Y489-T523 HydrophobicContact CE2-CG2 4.17Å; Y489-T523 PolarHBondContact OH-OG1 3.04Å; Y489-Y532 HydrophobicContact CD1-CE1 4.38Å; Y489-Y532 HydrophobicContact CE1-CD2 4.38Å; Y489-Y532 HydrophobicContact CE1-CE1 4.48Å; Y489-Y532 AromaticContact CE1-CE2 4Å; Y489-Y532 HydrophobicContact CE1-CE2 4Å
490	P	84.1	Confident	91.2	Very high	53 Å²	53	58 Å²	58	34%	0.344	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19	-179.9	-26.7	35.1	0	0	0	115.8	K255	K255-P490 WeakPolarHBondContact CE-O 3.42Å; K255-P490 PolarHBondContact NZ-O 3.4Å
491	N	83.8	Confident	91	Very high	60 Å²	60	58 Å²	58	32%	0.321	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-27.5	176.4	-69.3	7.7	0	0	0	112.2	L254 K255 Y489	L254-N491 PolarHBondContact O-ND2 2.98Å; K255-N491 VanDerWaalsContact CE-OD1 3.28Å; K255-N491 WeakPolarHBondContact CE-OD1 3.32Å; K255-N491 WeakPolarHBondContact CG-OD1 3.47Å; Y489-N491 PolarHBondContact O-N 3.41Å
492	H	85.9	Confident	91	Very high	129 Å²	129	58 Å²	58	60%	0.597	32%	0.317	S	S	*	.			trans	-136.9	68.8	-178.4	-63.8	-69.4	0	0	0	110	Y489 N494 V495	Y489-H492 CarbonylContact O-C 3.59Å; Y489-H492 PolarHBondContact O-N 2.87Å; H492-N494 PolarHBondContact O-N 3.5Å; H492-N494 VanDerWaalsContact O-N 3.14Å; H492-V495 HydrophobicContact CB-CB 4.42Å; H492-V495 HydrophobicContact CB-CG2 4.46Å; H492-V495 PolarHBondContact O-N 3.27Å; H492-V495 VanDerWaalsContact O-N 3.13Å
493	P	84.2	Confident	90.9	Very high	88 Å²	88	58.1 Å²	58.1	57%	0.571	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.2	-174.6	26.4	-35.4	0	0	0	113.2	A488 V495	A488-P493 WeakPolarHBondContact CB-O 3.13Å; P493-V495 VanDerWaalsContact C-N 3.31Å
494	N	87.3	Confident	90.9	Very high	158 Å²	158	55.4 Å²	55.4	85%	0.845	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-11.3	-179.2	-62.6	-11.9	0	0	0	113.4	H492	H492-N494 PolarHBondContact O-N 3.5Å; H492-N494 VanDerWaalsContact O-N 3.14Å
495	V	88.7	Confident	90.9	Very high	89 Å²	89	50.5 Å²	50.5	54%	0.539	28%	0.281	S	S	.	.	S	Bend	trans	-108.9	104	-178.5	-176.8	0	0	0	0	108.4	A488 H492 P493 V497	A488-V495 WeakPolarHBondContact CB-O 3.24Å; H492-V495 HydrophobicContact CB-CB 4.42Å; H492-V495 HydrophobicContact CB-CG2 4.46Å; H492-V495 PolarHBondContact O-N 3.27Å; H492-V495 VanDerWaalsContact O-N 3.13Å; P493-V495 VanDerWaalsContact C-N 3.31Å; V495-V497 PolarHBondContact O-N 3.43Å
496	Q	89	Confident	90.9	Very high	105 Å²	105	55.8 Å²	55.8	49%	0.491	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.5	174.5	-70.7	-173.5	-12.2	0	0	110	Q499	Q496-Q499 HydrophobicContact CB-CG 4.11Å
497	V	92.7	Very high	90.8	Very high	35 Å²	35	57.4 Å²	57.4	21%	0.212	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-35	177.4	178.8	0	0	0	0	111	F487 Y489 V495 T523 G695	F487-V497 PolarHBondContact O-N 2.86Å; Y489-V497 HydrophobicContact CD2-CG2 3.82Å; Y489-V497 HydrophobicContact CE2-CG2 4.01Å; V495-V497 PolarHBondContact O-N 3.43Å; V497-T523 HydrophobicContact CG1-CG2 4.32Å; V497-G695 WeakPolarHBondContact O-CA 3.29Å
498	L	93.4	Very high	90.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	136.8	174.3	-58.3	178	0	0	0	109.3	S486 F487 L501 T523 V524 L527 G695	S486-L498 VanDerWaalsContact CA-O 3.3Å; S486-L498 WeakPolarHBondContact CA-O 3.2Å; F487-L498 HydrophobicContact CB-CB 4.14Å; F487-L498 HydrophobicContact CB-CD1 4.16Å; F487-L498 HydrophobicContact CB-CG 4.33Å; F487-L498 PolarHBondContact N-O 2.92Å; F487-L498 PolarHBondContact O-N 3.42Å; L498-L501 HydrophobicContact CD1-CD2 4.16Å; L498-L501 HydrophobicContact CD2-CD2 4.22Å; L498-T523 HydrophobicContact CD1-CG2 3.92Å; L498-T523 HydrophobicContact CG-CG2 4.17Å; L498-V524 HydrophobicContact CD1-CG2 4.23Å; L498-V524 HydrophobicContact CD2-CG2 4.24Å; L498-L527 HydrophobicContact CD1-CD1 3.49Å; L498-L527 VanDerWaalsContact CD1-CD1 3.49Å; L498-G695 WeakPolarHBondContact CA-O 2.84Å
499	Q	92.9	Very high	90.5	Very high	101 Å²	101	62.7 Å²	62.7	47%	0.472	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	102.7	-173.7	-60.2	179.8	19.4	0	0	109.4	Q496 L501 G695	Q496-Q499 HydrophobicContact CB-CG 4.11Å; Q499-L501 VanDerWaalsContact C-N 3.34Å; Q499-L501 PolarHBondContact O-N 3.46Å; Q499-G695 PolarHBondContact N-O 2.87Å
500	G	90.8	Very high	90.7	Very high	30 Å²	30	60.1 Å²	60.1	31%	0.309	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.2	35.7	174.5	0	0	0	0	0	115.6	D484 V485 S486 T502	D484-G500 WeakPolarHBondContact OD1-CA 3.41Å; V485-G500 PolarHBondContact O-N 2.9Å; S486-G500 PolarHBondContact OG-N 3.42Å; G500-T502 PolarHBondContact O-N 3.39Å
501	L	93.3	Very high	91.2	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	120.9	-171.6	-165.4	73.9	0	0	0	112.1	F482 D484 V485 L498 Q499 F503 V524 L692 V697	F482-L501 HydrophobicContact CD1-CD2 4.13Å; F482-L501 HydrophobicContact CE1-CD2 4.48Å; D484-L501 PolarHBondContact N-O 3.43Å; V485-L501 HydrophobicContact CB-CB 4.26Å; V485-L501 PolarHBondContact N-O 2.92Å; V485-L501 WeakPolarHBondContact O-CB 3.29Å; V485-L501 PolarHBondContact O-N 3.2Å; L498-L501 HydrophobicContact CD1-CD2 4.16Å; L498-L501 HydrophobicContact CD2-CD2 4.22Å; Q499-L501 VanDerWaalsContact C-N 3.34Å; Q499-L501 PolarHBondContact O-N 3.46Å; L501-F503 HydrophobicContact CD2-CD1 4.23Å; L501-F503 HydrophobicContact CD2-CE1 3.57Å; L501-F503 HydrophobicContact CG-CD1 3.96Å; L501-F503 HydrophobicContact CG-CE1 3.82Å; L501-V524 HydrophobicContact CD2-CG2 3.65Å; L501-L692 HydrophobicContact CD1-CD1 3.44Å; L501-L692 VanDerWaalsContact CD1-CD1 3.44Å; L501-V697 HydrophobicContact CD1-CG2 3.47Å; L501-V697 VanDerWaalsContact CD1-CG2 3.47Å; L501-V697 HydrophobicContact CG-CG2 4.37Å
502	T	94.4	Very high	91.7	Very high	82 Å²	82	54.8 Å²	54.8	50%	0.503	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	115.3	-178.4	-58.5	0	0	0	0	111.3	F482 D484 G500	F482-T502 WeakPolarHBondContact O-CA 3.49Å; F482-T502 WeakPolarHBondContact O-CG2 3.27Å; D484-T502 PolarHBondContact N-OG1 3.45Å; G500-T502 PolarHBondContact O-N 3.39Å
503	F	94.9	Very high	92.1	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.022	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	170.8	173.5	66	-87.2	0	0	0	110.7	F482 L501 L505 V524 L690 V697	F482-F503 HydrophobicContact CB-CD1 3.96Å; F482-F503 HydrophobicContact CB-CE1 3.87Å; F482-F503 HydrophobicContact CB-CG 4.48Å; F482-F503 HydrophobicContact CB-CZ 4.36Å; F482-F503 AromaticContact CD1-CE1 3.94Å; F482-F503 HydrophobicContact CD1-CE1 3.94Å; F482-F503 HydrophobicContact CD1-CZ 4.23Å; F482-F503 HydrophobicContact CD2-CD1 4.4Å; F482-F503 HydrophobicContact CD2-CD2 4.43Å; F482-F503 AromaticContact CD2-CE1 3.68Å; F482-F503 HydrophobicContact CD2-CE1 3.68Å; F482-F503 AromaticContact CD2-CE2 3.74Å; F482-F503 HydrophobicContact CD2-CE2 3.74Å; F482-F503 AromaticContact CD2-CZ 3.3Å; F482-F503 HydrophobicContact CD2-CZ 3.3Å; F482-F503 HydrophobicContact CE1-CE1 4.45Å; F482-F503 HydrophobicContact CE1-CZ 4.42Å; F482-F503 HydrophobicContact CE2-CE1 4.2Å; F482-F503 HydrophobicContact CE2-CE2 4.08Å; F482-F503 AromaticContact CE2-CZ 3.52Å; F482-F503 HydrophobicContact CE2-CZ 3.52Å; F482-F503 HydrophobicContact CG-CD1 4.15Å; F482-F503 AromaticContact CG-CE1 3.55Å; F482-F503 HydrophobicContact CG-CE1 3.55Å; F482-F503 HydrophobicContact CG-CE2 4.41Å; F482-F503 AromaticContact CG-CZ 3.71Å; F482-F503 HydrophobicContact CG-CZ 3.71Å; F482-F503 HydrophobicContact CZ-CZ 4.11Å; F482-F503 PolarHBondContact N-O 3.44Å; F482-F503 PolarHBondContact O-N 3.04Å; L501-F503 HydrophobicContact CD2-CD1 4.23Å; L501-F503 HydrophobicContact CD2-CE1 3.57Å; L501-F503 HydrophobicContact CG-CD1 3.96Å; L501-F503 HydrophobicContact CG-CE1 3.82Å; F503-L505 HydrophobicContact CD2-CD2 3.98Å; F503-L505 HydrophobicContact CD2-CG 4.22Å; F503-L505 HydrophobicContact CE2-CD1 4.27Å; F503-L505 HydrophobicContact CE2-CD2 3.71Å; F503-L505 HydrophobicContact CE2-CG 3.79Å; F503-V524 HydrophobicContact CE1-CG1 4.43Å; F503-V524 HydrophobicContact CZ-CG1 3.83Å; F503-L690 HydrophobicContact CB-CD1 4.15Å; F503-L690 HydrophobicContact CB-CD2 4.14Å; F503-L690 HydrophobicContact CD1-CD1 4.38Å; F503-L690 HydrophobicContact CD2-CD1 3.43Å; F503-L690 VanDerWaalsContact CD2-CD1 3.43Å; F503-L690 HydrophobicContact CE2-CD1 3.87Å; F503-L690 HydrophobicContact CG-CD1 3.73Å; F503-V697 HydrophobicContact CD1-CG2 4.25Å
504	T	95.2	Very high	92.5	Very high	32 Å²	32	44.8 Å²	44.8	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.3	179.7	-58.6	0	0	0	0	110.7	L479 V480 K481 Y506	L479-T504 HydrophobicContact CD1-CG2 3.8Å; V480-T504 CarbonylContact O-C 3.47Å; V480-T504 VanDerWaalsContact O-CA 3.27Å; V480-T504 WeakPolarHBondContact O-CA 3.44Å; V480-T504 WeakPolarHBondContact O-CG2 3.36Å; K481-T504 HydrophobicContact CG-CG2 3.91Å; T504-Y506 HydrophobicContact CG2-CD1 4.3Å; T504-Y506 HydrophobicContact CG2-CD2 4.34Å; T504-Y506 HydrophobicContact CG2-CE1 3.88Å; T504-Y506 HydrophobicContact CG2-CE2 3.92Å
505	L	95.1	Very high	92.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.1	169.9	-53.2	176.9	0	0	0	109	L479 V480 F503 T511 L528 L640 T672 L674	L479-L505 WeakPolarHBondContact CD1-O 3.28Å; V480-L505 HydrophobicContact CB-CB 3.98Å; V480-L505 HydrophobicContact CB-CD1 4.11Å; V480-L505 HydrophobicContact CB-CG 4.21Å; V480-L505 HydrophobicContact CG2-CB 4.33Å; V480-L505 HydrophobicContact CG2-CD1 4.2Å; V480-L505 PolarHBondContact N-O 3.05Å; V480-L505 PolarHBondContact O-N 3.03Å; F503-L505 HydrophobicContact CD2-CD2 3.98Å; F503-L505 HydrophobicContact CD2-CG 4.22Å; F503-L505 HydrophobicContact CE2-CD1 4.27Å; F503-L505 HydrophobicContact CE2-CD2 3.71Å; F503-L505 HydrophobicContact CE2-CG 3.79Å; L505-T511 HydrophobicContact CD2-CG2 3.65Å; L505-L528 HydrophobicContact CD1-CD1 4.22Å; L505-L640 HydrophobicContact CD1-CD1 4.48Å; L505-T672 HydrophobicContact CB-CG2 3.67Å; L505-L674 HydrophobicContact CD1-CB 4.25Å; L505-L674 HydrophobicContact CD1-CD1 4.44Å; L505-L674 HydrophobicContact CD2-CD1 4.16Å
506	Y	93.3	Very high	92.5	Very high	110 Å²	110	36.7 Å²	36.7	43%	0.431	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-100.8	143.8	-175.3	-67	-84.1	0	0	0	111.9	L479 T504 K509	L479-Y506 HydrophobicContact CD1-CD1 3.8Å; L479-Y506 HydrophobicContact CD1-CE1 4.19Å; T504-Y506 HydrophobicContact CG2-CD1 4.3Å; T504-Y506 HydrophobicContact CG2-CD2 4.34Å; T504-Y506 HydrophobicContact CG2-CE1 3.88Å; T504-Y506 HydrophobicContact CG2-CE2 3.92Å; Y506-K509 PolarHBondContact O-N 3.41Å
507	P	92.1	Very high	92.4	Very high	56 Å²	56	37.9 Å²	37.9	36%	0.364	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	140.6	173.5	28.1	-35.1	0	0	0	111.8	K477 K509 T672	K477-P507 VanDerWaalsContact O-CB 3.32Å; K477-P507 WeakPolarHBondContact O-CB 3.34Å; P507-K509 PolarHBondContact O-N 3.12Å; P507-T672 VanDerWaalsContact CA-OG1 3.29Å; P507-T672 WeakPolarHBondContact CA-OG1 3.39Å
508	G	89.1	Confident	91.9	Very high	27 Å²	27	40 Å²	40	28%	0.278	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	8.9	-178.2	0	0	0	0	0	114.8	A669 R671	G508-A669 WeakPolarHBondContact CA-O 3.31Å; G508-R671 VanDerWaalsContact CA-O 3.27Å; G508-R671 WeakPolarHBondContact CA-O 3.47Å; G508-R671 PolarHBondContact N-O 2.98Å
509	K	91.4	Very high	91.7	Very high	98 Å²	98	40.1 Å²	40.1	43%	0.426	25%	0.245	S	C	.	.			trans	-117.3	136.7	177.1	-64.3	-166	-177.7	-179.8	0	111.3	Y506 P507 V673 H687	Y506-K509 PolarHBondContact O-N 3.41Å; P507-K509 PolarHBondContact O-N 3.12Å; K509-V673 PolarHBondContact O-N 2.93Å; K509-H687 HydrophobicContact CB-CB 4.2Å; K509-H687 HydrophobicContact CD-CB 4.47Å; K509-H687 HydrophobicContact CG-CB 4.42Å
510	V	93.3	Very high	91.5	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	116.7	167.9	-174.5	0	0	0	0	108.6	Y663 V673 L675 H687 H688	V510-Y663 HydrophobicContact CB-CE1 3.86Å; V510-Y663 HydrophobicContact CG1-CE1 4.14Å; V510-Y663 HydrophobicContact CG2-CD1 4.16Å; V510-Y663 HydrophobicContact CG2-CE1 3.81Å; V510-V673 HydrophobicContact CB-CB 4.42Å; V510-V673 HydrophobicContact CG1-CB 4.26Å; V510-V673 HydrophobicContact CG1-CG1 4.16Å; V510-V673 HydrophobicContact CG2-CB 4.14Å; V510-V673 HydrophobicContact CG2-CG2 4.41Å; V510-L675 HydrophobicContact CG1-CB 4.42Å; V510-H687 PolarHBondContact N-ND1 3.49Å; V510-H687 PolarHBondContact O-N 3.07Å; V510-H688 PolarHBondContact O-N 3.36Å
511	T	94.9	Very high	91.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.8	175.5	-53.9	0	0	0	0	109.5	L505 V673 L674 L675 H688 L690	L505-T511 HydrophobicContact CD2-CG2 3.65Å; T511-V673 PolarHBondContact N-O 3.28Å; T511-L674 WeakPolarHBondContact O-CA 3.28Å; T511-L675 PolarHBondContact O-N 3.14Å; T511-H688 CarbonylContact C-O 3.33Å; T511-H688 VanDerWaalsContact CA-O 3.24Å; T511-H688 WeakPolarHBondContact CA-O 3.28Å; T511-H688 HydrophobicContact CG2-CB 4.23Å; T511-L690 HydrophobicContact CG2-CD1 3.72Å; T511-L690 HydrophobicContact CG2-CG 3.89Å
512	A	94.6	Very high	91.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.6	174	0	0	0	0	0	111	V514 L675 A683 A686 H688 I689 L690	A512-V514 HydrophobicContact CB-CG2 4.29Å; A512-L675 CarbonylContact C-O 3.51Å; A512-L675 WeakPolarHBondContact CA-O 3.36Å; A512-A683 HydrophobicContact CB-CB 4.36Å; A512-A686 HydrophobicContact CB-CB 3.53Å; A512-H688 PolarHBondContact N-O 2.89Å; A512-I689 HydrophobicContact CB-CG1 4.36Å; A512-I689 CarbonylContact O-C 3.13Å; A512-I689 WeakPolarHBondContact O-CA 3.38Å; A512-L690 PolarHBondContact O-N 3.29Å
513	L	94.1	Very high	91.3	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.1	173.7	-177.4	65.7	0	0	0	109.2	K521 V524 L674 L675 I676 L690 L692	L513-K521 HydrophobicContact CD2-CB 4.09Å; L513-K521 HydrophobicContact CD2-CG 4.3Å; L513-K521 HydrophobicContact CG-CG 4.26Å; L513-V524 HydrophobicContact CD2-CB 4.07Å; L513-V524 HydrophobicContact CD2-CG1 4.22Å; L513-V524 HydrophobicContact CD2-CG2 4.22Å; L513-L674 HydrophobicContact CB-CD1 4.04Å; L513-L675 PolarHBondContact N-O 3.39Å; L513-I676 HydrophobicContact CB-CG1 4.09Å; L513-I676 HydrophobicContact CD2-CD1 4.47Å; L513-I676 HydrophobicContact CD2-CG1 4.09Å; L513-L690 WeakPolarHBondContact CA-O 3.24Å; L513-L690 HydrophobicContact CD1-CB 3.71Å; L513-L690 HydrophobicContact CD1-CD1 4.45Å; L513-L692 HydrophobicContact CD1-CB 4Å; L513-L692 HydrophobicContact CD1-CD1 4.28Å; L513-L692 HydrophobicContact CD1-CD2 4.48Å
514	V	92.4	Very high	91.3	Very high	6 Å²	6	33.9 Å²	33.9	4%	0.036	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	152.2	-172.1	-159.5	0	0	0	0	110.4	A512 A683 I689 L690 F691 L692 M716	A512-V514 HydrophobicContact CB-CG2 4.29Å; V514-A683 HydrophobicContact CG2-CB 4.03Å; V514-I689 HydrophobicContact CG2-CG2 4.21Å; V514-L690 PolarHBondContact N-O 2.91Å; V514-F691 CarbonylContact O-C 3.57Å; V514-F691 WeakPolarHBondContact O-CA 3.38Å; V514-L692 PolarHBondContact O-N 3.31Å; V514-M716 HydrophobicContact CB-CE 4.34Å; V514-M716 HydrophobicContact CG1-CE 3.42Å; V514-M716 VanDerWaalsContact CG1-CE 3.42Å; V514-M716 HydrophobicContact CG1-SD 3.47Å; V514-M716 WeakPolarHBondContact CG1-SD 3.3Å
515	G	90.1	Very high	91.2	Very high	9 Å²	9	32.6 Å²	32.6	9%	0.093	20%	0.202	C	C	.	.			trans	159.4	172.4	177.7	0	0	0	0	0	112.4	K521 L692	G515-K521 PolarHBondContact O-NZ 3.45Å; G515-L692 WeakPolarHBondContact CA-O 3.49Å
516	P	86.6	Confident	91	Very high	68 Å²	68	33.1 Å²	33.1	44%	0.442	21%	0.207	S	C	.	.	S	Bend	trans	-62.2	161.4	-178.7	25.4	-33.9	0	0	0	113	S519 K521 L692	P516-S519 WeakPolarHBondContact O-CB 3.46Å; P516-S519 PolarHBondContact O-N 2.89Å; P516-S519 PolarHBondContact O-OG 3.14Å; P516-K521 PolarHBondContact O-NZ 3.21Å; P516-L692 WeakPolarHBondContact CD-O 3.45Å
517	N	85.8	Confident	91	Very high	130 Å²	130	28 Å²	28	70%	0.695	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	140.8	173.2	-70.1	-19.3	0	0	0	110.4	S519 Q678	N517-S519 VanDerWaalsContact C-N 3.31Å; N517-S519 PolarHBondContact O-N 2.85Å; N517-Q678 PolarHBondContact OD1-NE2 3.35Å
518	G	83.1	Confident	91.1	Very high	79 Å²	79	25.4 Å²	25.4	81%	0.814	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	2.3	-176.8	0	0	0	0	0	115.8	G520	G518-G520 PolarHBondContact O-N 2.88Å
519	S	87.9	Confident	91.2	Very high	3 Å²	3	26 Å²	26	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-72.5	-5.7	179.4	66.4	0	0	0	0	115.7	P516 N517 K521 L692 G695	P516-S519 WeakPolarHBondContact O-CB 3.46Å; P516-S519 PolarHBondContact O-N 2.89Å; P516-S519 PolarHBondContact O-OG 3.14Å; N517-S519 VanDerWaalsContact C-N 3.31Å; N517-S519 PolarHBondContact O-N 2.85Å; S519-K521 WeakPolarHBondContact OG-CG 3.45Å; S519-L692 VanDerWaalsContact CB-O 3.27Å; S519-L692 WeakPolarHBondContact CB-O 3.39Å; S519-L692 WeakPolarHBondContact O-CD2 3.46Å; S519-L692 PolarHBondContact OG-O 3.17Å; S519-G695 WeakPolarHBondContact O-CA 3.36Å; S519-G695 PolarHBondContact O-N 3.35Å
520	G	89.2	Confident	91.2	Very high	4 Å²	4	22.8 Å²	22.8	4%	0.041	15%	0.153	C	C	.	.	S	Bend	trans	101.5	10.4	178.9	0	0	0	0	0	115.9	G518 T523 V524	G518-G520 PolarHBondContact O-N 2.88Å; G520-T523 WeakPolarHBondContact O-CA 3.43Å; G520-T523 VanDerWaalsContact O-CB 3.25Å; G520-T523 WeakPolarHBondContact O-CB 3.24Å; G520-T523 PolarHBondContact O-N 3.2Å; G520-T523 VanDerWaalsContact O-N 3.12Å; G520-V524 PolarHBondContact O-N 3.48Å
521	K	91.8	Very high	91	Very high	17 Å²	17	25.4 Å²	25.4	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-57.5	-53.3	-176.6	-54.3	-177.2	-63.4	-82.5	0	113.5	L513 G515 P516 S519 T523 V524 A525 I676 L692	L513-K521 HydrophobicContact CD2-CB 4.09Å; L513-K521 HydrophobicContact CD2-CG 4.3Å; L513-K521 HydrophobicContact CG-CG 4.26Å; G515-K521 PolarHBondContact O-NZ 3.45Å; P516-K521 PolarHBondContact O-NZ 3.21Å; S519-K521 WeakPolarHBondContact OG-CG 3.45Å; K521-T523 PolarHBondContact O-N 3.13Å; K521-V524 WeakPolarHBondContact O-CB 3.27Å; K521-V524 PolarHBondContact O-N 3.01Å; K521-V524 VanDerWaalsContact O-N 3.11Å; K521-A525 PolarHBondContact O-N 2.88Å; K521-I676 HydrophobicContact CB-CD1 4.34Å; K521-I676 HydrophobicContact CB-CG2 3.71Å; K521-I676 HydrophobicContact CD-CG2 3.89Å; K521-I676 HydrophobicContact CG-CG2 4.36Å; K521-I676 WeakPolarHBondContact O-CD1 3.23Å; K521-L692 HydrophobicContact CG-CD2 4.14Å
522	S	90.6	Very high	90.7	Very high	58 Å²	58	27.1 Å²	27.1	41%	0.406	17%	0.173	S	C	.	.	H	α-helix	trans	-66	-25.9	177.3	-50.5	0	0	0	0	112.3	A525 A526 D644	S522-A525 PolarHBondContact O-N 3.38Å; S522-A526 WeakPolarHBondContact O-CB 3.45Å; S522-A526 PolarHBondContact O-N 3.41Å; S522-D644 WeakPolarHBondContact CB-OD2 3.27Å; S522-D644 PolarHBondContact OG-OD2 3.38Å
523	T	92.8	Very high	90.4	Very high	8 Å²	8	30.7 Å²	30.7	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-66.9	-39.9	172.7	-49.2	0	0	0	0	111.5	F487 Y489 V497 L498 G520 K521 A525 A526 L527	F487-T523 HydrophobicContact CD1-CG2 3.3Å; F487-T523 HydrophobicContact CE1-CG2 3.6Å; F487-T523 HydrophobicContact CG-CG2 4.21Å; Y489-T523 HydrophobicContact CE2-CG2 4.17Å; Y489-T523 PolarHBondContact OH-OG1 3.04Å; V497-T523 HydrophobicContact CG1-CG2 4.32Å; L498-T523 HydrophobicContact CD1-CG2 3.92Å; L498-T523 HydrophobicContact CG-CG2 4.17Å; G520-T523 WeakPolarHBondContact O-CA 3.43Å; G520-T523 VanDerWaalsContact O-CB 3.25Å; G520-T523 WeakPolarHBondContact O-CB 3.24Å; G520-T523 PolarHBondContact O-N 3.2Å; G520-T523 VanDerWaalsContact O-N 3.12Å; K521-T523 PolarHBondContact O-N 3.13Å; T523-A525 VanDerWaalsContact C-N 3.35Å; T523-A525 PolarHBondContact O-N 2.87Å; T523-A526 PolarHBondContact O-N 2.89Å; T523-L527 WeakPolarHBondContact O-CG 3.44Å; T523-L527 PolarHBondContact O-N 3.44Å
524	V	93.9	Very high	90.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-45.4	172.6	175.8	0	0	0	0	110.8	F482 L498 L501 F503 L513 G520 K521 A526 L527 L528 L674	F482-V524 HydrophobicContact CE1-CG1 4.39Å; F482-V524 HydrophobicContact CE2-CG1 4.47Å; F482-V524 HydrophobicContact CZ-CG1 3.96Å; L498-V524 HydrophobicContact CD1-CG2 4.23Å; L498-V524 HydrophobicContact CD2-CG2 4.24Å; L501-V524 HydrophobicContact CD2-CG2 3.65Å; F503-V524 HydrophobicContact CE1-CG1 4.43Å; F503-V524 HydrophobicContact CZ-CG1 3.83Å; L513-V524 HydrophobicContact CD2-CB 4.07Å; L513-V524 HydrophobicContact CD2-CG1 4.22Å; L513-V524 HydrophobicContact CD2-CG2 4.22Å; G520-V524 PolarHBondContact O-N 3.48Å; K521-V524 WeakPolarHBondContact O-CB 3.27Å; K521-V524 PolarHBondContact O-N 3.01Å; K521-V524 VanDerWaalsContact O-N 3.11Å; V524-A526 VanDerWaalsContact C-N 3.31Å; V524-A526 PolarHBondContact O-N 2.96Å; V524-L527 PolarHBondContact O-N 3.41Å; V524-L528 HydrophobicContact CG1-CD1 4.27Å; V524-L528 WeakPolarHBondContact O-CG 3.25Å; V524-L528 PolarHBondContact O-N 2.95Å; V524-L674 HydrophobicContact CG1-CD2 4.28Å
525	A	93.3	Very high	90.2	Very high	5 Å²	5	36.2 Å²	36.2	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-38.9	175.3	0	0	0	0	0	112.6	K521 S522 T523 Q529 I642 I676	K521-A525 PolarHBondContact O-N 2.88Å; S522-A525 PolarHBondContact O-N 3.38Å; T523-A525 VanDerWaalsContact C-N 3.35Å; T523-A525 PolarHBondContact O-N 2.87Å; A525-Q529 WeakPolarHBondContact O-CG 3.43Å; A525-Q529 PolarHBondContact O-N 3.38Å; A525-Q529 PolarHBondContact O-NE2 2.77Å; A525-I642 HydrophobicContact CB-CG2 3.77Å; A525-I676 HydrophobicContact CB-CD1 3.86Å
526	A	92.3	Very high	90.2	Very high	11 Å²	11	37 Å²	37	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-70.5	-37.2	178.9	0	0	0	0	0	112.9	S522 T523 V524 Q529 N530 L531 Y532	S522-A526 WeakPolarHBondContact O-CB 3.45Å; S522-A526 PolarHBondContact O-N 3.41Å; T523-A526 PolarHBondContact O-N 2.89Å; V524-A526 VanDerWaalsContact C-N 3.31Å; V524-A526 PolarHBondContact O-N 2.96Å; A526-Q529 PolarHBondContact O-N 3.16Å; A526-N530 PolarHBondContact O-N 3.5Å; A526-L531 HydrophobicContact CB-CD1 4.49Å; A526-L531 WeakPolarHBondContact O-CB 3.45Å; A526-L531 PolarHBondContact O-N 3.05Å; A526-Y532 HydrophobicContact CB-CD2 3.8Å; A526-Y532 HydrophobicContact CB-CE2 4.03Å
527	L	92.7	Very high	90.5	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-67.7	-39.6	174.2	-70.6	177.4	0	0	0	112	F482 V485 F487 L498 T523 V524 Q529 N530 Y532 L546	F482-L527 HydrophobicContact CE1-CB 4.47Å; F482-L527 HydrophobicContact CE1-CD1 4.39Å; V485-L527 HydrophobicContact CG1-CD1 3.98Å; F487-L527 HydrophobicContact CB-CD1 4.19Å; F487-L527 HydrophobicContact CD2-CD2 3.88Å; F487-L527 HydrophobicContact CE2-CD2 4.15Å; F487-L527 HydrophobicContact CG-CD1 4.37Å; F487-L527 HydrophobicContact CG-CD2 4.28Å; L498-L527 HydrophobicContact CD1-CD1 3.49Å; L498-L527 VanDerWaalsContact CD1-CD1 3.49Å; T523-L527 WeakPolarHBondContact O-CG 3.44Å; T523-L527 PolarHBondContact O-N 3.44Å; V524-L527 PolarHBondContact O-N 3.41Å; L527-Q529 VanDerWaalsContact C-N 3.28Å; L527-Q529 PolarHBondContact O-N 3.07Å; L527-N530 WeakPolarHBondContact O-CA 3.39Å; L527-N530 PolarHBondContact O-N 3.48Å; L527-Y532 VanDerWaalsContact CD2-O 3.3Å; L527-Y532 WeakPolarHBondContact CD2-O 3.46Å; L527-L546 VanDerWaalsContact O-CD1 3.3Å; L527-L546 WeakPolarHBondContact O-CD1 3.36Å
528	L	93.2	Very high	90.9	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-35.9	175.3	-81.7	173.9	0	0	0	113.4	V480 F482 L505 V524 N530 L640 I642 L674	V480-L528 HydrophobicContact CB-CD2 4.42Å; V480-L528 HydrophobicContact CG1-CD2 3.5Å; V480-L528 VanDerWaalsContact CG1-CD2 3.5Å; V480-L528 HydrophobicContact CG2-CD2 4.24Å; F482-L528 HydrophobicContact CE2-CD2 3.58Å; F482-L528 HydrophobicContact CE2-CG 3.95Å; F482-L528 HydrophobicContact CZ-CD2 3.92Å; F482-L528 HydrophobicContact CZ-CG 3.86Å; L505-L528 HydrophobicContact CD1-CD1 4.22Å; V524-L528 HydrophobicContact CG1-CD1 4.27Å; V524-L528 WeakPolarHBondContact O-CG 3.25Å; V524-L528 PolarHBondContact O-N 2.95Å; L528-N530 PolarHBondContact O-N 3.1Å; L528-L640 HydrophobicContact CD2-CD2 4.23Å; L528-I642 HydrophobicContact CB-CD1 3.61Å; L528-I642 HydrophobicContact CD1-CD1 3.94Å; L528-I642 HydrophobicContact CD1-CG1 4.36Å; L528-I642 HydrophobicContact CG-CD1 4.43Å; L528-L674 HydrophobicContact CD1-CD2 3.31Å
529	Q	91.7	Very high	91.4	Very high	40 Å²	40	32.1 Å²	32.1	19%	0.187	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	1.1	174.4	-71.3	172.7	82.6	0	0	112.7	A525 A526 L527 L531 H555 V558 A560 I642	A525-Q529 WeakPolarHBondContact O-CG 3.43Å; A525-Q529 PolarHBondContact O-N 3.38Å; A525-Q529 PolarHBondContact O-NE2 2.77Å; A526-Q529 PolarHBondContact O-N 3.16Å; L527-Q529 VanDerWaalsContact C-N 3.28Å; L527-Q529 PolarHBondContact O-N 3.07Å; Q529-L531 HydrophobicContact CB-CD1 4.14Å; Q529-L531 HydrophobicContact CB-CD2 4.42Å; Q529-L531 HydrophobicContact CB-CG 3.74Å; Q529-L531 PolarHBondContact O-N 3.41Å; Q529-L531 VanDerWaalsContact O-N 3.14Å; Q529-H555 PolarHBondContact O-CE1 3.04Å; Q529-H555 PolarHBondContact O-NE2 3.29Å; Q529-V558 HydrophobicContact CG-CG1 4.42Å; Q529-A560 HydrophobicContact CG-CB 3.99Å; Q529-A560 VanDerWaalsContact OE1-CB 3.3Å; Q529-I642 HydrophobicContact CG-CD1 4.03Å
530	N	90.9	Very high	91.7	Very high	29 Å²	29	32.9 Å²	32.9	16%	0.155	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	30.7	-173.8	-163.4	35.1	0	0	0	113	A526 L527 L528 Y532 L546 L554	A526-N530 PolarHBondContact O-N 3.5Å; L527-N530 WeakPolarHBondContact O-CA 3.39Å; L527-N530 PolarHBondContact O-N 3.48Å; L528-N530 PolarHBondContact O-N 3.1Å; N530-Y532 VanDerWaalsContact C-N 3.29Å; N530-L546 HydrophobicContact CB-CB 4.38Å; N530-L554 HydrophobicContact CB-CD2 3.55Å
531	L	89.2	Confident	92	Very high	60 Å²	60	32.8 Å²	32.8	31%	0.314	19%	0.19	S	C	.	.	S	Bend	trans	-73.8	-28.3	174.4	-61.1	179.2	0	0	0	111.1	T250 A526 Q529	T250-L531 HydrophobicContact CG2-CB 4.13Å; T250-L531 HydrophobicContact CG2-CD2 4.15Å; T250-L531 PolarHBondContact OG1-O 2.73Å; A526-L531 HydrophobicContact CB-CD1 4.49Å; A526-L531 WeakPolarHBondContact O-CB 3.45Å; A526-L531 PolarHBondContact O-N 3.05Å; Q529-L531 HydrophobicContact CB-CD1 4.14Å; Q529-L531 HydrophobicContact CB-CD2 4.42Å; Q529-L531 HydrophobicContact CB-CG 3.74Å; Q529-L531 PolarHBondContact O-N 3.41Å; Q529-L531 VanDerWaalsContact O-N 3.14Å
532	Y	89.4	Confident	92	Very high	36 Å²	36	34.3 Å²	34.3	14%	0.141	20%	0.199	C	C	.	.	S	Bend	trans	-132.4	152.7	172.6	-57	-82.5	0	0	0	109.6	T250 L254 F487 Y489 A526 L527 N530	T250-Y532 WeakPolarHBondContact OG1-CE1 3.47Å; T250-Y532 VanDerWaalsContact OG1-CZ 3.25Å; L254-Y532 HydrophobicContact CD1-CE1 4.07Å; L254-Y532 WeakPolarHBondContact CD1-OH 2.91Å; F487-Y532 HydrophobicContact CE2-CG 4.22Å; F487-Y532 HydrophobicContact CZ-CD1 4.07Å; F487-Y532 HydrophobicContact CZ-CD2 4.38Å; F487-Y532 AromaticContact CZ-CG 3.77Å; F487-Y532 HydrophobicContact CZ-CG 3.77Å; Y489-Y532 HydrophobicContact CD1-CE1 4.38Å; Y489-Y532 HydrophobicContact CE1-CD2 4.38Å; Y489-Y532 HydrophobicContact CE1-CE1 4.48Å; Y489-Y532 AromaticContact CE1-CE2 4Å; Y489-Y532 HydrophobicContact CE1-CE2 4Å; A526-Y532 HydrophobicContact CB-CD2 3.8Å; A526-Y532 HydrophobicContact CB-CE2 4.03Å; L527-Y532 VanDerWaalsContact CD2-O 3.3Å; L527-Y532 WeakPolarHBondContact CD2-O 3.46Å; N530-Y532 VanDerWaalsContact C-N 3.29Å
533	Q	88.3	Confident	92.1	Very high	76 Å²	76	33.7 Å²	33.7	36%	0.355	20%	0.202	S	C	.	.			trans	-94.8	143.5	170.9	-65.6	-169.3	-8.8	0	0	110.5	S465 F487 V547	S465-Q533 PolarHBondContact OG-NE2 3.45Å; F487-Q533 VanDerWaalsContact CD2-O 3.29Å; F487-Q533 WeakPolarHBondContact CD2-O 3.37Å; F487-Q533 VanDerWaalsContact CE2-O 3.28Å; F487-Q533 WeakPolarHBondContact CE2-O 3.27Å; Q533-V547 HydrophobicContact CG-CG2 4.13Å
534	P	91.3	Very high	92	Very high	35 Å²	35	37.3 Å²	37.3	23%	0.227	22%	0.218	C	C	.	.			trans	-63.6	144.3	174.3	29.9	-35.8	0	0	0	110.7	V485	V485-P534 HydrophobicContact CG1-CB 3.79Å
535	T	90	Very high	92	Very high	88 Å²	88	38.8 Å²	38.8	54%	0.54	23%	0.227	S	C	.	.	S	Bend	trans	-79.3	-24.9	175.8	53.7	0	0	0	0	112.1	S486 F487 A488	S486-T535 VanDerWaalsContact C-OG1 3.28Å; S486-T535 PolarHBondContact O-N 2.93Å; S486-T535 PolarHBondContact O-OG1 3.3Å; F487-T535 VanDerWaalsContact CA-OG1 3.28Å; F487-T535 WeakPolarHBondContact CA-OG1 3.28Å; F487-T535 PolarHBondContact N-OG1 3.34Å; A488-T535 HydrophobicContact CB-CG2 4.44Å
536	G	90.7	Very high	91.8	Very high	26 Å²	26	38.9 Å²	38.9	27%	0.268	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.8	172.5	0	0	0	0	0	111.1	V485 S486	V485-G536 WeakPolarHBondContact CA-O 3.25Å; S486-G536 PolarHBondContact N-O 3.23Å; S486-G536 PolarHBondContact O-N 3.25Å; S486-G536 VanDerWaalsContact O-N 3.1Å
537	G	92.7	Very high	91.6	Very high	39 Å²	39	40.7 Å²	40.7	40%	0.402	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	73.9	-166.3	-175.4	0	0	0	0	0	113.8	Q483 D484	Q483-G537 VanDerWaalsContact O-CA 3.25Å; Q483-G537 WeakPolarHBondContact O-CA 3.42Å; D484-G537 VanDerWaalsContact O-CA 3.29Å; D484-G537 WeakPolarHBondContact O-CA 3.37Å
538	K	93.4	Very high	91.4	Very high	127 Å²	127	44.7 Å²	44.7	55%	0.552	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.7	-178.1	-63.2	-178.7	-176.4	176.1	0	112.1	Q483 V485 L540	Q483-K538 PolarHBondContact N-O 3.42Å; Q483-K538 PolarHBondContact O-N 3.04Å; V485-K538 VanDerWaalsContact CG2-O 3.27Å; V485-K538 WeakPolarHBondContact CG2-O 3.4Å; K538-L540 HydrophobicContact CB-CD2 4.25Å
539	V	94.7	Very high	91.3	Very high	8 Å²	8	44.9 Å²	44.9	5%	0.048	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.1	167.4	-173.1	0	0	0	0	108	V480 F482 V485 P545 L546	V480-V539 HydrophobicContact CG1-CG1 4.29Å; F482-V539 HydrophobicContact CD1-CG2 3.89Å; F482-V539 HydrophobicContact CD2-CG1 4.26Å; F482-V539 HydrophobicContact CE1-CG1 4.31Å; F482-V539 HydrophobicContact CE1-CG2 3.63Å; F482-V539 HydrophobicContact CE2-CG1 3.88Å; F482-V539 HydrophobicContact CG-CG2 4.48Å; F482-V539 HydrophobicContact CZ-CG1 3.88Å; F482-V539 HydrophobicContact CZ-CG2 4.02Å; V485-V539 HydrophobicContact CG1-CG2 4.35Å; V485-V539 HydrophobicContact CG2-CG2 3.87Å; V539-P545 WeakPolarHBondContact O-CA 3.44Å; V539-L546 HydrophobicContact CB-CD1 3.92Å; V539-L546 HydrophobicContact CB-CG 4.36Å; V539-L546 HydrophobicContact CG1-CD1 3.43Å; V539-L546 VanDerWaalsContact CG1-CD1 3.43Å; V539-L546 HydrophobicContact CG1-CG 4.02Å; V539-L546 PolarHBondContact O-N 3.08Å; V539-L546 VanDerWaalsContact O-N 3.13Å
540	L	94.8	Very high	91.3	Very high	18 Å²	18	45.3 Å²	45.3	9%	0.094	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.3	-177.8	-52.4	175.7	0	0	0	110.1	V480 K481 K538 E544 P545	V480-L540 CarbonylContact C-O 3.51Å; V480-L540 WeakPolarHBondContact CA-O 3.4Å; K481-L540 HydrophobicContact CB-CB 4.36Å; K481-L540 PolarHBondContact N-O 3.47Å; K481-L540 PolarHBondContact O-N 3.17Å; K538-L540 HydrophobicContact CB-CD2 4.25Å; L540-E544 CarbonylContact C-O 3.58Å; L540-E544 VanDerWaalsContact CA-O 3.26Å; L540-E544 WeakPolarHBondContact CA-O 3.44Å; L540-P545 HydrophobicContact CD2-CB 4.17Å; L540-P545 HydrophobicContact CD2-CG 3.81Å
541	L	93.9	Very high	91.2	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.3	168.3	-178.2	65.1	0	0	0	107.3	M476 L479 V480 G543 E544 L546 Y549 L554	M476-L541 HydrophobicContact CE-CD2 3.53Å; M476-L541 HydrophobicContact CE-CG 4.33Å; M476-L541 HydrophobicContact SD-CD1 4.48Å; M476-L541 HydrophobicContact SD-CD2 3.88Å; M476-L541 HydrophobicContact SD-CG 4.39Å; L479-L541 CarbonylContact O-C 3.54Å; V480-L541 HydrophobicContact CG2-CD1 3.82Å; L541-G543 PolarHBondContact O-N 3.46Å; L541-E544 PolarHBondContact N-O 2.96Å; L541-E544 PolarHBondContact O-N 3.4Å; L541-L546 HydrophobicContact CB-CD2 3.72Å; L541-L546 HydrophobicContact CD2-CD2 4.03Å; L541-Y549 HydrophobicContact CB-CE2 3.97Å; L541-Y549 HydrophobicContact CD2-CE2 4.38Å; L541-Y549 PolarHBondContact O-OH 2.93Å; L541-L554 HydrophobicContact CD2-CD1 3.79Å
542	D	92.9	Very high	91.2	Very high	50 Å²	50	49.3 Å²	49.3	27%	0.267	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	22.6	-175.6	-67.9	-21.6	0	0	0	115.7	M476 K477 G478 L479	M476-D542 VanDerWaalsContact CG-OD2 3.23Å; M476-D542 WeakPolarHBondContact CG-OD2 3.48Å; K477-D542 WeakPolarHBondContact CB-OD1 3.35Å; K477-D542 PolarHBondContact N-OD2 3.36Å; G478-D542 PolarHBondContact N-OD1 3.45Å; G478-D542 PolarHBondContact N-OD2 2.98Å; L479-D542 WeakPolarHBondContact CB-OD1 3.2Å; L479-D542 PolarHBondContact N-OD1 3.31Å; L479-D542 PolarHBondContact O-N 3.47Å
543	G	91.1	Very high	91.2	Very high	45 Å²	45	49 Å²	49	46%	0.464	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.8	-14.8	-179.7	0	0	0	0	0	114.5	L541	L541-G543 PolarHBondContact O-N 3.46Å
544	E	92.6	Very high	91.4	Very high	84 Å²	84	45.4 Å²	45.4	39%	0.393	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.8	-179.5	-63.7	-60.2	161.3	0	0	111.9	L540 L541 Q548 Y549	L540-E544 CarbonylContact C-O 3.58Å; L540-E544 VanDerWaalsContact CA-O 3.26Å; L540-E544 WeakPolarHBondContact CA-O 3.44Å; L541-E544 PolarHBondContact N-O 2.96Å; L541-E544 PolarHBondContact O-N 3.4Å; E544-Q548 PolarHBondContact OE2-OE1 3.14Å; E544-Y549 HydrophobicContact CB-CE2 3.83Å
545	P	92.1	Very high	91.4	Very high	30 Å²	30	45.3 Å²	45.3	20%	0.195	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	139.2	176.1	-18.9	30.3	0	0	0	112.8	V539 L540 V547 Q548	V539-P545 WeakPolarHBondContact O-CA 3.44Å; L540-P545 HydrophobicContact CD2-CB 4.17Å; L540-P545 HydrophobicContact CD2-CG 3.81Å; P545-V547 PolarHBondContact O-N 3.38Å; P545-Q548 HydrophobicContact CB-CG 4.24Å; P545-Q548 HydrophobicContact CG-CG 4.33Å; P545-Q548 PolarHBondContact O-N 3.41Å
546	L	90	Very high	91.4	Very high	8 Å²	8	43.8 Å²	43.8	4%	0.042	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.6	179.8	-75.1	179.4	0	0	0	113.8	L527 N530 V539 L541 Q548 Y549 L554	L527-L546 VanDerWaalsContact O-CD1 3.3Å; L527-L546 WeakPolarHBondContact O-CD1 3.36Å; N530-L546 HydrophobicContact CB-CB 4.38Å; V539-L546 HydrophobicContact CB-CD1 3.92Å; V539-L546 HydrophobicContact CB-CG 4.36Å; V539-L546 HydrophobicContact CG1-CD1 3.43Å; V539-L546 VanDerWaalsContact CG1-CD1 3.43Å; V539-L546 HydrophobicContact CG1-CG 4.02Å; V539-L546 PolarHBondContact O-N 3.08Å; V539-L546 VanDerWaalsContact O-N 3.13Å; L541-L546 HydrophobicContact CB-CD2 3.72Å; L541-L546 HydrophobicContact CD2-CD2 4.03Å; L546-Q548 PolarHBondContact O-N 3.26Å; L546-Y549 PolarHBondContact O-N 3.12Å; L546-L554 HydrophobicContact CD2-CD1 3.9Å; L546-L554 HydrophobicContact CD2-CD2 4.43Å
547	V	87.4	Confident	91.4	Very high	49 Å²	49	44.3 Å²	44.3	30%	0.297	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-63.1	-24.3	-179.4	-176.1	0	0	0	0	112.8	P466 Q533 P545	P466-V547 HydrophobicContact CG-CG1 4.49Å; Q533-V547 HydrophobicContact CG-CG2 4.13Å; P545-V547 PolarHBondContact O-N 3.38Å
548	Q	90.1	Very high	91.4	Very high	86 Å²	86	42.5 Å²	42.5	40%	0.402	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-86.2	-12.9	-177.6	-49	-176	0.6	0	0	113.5	G469 S470 L471 E544 P545 L546	G469-Q548 CarbonylContact C-O 3.56Å; G469-Q548 VanDerWaalsContact CA-O 3.26Å; G469-Q548 WeakPolarHBondContact CA-O 3.48Å; S470-Q548 PolarHBondContact N-O 3.06Å; S470-Q548 VanDerWaalsContact N-O 3.14Å; L471-Q548 WeakPolarHBondContact CB-O 3.12Å; L471-Q548 HydrophobicContact CD1-CB 3.41Å; L471-Q548 VanDerWaalsContact CD1-CB 3.41Å; L471-Q548 HydrophobicContact CD1-CG 4.47Å; L471-Q548 PolarHBondContact N-O 3.2Å; E544-Q548 PolarHBondContact OE2-OE1 3.14Å; P545-Q548 HydrophobicContact CB-CG 4.24Å; P545-Q548 HydrophobicContact CG-CG 4.33Å; P545-Q548 PolarHBondContact O-N 3.41Å; L546-Q548 PolarHBondContact O-N 3.26Å
549	Y	90.6	Very high	91.4	Very high	6 Å²	6	36.7 Å²	36.7	2%	0.024	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-73.8	146.2	176.4	-74.4	-91.1	0	0	0	111.6	G469 L471 P473 M476 L541 E544 L546 H551 Y553	G469-Y549 PolarHBondContact N-O 3.06Å; L471-Y549 HydrophobicContact CB-CD1 4.26Å; L471-Y549 WeakPolarHBondContact O-CA 3.21Å; P473-Y549 HydrophobicContact CG-CE1 3.91Å; M476-Y549 HydrophobicContact CE-CE1 4.15Å; L541-Y549 HydrophobicContact CB-CE2 3.97Å; L541-Y549 HydrophobicContact CD2-CE2 4.38Å; L541-Y549 PolarHBondContact O-OH 2.93Å; E544-Y549 HydrophobicContact CB-CE2 3.83Å; L546-Y549 PolarHBondContact O-N 3.12Å; Y549-H551 PolarHBondContact O-N 3.12Å; Y549-Y553 AromaticContact CD1-CD1 4Å; Y549-Y553 HydrophobicContact CD1-CD1 4Å; Y549-Y553 AromaticContact CD1-CE1 3.94Å; Y549-Y553 HydrophobicContact CD1-CE1 3.94Å; Y549-Y553 HydrophobicContact CE1-CE1 4.18Å
550	D	91.1	Very high	91.4	Very high	50 Å²	50	38 Å²	38	27%	0.267	21%	0.209	S	C	.	.			trans	-64.7	132	166	175.3	78.6	0	0	0	109.7	S468 G469 L471 H552 Y553 L554	S468-D550 VanDerWaalsContact OG-CA 3.29Å; S468-D550 WeakPolarHBondContact OG-CA 3.29Å; S468-D550 PolarHBondContact OG-OD1 3.41Å; G469-D550 WeakPolarHBondContact O-CA 3.4Å; L471-D550 PolarHBondContact O-N 3.49Å; D550-H552 PolarHBondContact O-N 2.86Å; D550-H552 WeakPolarHBondContact OD2-CB 3.46Å; D550-H552 PolarHBondContact OD2-N 2.89Å; D550-H552 VanDerWaalsContact OD2-N 3.08Å; D550-Y553 PolarHBondContact O-N 2.94Å; D550-Y553 PolarHBondContact OD2-N 2.86Å; D550-L554 WeakPolarHBondContact O-CB 3.49Å; D550-L554 PolarHBondContact O-N 3.5Å
551	H	88.6	Confident	91.3	Very high	77 Å²	77	37.3 Å²	37.3	36%	0.356	21%	0.205	S	C	.	.	H	α-helix	trans	-61.6	-43.7	-175.7	176.3	82.7	0	0	0	112.6	L467 S468 Y549 Y553 L554 H555	L467-H551 WeakPolarHBondContact O-CB 3.23Å; S468-H551 PolarHBondContact OG-N 2.92Å; Y549-H551 PolarHBondContact O-N 3.12Å; H551-Y553 VanDerWaalsContact C-N 3.35Å; H551-L554 PolarHBondContact O-N 2.8Å; H551-H555 AromaticContact CD2-CD2 3.97Å; H551-H555 AromaticContact CE1-CD2 3.17Å; H551-H555 PolarHBondContact CE1-CD2 3.23Å; H551-H555 AromaticContact CE1-NE2 3.09Å; H551-H555 PolarHBondContact CE1-NE2 3.19Å; H551-H555 AromaticContact CG-CD2 3.85Å; H551-H555 AromaticContact ND1-CD2 3.36Å; H551-H555 PolarHBondContact ND1-CD2 3.43Å; H551-H555 AromaticContact ND1-NE2 3.4Å; H551-H555 PolarHBondContact ND1-NE2 3.32Å; H551-H555 AromaticContact NE2-CD2 3.56Å; H551-H555 AromaticContact NE2-NE2 3.9Å; H551-H555 PolarHBondContact O-CD2 3.24Å; H551-H555 PolarHBondContact O-N 3.24Å
552	H	88.6	Confident	91.1	Very high	95 Å²	95	38.8 Å²	38.8	44%	0.44	22%	0.221	S	C	.	.	H	α-helix	trans	-65	-43.5	178	-179.8	-74.2	0	0	0	110.4	D550 T556	D550-H552 PolarHBondContact O-N 2.86Å; D550-H552 WeakPolarHBondContact OD2-CB 3.46Å; D550-H552 PolarHBondContact OD2-N 2.89Å; D550-H552 VanDerWaalsContact OD2-N 3.08Å; H552-T556 PolarHBondContact O-N 3.13Å; H552-T556 VanDerWaalsContact O-N 3.13Å; H552-T556 PolarHBondContact O-OG1 3.38Å
553	Y	90.7	Very high	90.8	Very high	30 Å²	30	41 Å²	41	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-48.9	174.6	176	-94.3	0	0	0	112	A472 P473 M476 Y549 D550 H551 H555 T556 Q557	A472-Y553 HydrophobicContact CB-CD1 4.39Å; A472-Y553 HydrophobicContact CB-CD2 3.82Å; A472-Y553 HydrophobicContact CB-CE2 4.42Å; A472-Y553 HydrophobicContact CB-CG 3.81Å; P473-Y553 HydrophobicContact CG-CE1 4.03Å; P473-Y553 WeakPolarHBondContact O-CE2 3.39Å; P473-Y553 PolarHBondContact O-OH 3.08Å; M476-Y553 HydrophobicContact CE-CD1 4.48Å; M476-Y553 HydrophobicContact CE-CE1 3.46Å; M476-Y553 VanDerWaalsContact CE-CE1 3.46Å; Y549-Y553 AromaticContact CD1-CD1 4Å; Y549-Y553 HydrophobicContact CD1-CD1 4Å; Y549-Y553 AromaticContact CD1-CE1 3.94Å; Y549-Y553 HydrophobicContact CD1-CE1 3.94Å; Y549-Y553 HydrophobicContact CE1-CE1 4.18Å; D550-Y553 PolarHBondContact O-N 2.94Å; D550-Y553 PolarHBondContact OD2-N 2.86Å; H551-Y553 VanDerWaalsContact C-N 3.35Å; Y553-H555 PolarHBondContact O-N 3.09Å; Y553-T556 WeakPolarHBondContact O-CB 3.15Å; Y553-T556 PolarHBondContact O-N 2.92Å; Y553-T556 VanDerWaalsContact O-N 3.09Å; Y553-Q557 HydrophobicContact CD1-CG 4.49Å; Y553-Q557 HydrophobicContact CE1-CG 3.98Å; Y553-Q557 HydrophobicContact CE2-CG 4.17Å; Y553-Q557 PolarHBondContact O-N 2.69Å
554	L	91.9	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.2	-47.6	179.8	-177.6	67.6	0	0	0	111.4	N530 L541 L546 D550 H551 T556 Q557 V558	N530-L554 HydrophobicContact CB-CD2 3.55Å; L541-L554 HydrophobicContact CD2-CD1 3.79Å; L546-L554 HydrophobicContact CD2-CD1 3.9Å; L546-L554 HydrophobicContact CD2-CD2 4.43Å; D550-L554 WeakPolarHBondContact O-CB 3.49Å; D550-L554 PolarHBondContact O-N 3.5Å; H551-L554 PolarHBondContact O-N 2.8Å; L554-T556 PolarHBondContact O-N 3.43Å; L554-Q557 CarbonylContact O-C 3.6Å; L554-Q557 PolarHBondContact O-N 3.22Å; L554-V558 HydrophobicContact CD1-CG2 3.7Å; L554-V558 HydrophobicContact CG-CG2 4.21Å; L554-V558 WeakPolarHBondContact O-CB 3.48Å; L554-V558 WeakPolarHBondContact O-CG2 3.27Å; L554-V558 PolarHBondContact O-N 3.43Å
555	H	91	Very high	90.1	Very high	34 Å²	34	43.3 Å²	43.3	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-77	-5	179.9	-73.2	-71.4	0	0	0	114.9	Q529 H551 Y553 R636	Q529-H555 PolarHBondContact O-CE1 3.04Å; Q529-H555 PolarHBondContact O-NE2 3.29Å; H551-H555 AromaticContact CD2-CD2 3.97Å; H551-H555 AromaticContact CE1-CD2 3.17Å; H551-H555 PolarHBondContact CE1-CD2 3.23Å; H551-H555 AromaticContact CE1-NE2 3.09Å; H551-H555 PolarHBondContact CE1-NE2 3.19Å; H551-H555 AromaticContact CG-CD2 3.85Å; H551-H555 AromaticContact ND1-CD2 3.36Å; H551-H555 PolarHBondContact ND1-CD2 3.43Å; H551-H555 AromaticContact ND1-NE2 3.4Å; H551-H555 PolarHBondContact ND1-NE2 3.32Å; H551-H555 AromaticContact NE2-CD2 3.56Å; H551-H555 AromaticContact NE2-NE2 3.9Å; H551-H555 PolarHBondContact O-CD2 3.24Å; H551-H555 PolarHBondContact O-N 3.24Å; Y553-H555 PolarHBondContact O-N 3.09Å; H555-R636 PolarHBondContact O-NH1 3.08Å; H555-R636 VanDerWaalsContact O-NH1 3.08Å
556	T	89.6	Confident	89.9	Confident	56 Å²	56	47.6 Å²	47.6	34%	0.344	25%	0.251	S	S	.	.	H	α-helix	trans	-81.4	-37	164.1	-54.4	0	0	0	0	110.5	H552 Y553 L554	H552-T556 PolarHBondContact O-N 3.13Å; H552-T556 VanDerWaalsContact O-N 3.13Å; H552-T556 PolarHBondContact O-OG1 3.38Å; Y553-T556 WeakPolarHBondContact O-CB 3.15Å; Y553-T556 PolarHBondContact O-N 2.92Å; Y553-T556 VanDerWaalsContact O-N 3.09Å; L554-T556 PolarHBondContact O-N 3.43Å
557	Q	91.8	Very high	89.9	Confident	36 Å²	36	47.5 Å²	47.5	17%	0.168	25%	0.25	C	C	.	.	H	α-helix	trans	-88.9	-26.6	-178	-57.9	-58.5	-36.6	0	0	113.9	M476 Y553 L554 P638 R639 L640	M476-Q557 HydrophobicContact CE-CB 3.77Å; M476-Q557 HydrophobicContact CE-CG 3.7Å; M476-Q557 HydrophobicContact SD-CB 3.5Å; M476-Q557 WeakPolarHBondContact SD-CB 3.4Å; M476-Q557 HydrophobicContact SD-CG 3.84Å; Y553-Q557 HydrophobicContact CD1-CG 4.49Å; Y553-Q557 HydrophobicContact CE1-CG 3.98Å; Y553-Q557 HydrophobicContact CE2-CG 4.17Å; Y553-Q557 PolarHBondContact O-N 2.69Å; L554-Q557 CarbonylContact O-C 3.6Å; L554-Q557 PolarHBondContact O-N 3.22Å; Q557-P638 CarbonylContact O-C 3.55Å; Q557-P638 WeakPolarHBondContact O-CA 3.13Å; Q557-P638 VanDerWaalsContact O-CB 3.27Å; Q557-P638 WeakPolarHBondContact O-CB 3.37Å; Q557-R639 PolarHBondContact O-N 3.38Å; Q557-L640 PolarHBondContact O-N 2.8Å
558	V	93.1	Very high	89.9	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.4	179.7	-175	0	0	0	0	108.9	Q529 L554 L640 I642	Q529-V558 HydrophobicContact CG-CG1 4.42Å; L554-V558 HydrophobicContact CD1-CG2 3.7Å; L554-V558 HydrophobicContact CG-CG2 4.21Å; L554-V558 WeakPolarHBondContact O-CB 3.48Å; L554-V558 WeakPolarHBondContact O-CG2 3.27Å; L554-V558 PolarHBondContact O-N 3.43Å; V558-L640 WeakPolarHBondContact CA-O 3.2Å; V558-L640 HydrophobicContact CG1-CB 4.44Å; V558-L640 HydrophobicContact CG1-CD2 3.98Å; V558-L640 HydrophobicContact CG1-CG 4.26Å; V558-L640 HydrophobicContact CG2-CB 4.16Å; V558-L640 HydrophobicContact CG2-CD2 4.03Å; V558-I642 HydrophobicContact CG1-CD1 3.97Å
559	A	93.6	Very high	89.9	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.4	171.3	0	0	0	0	0	110.3	A633 P638 L640 L641 I642	A559-A633 HydrophobicContact CB-CB 3.87Å; A559-P638 HydrophobicContact CB-CB 3.75Å; A559-P638 HydrophobicContact CB-CG 3.68Å; A559-L640 PolarHBondContact N-O 3.44Å; A559-L641 HydrophobicContact CB-CD1 4.26Å; A559-L641 WeakPolarHBondContact O-CA 3.26Å; A559-I642 PolarHBondContact O-N 3.48Å
560	A	93.3	Very high	90	Very high	35 Å²	35	52.5 Å²	52.5	29%	0.289	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141	177	0	0	0	0	0	110.8	Q529 I642	Q529-A560 HydrophobicContact CG-CB 3.99Å; Q529-A560 VanDerWaalsContact OE1-CB 3.3Å; A560-I642 CarbonylContact C-O 3.47Å; A560-I642 VanDerWaalsContact CA-O 3.28Å; A560-I642 WeakPolarHBondContact CA-O 3.25Å; A560-I642 HydrophobicContact CB-CB 3.99Å; A560-I642 HydrophobicContact CB-CD1 4.45Å
561	V	93.6	Very high	90.1	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.8	168.3	-171.2	0	0	0	0	106.8	A629 L630 A633 I642 L643 D644 A646	V561-A629 HydrophobicContact CG1-CB 3.91Å; V561-L630 HydrophobicContact CG2-CD1 4.15Å; V561-A633 HydrophobicContact CG2-CB 3.68Å; V561-I642 PolarHBondContact N-O 2.96Å; V561-L643 HydrophobicContact CB-CD2 3.95Å; V561-L643 HydrophobicContact CG2-CD2 3.8Å; V561-D644 PolarHBondContact O-N 3.45Å; V561-A646 HydrophobicContact CB-CB 3.74Å; V561-A646 HydrophobicContact CG1-CB 3.48Å; V561-A646 VanDerWaalsContact CG1-CB 3.48Å
562	G	89.8	Confident	90.3	Very high	34 Å²	34	47.1 Å²	47.1	35%	0.351	25%	0.253	S	S	.	.			trans	-77.9	166.6	178.7	0	0	0	0	0	112.7	E564 P565 D644	G562-E564 PolarHBondContact O-N 3.29Å; G562-P565 WeakPolarHBondContact O-CD 3.29Å; G562-D644 CarbonylContact C-O 3.57Å
563	Q	86.6	Confident	90.6	Very high	96 Å²	96	46.5 Å²	46.5	45%	0.449	25%	0.247	S	C	.	.	S	Bend	trans	-57.6	-46.9	179.8	-177.2	175.4	9.7	0	0	112.3	P565 Q626 D644 D645	Q563-P565 WeakPolarHBondContact O-CD 3.42Å; Q563-Q626 PolarHBondContact O-NE2 3.33Å; Q563-Q626 VanDerWaalsContact O-NE2 3.13Å; Q563-D644 WeakPolarHBondContact CA-O 3.41Å; Q563-D644 PolarHBondContact N-O 3.49Å; Q563-D645 HydrophobicContact CB-CB 4.49Å; Q563-D645 HydrophobicContact CG-CB 4.17Å
564	E	84.4	Confident	90.8	Very high	162 Å²	162	49.8 Å²	49.8	76%	0.757	26%	0.263	S	S	*	.	S	Bend	trans	-116.1	85.8	175.2	-66.2	-173	167.7	0	0	110.1	G562 L566	G562-E564 PolarHBondContact O-N 3.29Å; E564-L566 PolarHBondContact O-N 3.34Å
565	P	85.3	Confident	90.9	Very high	15 Å²	15	49.8 Å²	49.8	10%	0.097	26%	0.263	C	S	.	.			trans	-73.3	130.9	-176.7	25.4	-28.5	0	0	0	111.5	G562 Q563 R625 Q626 A629	G562-P565 WeakPolarHBondContact O-CD 3.29Å; Q563-P565 WeakPolarHBondContact O-CD 3.42Å; P565-R625 HydrophobicContact CG-CB 4.3Å; P565-Q626 HydrophobicContact CG-CB 4.48Å; P565-Q626 HydrophobicContact CG-CG 3.93Å; P565-A629 HydrophobicContact CB-CB 3.33Å; P565-A629 HydrophobicContact CG-CB 3.72Å
566	L	86.4	Confident	91.1	Very high	121 Å²	121	48.1 Å²	48.1	63%	0.634	26%	0.256	S	S	*	.			trans	-86.8	135.5	174.7	-62.4	171.9	0	0	0	110.8	E564 R632	E564-L566 PolarHBondContact O-N 3.34Å; L566-R632 PolarHBondContact O-NH1 2.75Å
567	L	89.7	Confident	91.3	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.026	25%	0.248	C	C	.	.			trans	-107.1	146.6	171.8	-56.5	-178	0	0	0	109.8	V613 T616 L620 R625 V628	L567-V613 HydrophobicContact CB-CG1 4.06Å; L567-V613 HydrophobicContact CD1-CG1 3.69Å; L567-T616 WeakPolarHBondContact O-CA 2.99Å; L567-L620 HydrophobicContact CD1-CD1 3.56Å; L567-R625 HydrophobicContact CD1-CB 4.39Å; L567-R625 HydrophobicContact CD1-CG 4Å; L567-R625 HydrophobicContact CG-CG 4.46Å; L567-V628 HydrophobicContact CD1-CB 4.25Å; L567-V628 HydrophobicContact CD1-CG1 4.26Å; L567-V628 HydrophobicContact CD2-CB 4.13Å; L567-V628 HydrophobicContact CD2-CG1 3.77Å
568	F	89.3	Confident	91.3	Very high	84 Å²	84	48.9 Å²	48.9	37%	0.368	26%	0.256	S	S	.	.			trans	-83.7	150.2	175.5	-64.6	-79.4	0	0	0	109.4	R570 N575 Y578	F568-R570 HydrophobicContact CB-CG 4.14Å; F568-R570 PolarHBondContact O-N 3.03Å; F568-N575 PolarHBondContact N-OD1 3.42Å; F568-N575 PolarHBondContact O-ND2 2.87Å; F568-N575 PolarHBondContact O-OD1 3.45Å; F568-Y578 AromaticContact CD2-CD2 3.86Å; F568-Y578 HydrophobicContact CD2-CD2 3.86Å; F568-Y578 HydrophobicContact CD2-CE1 4.49Å; F568-Y578 AromaticContact CD2-CE2 3.83Å; F568-Y578 HydrophobicContact CD2-CE2 3.83Å; F568-Y578 HydrophobicContact CD2-CG 4.2Å; F568-Y578 AromaticContact CE2-CD1 3.84Å; F568-Y578 HydrophobicContact CE2-CD1 3.84Å; F568-Y578 AromaticContact CE2-CD2 3.81Å; F568-Y578 HydrophobicContact CE2-CD2 3.81Å; F568-Y578 AromaticContact CE2-CE1 3.52Å; F568-Y578 HydrophobicContact CE2-CE1 3.52Å; F568-Y578 AromaticContact CE2-CE2 3.48Å; F568-Y578 HydrophobicContact CE2-CE2 3.48Å; F568-Y578 VanDerWaalsContact CE2-CE2 3.48Å; F568-Y578 AromaticContact CE2-CG 3.98Å; F568-Y578 HydrophobicContact CE2-CG 3.98Å; F568-Y578 AromaticContact CE2-CZ 3.33Å; F568-Y578 AromaticContact CZ-CE1 3.97Å; F568-Y578 HydrophobicContact CZ-CE1 3.97Å; F568-Y578 AromaticContact CZ-CE2 3.9Å; F568-Y578 HydrophobicContact CZ-CE2 3.9Å; F568-Y578 AromaticContact CZ-CZ 3.5Å; F568-Y578 WeakPolarHBondContact CZ-OH 3.38Å
569	G	89.8	Confident	91	Very high	52 Å²	52	51.2 Å²	51.2	54%	0.536	28%	0.28	S	S	.	.	S	Bend	trans	-68.8	72.2	172.3	0	0	0	0	0	111.3	G614	G569-G614 WeakPolarHBondContact CA-O 3.38Å
570	R	91.5	Very high	90.8	Very high	111 Å²	111	53 Å²	53	42%	0.419	29%	0.289	S	S	.	.	S	Bend	trans	-146.2	172.4	-174.9	-67.1	-174.9	-173.8	-172.4	-0.2	108.5	F568 E574 N575 V613	F568-R570 HydrophobicContact CB-CG 4.14Å; F568-R570 PolarHBondContact O-N 3.03Å; R570-E574 HydrophobicContact CB-CB 3.92Å; R570-E574 WeakPolarHBondContact CB-OE2 3.43Å; R570-E574 WeakPolarHBondContact CD-OE2 3.42Å; R570-E574 WeakPolarHBondContact CG-OE2 3.48Å; R570-N575 PolarHBondContact O-ND2 2.92Å; R570-N575 VanDerWaalsContact O-ND2 3.13Å; R570-V613 WeakPolarHBondContact O-CG2 3.47Å; R570-V613 PolarHBondContact O-N 3.19Å
571	S	93.1	Very high	90.4	Very high	12 Å²	12	57.5 Å²	57.5	8%	0.084	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-62.4	161	173.7	66.6	0	0	0	0	112.6	R573 E574 N575 T611	S571-R573 VanDerWaalsContact C-N 3.27Å; S571-R573 PolarHBondContact O-N 2.64Å; S571-E574 PolarHBondContact O-N 3.31Å; S571-E574 WeakPolarHBondContact OG-CB 3.28Å; S571-E574 WeakPolarHBondContact OG-CG 3.12Å; S571-E574 PolarHBondContact OG-N 3.45Å; S571-N575 WeakPolarHBondContact O-CB 3.48Å; S571-N575 PolarHBondContact O-N 2.9Å; S571-N575 PolarHBondContact O-ND2 3.19Å; S571-T611 VanDerWaalsContact CA-O 3.26Å; S571-T611 WeakPolarHBondContact CA-O 3.44Å
572	F	94.3	Very high	90.1	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-58	-42.3	171.9	-73	-71.3	0	0	0	111.7	E574 N575 I576 F601 I602 F605 Y609 T611 V613 L620 V628	F572-E574 VanDerWaalsContact C-N 3.34Å; F572-E574 PolarHBondContact O-N 2.97Å; F572-N575 PolarHBondContact O-N 3.4Å; F572-I576 WeakPolarHBondContact O-CG1 3.34Å; F572-I576 PolarHBondContact O-N 3.47Å; F572-F601 AromaticContact CE1-CE2 3.87Å; F572-F601 HydrophobicContact CE1-CE2 3.87Å; F572-F601 HydrophobicContact CE1-CZ 4.48Å; F572-F601 HydrophobicContact CZ-CE2 4.01Å; F572-I602 HydrophobicContact CB-CD1 4.24Å; F572-I602 HydrophobicContact CB-CG2 4.34Å; F572-I602 HydrophobicContact CD1-CD1 4.02Å; F572-I602 HydrophobicContact CD1-CG1 3.94Å; F572-I602 HydrophobicContact CD2-CG1 4.24Å; F572-I602 HydrophobicContact CD2-CG2 4.03Å; F572-I602 HydrophobicContact CE1-CG1 4.1Å; F572-I602 HydrophobicContact CE2-CG1 4.4Å; F572-I602 HydrophobicContact CG-CD1 4.14Å; F572-I602 HydrophobicContact CG-CG1 4Å; F572-I602 HydrophobicContact CG-CG2 4.24Å; F572-I602 HydrophobicContact CZ-CG1 4.33Å; F572-F605 AromaticContact CE2-CD2 3.91Å; F572-F605 HydrophobicContact CE2-CD2 3.91Å; F572-F605 HydrophobicContact CE2-CE2 4.05Å; F572-F605 HydrophobicContact CE2-CG 4.33Å; F572-F605 HydrophobicContact CZ-CD2 4.19Å; F572-F605 AromaticContact CZ-CE2 3.88Å; F572-F605 HydrophobicContact CZ-CE2 3.88Å; F572-F605 HydrophobicContact CZ-CZ 4.35Å; F572-Y609 HydrophobicContact CB-CD1 4.48Å; F572-Y609 PolarHBondContact N-O 3.44Å; F572-T611 HydrophobicContact CE2-CG2 4.15Å; F572-T611 PolarHBondContact N-O 2.88Å; F572-T611 VanDerWaalsContact N-O 3.17Å; F572-V613 HydrophobicContact CD1-CG2 3.59Å; F572-V613 HydrophobicContact CD2-CG2 4.27Å; F572-V613 HydrophobicContact CE1-CG2 3.62Å; F572-V613 HydrophobicContact CE2-CG2 4.29Å; F572-V613 HydrophobicContact CG-CG2 3.94Å; F572-V613 HydrophobicContact CZ-CG2 3.98Å; F572-L620 HydrophobicContact CE1-CD1 3.72Å; F572-L620 HydrophobicContact CE1-CD2 4.26Å; F572-L620 HydrophobicContact CZ-CD1 4.2Å; F572-L620 HydrophobicContact CZ-CD2 3.93Å; F572-V628 HydrophobicContact CD1-CG2 3.97Å; F572-V628 HydrophobicContact CE1-CG2 4.04Å
573	R	94.6	Very high	90.1	Very high	83 Å²	83	67.5 Å²	67.5	31%	0.313	36%	0.355	S	S	.	.	H	α-helix	trans	-52.5	-51.8	175.6	-175.3	-164.5	-63.8	-95.8	-0.7	111.4	S571 I576 A577 M586 I589 Y609 D610	S571-R573 VanDerWaalsContact C-N 3.27Å; S571-R573 PolarHBondContact O-N 2.64Å; R573-I576 PolarHBondContact O-N 2.64Å; R573-A577 WeakPolarHBondContact O-CB 3.38Å; R573-A577 PolarHBondContact O-N 2.89Å; R573-M586 VanDerWaalsContact CZ-SD 3.52Å; R573-M586 PolarHBondContact NH1-SD 2.87Å; R573-I589 HydrophobicContact CG-CD1 3.56Å; R573-Y609 PolarHBondContact N-O 2.9Å; R573-D610 IonicContact CZ-OD1 3.41Å; R573-D610 IonicContact NE-OD1 2.78Å; R573-D610 PolarHBondContact NE-OD1 3.26Å; R573-D610 IonicContact NH2-OD1 3.44Å; R573-D610 PolarHBondContact NH2-OD1 2.9Å; R573-D610 IonicContact NH2-OD2 2.92Å; R573-D610 PolarHBondContact NH2-OD2 2.94Å
574	E	93.8	Very high	90.4	Very high	98 Å²	98	64 Å²	64	46%	0.458	34%	0.34	S	S	.	.	H	α-helix	trans	-69.6	-33.1	-179.4	-73.6	177.4	-163.6	0	0	112.9	R570 S571 F572 Y578	R570-E574 HydrophobicContact CB-CB 3.92Å; R570-E574 WeakPolarHBondContact CB-OE2 3.43Å; R570-E574 WeakPolarHBondContact CD-OE2 3.42Å; R570-E574 WeakPolarHBondContact CG-OE2 3.48Å; S571-E574 PolarHBondContact O-N 3.31Å; S571-E574 WeakPolarHBondContact OG-CB 3.28Å; S571-E574 WeakPolarHBondContact OG-CG 3.12Å; S571-E574 PolarHBondContact OG-N 3.45Å; F572-E574 VanDerWaalsContact C-N 3.34Å; F572-E574 PolarHBondContact O-N 2.97Å; E574-Y578 PolarHBondContact O-N 2.96Å; E574-Y578 VanDerWaalsContact O-N 3.16Å
575	N	94	Very high	90.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-40.5	174.4	-91	-76.6	0	0	0	112	F568 R570 S571 F572 Y578 V628 R632	F568-N575 PolarHBondContact N-OD1 3.42Å; F568-N575 PolarHBondContact O-ND2 2.87Å; F568-N575 PolarHBondContact O-OD1 3.45Å; R570-N575 PolarHBondContact O-ND2 2.92Å; R570-N575 VanDerWaalsContact O-ND2 3.13Å; S571-N575 WeakPolarHBondContact O-CB 3.48Å; S571-N575 PolarHBondContact O-N 2.9Å; S571-N575 PolarHBondContact O-ND2 3.19Å; F572-N575 PolarHBondContact O-N 3.4Å; N575-Y578 WeakPolarHBondContact O-CB 3.32Å; N575-V628 HydrophobicContact CB-CG1 4.19Å; N575-R632 PolarHBondContact O-NE 3.45Å; N575-R632 PolarHBondContact O-NH2 3.26Å; N575-R632 PolarHBondContact OD1-NH2 3.26Å
576	I	95.1	Very high	91.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-70.1	-43.7	176.8	-65.7	168.5	0	0	0	110	F572 R573 Y578 I589 V592 A593 I602 Y609 V628 A631 I635	F572-I576 WeakPolarHBondContact O-CG1 3.34Å; F572-I576 PolarHBondContact O-N 3.47Å; R573-I576 PolarHBondContact O-N 2.64Å; I576-Y578 PolarHBondContact O-N 3.28Å; I576-I589 HydrophobicContact CB-CG2 4.38Å; I576-I589 HydrophobicContact CD1-CG2 3.9Å; I576-I589 HydrophobicContact CG2-CG2 4.21Å; I576-V592 HydrophobicContact CG2-CG2 3.91Å; I576-A593 HydrophobicContact CD1-CB 4.38Å; I576-I602 HydrophobicContact CD1-CD1 4.29Å; I576-Y609 HydrophobicContact CD1-CD1 4.4Å; I576-Y609 HydrophobicContact CD1-CE1 4.1Å; I576-V628 HydrophobicContact CG1-CG1 4.19Å; I576-A631 HydrophobicContact CD1-CB 4.23Å; I576-A631 HydrophobicContact CG1-CB 4.04Å; I576-A631 HydrophobicContact CG2-CB 4.18Å; I576-I635 HydrophobicContact CG2-CD1 3.93Å; I576-I635 WeakPolarHBondContact O-CG2 3.43Å
577	A	94.2	Very high	91.7	Very high	22 Å²	22	61.7 Å²	61.7	18%	0.182	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	4.3	-179.6	0	0	0	0	0	114.7	R573 G579 L580 P584	R573-A577 WeakPolarHBondContact O-CB 3.38Å; R573-A577 PolarHBondContact O-N 2.89Å; A577-G579 PolarHBondContact O-N 3.37Å; A577-L580 HydrophobicContact CB-CD1 4.47Å; A577-L580 PolarHBondContact O-N 3.47Å; A577-P584 HydrophobicContact CB-CG 3.57Å
578	Y	93	Very high	91.8	Very high	85 Å²	85	64.4 Å²	64.4	33%	0.333	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	126.9	-170.9	-177.4	-97.4	0	0	0	113.2	F568 E574 N575 I576 R636	F568-Y578 AromaticContact CD2-CD2 3.86Å; F568-Y578 HydrophobicContact CD2-CD2 3.86Å; F568-Y578 HydrophobicContact CD2-CE1 4.49Å; F568-Y578 AromaticContact CD2-CE2 3.83Å; F568-Y578 HydrophobicContact CD2-CE2 3.83Å; F568-Y578 HydrophobicContact CD2-CG 4.2Å; F568-Y578 AromaticContact CE2-CD1 3.84Å; F568-Y578 HydrophobicContact CE2-CD1 3.84Å; F568-Y578 AromaticContact CE2-CD2 3.81Å; F568-Y578 HydrophobicContact CE2-CD2 3.81Å; F568-Y578 AromaticContact CE2-CE1 3.52Å; F568-Y578 HydrophobicContact CE2-CE1 3.52Å; F568-Y578 AromaticContact CE2-CE2 3.48Å; F568-Y578 HydrophobicContact CE2-CE2 3.48Å; F568-Y578 VanDerWaalsContact CE2-CE2 3.48Å; F568-Y578 AromaticContact CE2-CG 3.98Å; F568-Y578 HydrophobicContact CE2-CG 3.98Å; F568-Y578 AromaticContact CE2-CZ 3.33Å; F568-Y578 AromaticContact CZ-CE1 3.97Å; F568-Y578 HydrophobicContact CZ-CE1 3.97Å; F568-Y578 AromaticContact CZ-CE2 3.9Å; F568-Y578 HydrophobicContact CZ-CE2 3.9Å; F568-Y578 AromaticContact CZ-CZ 3.5Å; F568-Y578 WeakPolarHBondContact CZ-OH 3.38Å; E574-Y578 PolarHBondContact O-N 2.96Å; E574-Y578 VanDerWaalsContact O-N 3.16Å; N575-Y578 WeakPolarHBondContact O-CB 3.32Å; I576-Y578 PolarHBondContact O-N 3.28Å; Y578-R636 PolarHBondContact O-NH2 2.96Å
579	G	86.3	Confident	92.1	Very high	51 Å²	51	60.6 Å²	60.6	53%	0.526	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	10.3	176.8	0	0	0	0	0	114.9	A577	A577-G579 PolarHBondContact O-N 3.37Å
580	L	88.9	Confident	92.3	Very high	44 Å²	44	59.8 Å²	59.8	23%	0.23	31%	0.311	C	S	.	.			trans	-82.8	135.5	168.4	-66	171.6	0	0	0	110.2	A577 R582 P584 I635 R636	A577-L580 HydrophobicContact CB-CD1 4.47Å; A577-L580 PolarHBondContact O-N 3.47Å; L580-R582 VanDerWaalsContact C-N 3.34Å; L580-R582 WeakPolarHBondContact CB-O 3.26Å; L580-P584 HydrophobicContact CD1-CB 4.28Å; L580-P584 HydrophobicContact CD1-CG 3.89Å; L580-I635 HydrophobicContact CD1-CD1 3.99Å; L580-I635 HydrophobicContact CD1-CG1 4.08Å; L580-I635 HydrophobicContact CD1-CG2 4.05Å; L580-R636 HydrophobicContact CD2-CG 4.01Å
581	T	84.1	Confident	92.4	Very high	128 Å²	128	56.6 Å²	56.6	79%	0.785	31%	0.308	S	S	*	.	S	Bend	trans	-73.4	-27.2	172.1	27.4	0	0	0	0	112.8
582	R	88.8	Confident	92.4	Very high	114 Å²	114	56.6 Å²	56.6	43%	0.43	31%	0.308	S	S	.	.	S	Bend	trans	-97.2	148.1	173.4	71.1	-176.1	-174.5	84.6	4.1	110.4	L580 P584 E588	L580-R582 VanDerWaalsContact C-N 3.34Å; L580-R582 WeakPolarHBondContact CB-O 3.26Å; R582-P584 VanDerWaalsContact O-CD 3.3Å; R582-P584 WeakPolarHBondContact O-CD 3.42Å; R582-E588 IonicContact CZ-OE1 3.74Å; R582-E588 IonicContact CZ-OE2 3.22Å; R582-E588 VanDerWaalsContact CZ-OE2 3.22Å; R582-E588 IonicContact NH1-OE1 3.28Å; R582-E588 PolarHBondContact NH1-OE1 3.31Å; R582-E588 IonicContact NH1-OE2 2.69Å; R582-E588 PolarHBondContact NH1-OE2 3.08Å; R582-E588 IonicContact NH2-OE1 3.39Å; R582-E588 PolarHBondContact NH2-OE1 3.39Å; R582-E588 IonicContact NH2-OE2 2.82Å; R582-E588 PolarHBondContact NH2-OE2 3.28Å
583	T	89.8	Confident	92.3	Very high	134 Å²	134	56.5 Å²	56.5	82%	0.822	31%	0.307	S	S	*	.			trans	-77.4	114.5	167.8	49.2	0	0	0	0	109.4
584	P	92	Very high	92.1	Very high	21 Å²	21	56.7 Å²	56.7	14%	0.136	31%	0.313	C	S	.	.			trans	-70.1	150.6	177.6	28.8	-33.2	0	0	0	111.2	A577 L580 R582 E588 I589 I635	A577-P584 HydrophobicContact CB-CG 3.57Å; L580-P584 HydrophobicContact CD1-CB 4.28Å; L580-P584 HydrophobicContact CD1-CG 3.89Å; R582-P584 VanDerWaalsContact O-CD 3.3Å; R582-P584 WeakPolarHBondContact O-CD 3.42Å; P584-E588 HydrophobicContact CB-CB 4.45Å; P584-E588 WeakPolarHBondContact CB-OE2 3.45Å; P584-I589 HydrophobicContact CB-CG1 4.19Å; P584-I589 HydrophobicContact CG-CD1 4.01Å; P584-I589 HydrophobicContact CG-CG1 3.98Å; P584-I635 HydrophobicContact CB-CD1 3.81Å; P584-I635 HydrophobicContact CG-CD1 3.9Å
585	T	94.9	Very high	91.8	Very high	68 Å²	68	55.3 Å²	55.3	42%	0.417	31%	0.306	S	S	.	.			trans	-74.9	160.4	175	76.5	0	0	0	0	110.3	E587 E588 I589	T585-E587 WeakPolarHBondContact CB-OE2 3.26Å; T585-E587 PolarHBondContact O-N 3.28Å; T585-E587 PolarHBondContact OG1-OE2 3.04Å; T585-E588 PolarHBondContact O-N 3.28Å; T585-E588 PolarHBondContact OG1-N 2.86Å; T585-I589 WeakPolarHBondContact O-CG1 3.16Å; T585-I589 PolarHBondContact O-N 2.85Å
586	M	93.3	Very high	91.6	Very high	49 Å²	49	55.3 Å²	55.3	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-32.4	-178.9	-167.7	61.4	-129.9	0	0	111.4	R573 E588 I589 T590 Y609	R573-M586 VanDerWaalsContact CZ-SD 3.52Å; R573-M586 PolarHBondContact NH1-SD 2.87Å; M586-E588 VanDerWaalsContact C-N 3.33Å; M586-E588 PolarHBondContact O-N 2.92Å; M586-I589 HydrophobicContact CE-CB 3.85Å; M586-I589 HydrophobicContact CE-CG2 3.67Å; M586-I589 PolarHBondContact O-N 3.09Å; M586-I589 HydrophobicContact SD-CB 4.42Å; M586-I589 HydrophobicContact SD-CD1 4.42Å; M586-T590 HydrophobicContact CE-CG2 3.47Å; M586-T590 VanDerWaalsContact CE-CG2 3.47Å; M586-T590 HydrophobicContact CG-CG2 4.37Å; M586-T590 WeakPolarHBondContact O-CG2 3.45Å; M586-T590 PolarHBondContact O-N 3.19Å; M586-T590 PolarHBondContact O-OG1 3.35Å; M586-Y609 HydrophobicContact CE-CD1 3.64Å; M586-Y609 HydrophobicContact CE-CD2 3.47Å; M586-Y609 VanDerWaalsContact CE-CD2 3.47Å; M586-Y609 HydrophobicContact CE-CE1 3.87Å; M586-Y609 HydrophobicContact CE-CE2 3.73Å; M586-Y609 HydrophobicContact CE-CG 3.42Å; M586-Y609 VanDerWaalsContact CE-CG 3.42Å
587	E	94.4	Very high	91.2	Very high	133 Å²	133	55.3 Å²	55.3	62%	0.621	31%	0.306	S	S	*	.	H	α-helix	trans	-63.5	-38.7	176.3	-57	74.6	-158.6	0	0	111.7	T585 T590 A591	T585-E587 WeakPolarHBondContact CB-OE2 3.26Å; T585-E587 PolarHBondContact O-N 3.28Å; T585-E587 PolarHBondContact OG1-OE2 3.04Å; E587-T590 WeakPolarHBondContact CA-OG1 3.21Å; E587-T590 PolarHBondContact O-OG1 2.82Å; E587-T590 VanDerWaalsContact O-OG1 3.04Å; E587-A591 VanDerWaalsContact O-CB 3.24Å; E587-A591 WeakPolarHBondContact O-CB 3.5Å; E587-A591 PolarHBondContact O-N 2.8Å
588	E	93.5	Very high	91.1	Very high	63 Å²	63	54.2 Å²	54.2	29%	0.294	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-42.1	174.6	-69.1	-178	163.4	0	0	111.3	R582 P584 T585 M586 A591 V592	R582-E588 IonicContact CZ-OE1 3.74Å; R582-E588 IonicContact CZ-OE2 3.22Å; R582-E588 VanDerWaalsContact CZ-OE2 3.22Å; R582-E588 IonicContact NH1-OE1 3.28Å; R582-E588 PolarHBondContact NH1-OE1 3.31Å; R582-E588 IonicContact NH1-OE2 2.69Å; R582-E588 PolarHBondContact NH1-OE2 3.08Å; R582-E588 IonicContact NH2-OE1 3.39Å; R582-E588 PolarHBondContact NH2-OE1 3.39Å; R582-E588 IonicContact NH2-OE2 2.82Å; R582-E588 PolarHBondContact NH2-OE2 3.28Å; P584-E588 HydrophobicContact CB-CB 4.45Å; P584-E588 WeakPolarHBondContact CB-OE2 3.45Å; T585-E588 PolarHBondContact O-N 3.28Å; T585-E588 PolarHBondContact OG1-N 2.86Å; M586-E588 VanDerWaalsContact C-N 3.33Å; M586-E588 PolarHBondContact O-N 2.92Å; E588-A591 PolarHBondContact O-N 2.94Å; E588-V592 WeakPolarHBondContact O-CG2 3.29Å; E588-V592 PolarHBondContact O-N 3.37Å; E588-V592 VanDerWaalsContact O-N 3.15Å
589	I	95	Very high	91.1	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-66.1	-42.6	178.9	-62.9	174.8	0	0	0	110.9	R573 I576 P584 T585 M586 V592 A593 Y609 I635	R573-I589 HydrophobicContact CG-CD1 3.56Å; I576-I589 HydrophobicContact CB-CG2 4.38Å; I576-I589 HydrophobicContact CD1-CG2 3.9Å; I576-I589 HydrophobicContact CG2-CG2 4.21Å; P584-I589 HydrophobicContact CB-CG1 4.19Å; P584-I589 HydrophobicContact CG-CD1 4.01Å; P584-I589 HydrophobicContact CG-CG1 3.98Å; T585-I589 WeakPolarHBondContact O-CG1 3.16Å; T585-I589 PolarHBondContact O-N 2.85Å; M586-I589 HydrophobicContact CE-CB 3.85Å; M586-I589 HydrophobicContact CE-CG2 3.67Å; M586-I589 PolarHBondContact O-N 3.09Å; M586-I589 HydrophobicContact SD-CB 4.42Å; M586-I589 HydrophobicContact SD-CD1 4.42Å; I589-V592 VanDerWaalsContact O-CG2 3.31Å; I589-V592 WeakPolarHBondContact O-CG2 3.46Å; I589-A593 WeakPolarHBondContact O-CB 3.48Å; I589-A593 PolarHBondContact O-N 3.48Å; I589-A593 VanDerWaalsContact O-N 3.08Å; I589-Y609 HydrophobicContact CG2-CD1 3.87Å; I589-Y609 HydrophobicContact CG2-CE1 3.78Å; I589-I635 HydrophobicContact CG1-CD1 4.08Å
590	T	94.7	Very high	91.3	Very high	36 Å²	36	54.2 Å²	54.2	22%	0.221	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-41.7	177.5	53	0	0	0	0	111.4	M586 E587 A593 M594 Y609	M586-T590 HydrophobicContact CE-CG2 3.47Å; M586-T590 VanDerWaalsContact CE-CG2 3.47Å; M586-T590 HydrophobicContact CG-CG2 4.37Å; M586-T590 WeakPolarHBondContact O-CG2 3.45Å; M586-T590 PolarHBondContact O-N 3.19Å; M586-T590 PolarHBondContact O-OG1 3.35Å; E587-T590 WeakPolarHBondContact CA-OG1 3.21Å; E587-T590 PolarHBondContact O-OG1 2.82Å; E587-T590 VanDerWaalsContact O-OG1 3.04Å; T590-A593 PolarHBondContact O-N 2.96Å; T590-M594 WeakPolarHBondContact O-CG 3.47Å; T590-M594 PolarHBondContact O-N 2.76Å; T590-Y609 HydrophobicContact CG2-CE2 3.93Å
591	A	92.3	Very high	91.4	Very high	43 Å²	43	53.9 Å²	53.9	36%	0.355	29%	0.286	S	S	.	.	H	α-helix	trans	-57.8	-51.9	177.9	0	0	0	0	0	111.8	E587 E588 A593 M594 E595	E587-A591 VanDerWaalsContact O-CB 3.24Å; E587-A591 WeakPolarHBondContact O-CB 3.5Å; E587-A591 PolarHBondContact O-N 2.8Å; E588-A591 PolarHBondContact O-N 2.94Å; A591-A593 VanDerWaalsContact C-N 3.3Å; A591-A593 PolarHBondContact O-N 3.02Å; A591-M594 PolarHBondContact O-N 3.39Å; A591-M594 VanDerWaalsContact O-N 3.16Å; A591-E595 WeakPolarHBondContact O-CG 3.12Å; A591-E595 PolarHBondContact O-N 3.41Å
592	V	92.6	Very high	91.9	Very high	12 Å²	12	47.8 Å²	47.8	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-29.6	179.9	-60.7	0	0	0	0	112.9	I576 E588 I589 E595 S596 A631 L634 I635	I576-V592 HydrophobicContact CG2-CG2 3.91Å; E588-V592 WeakPolarHBondContact O-CG2 3.29Å; E588-V592 PolarHBondContact O-N 3.37Å; E588-V592 VanDerWaalsContact O-N 3.15Å; I589-V592 VanDerWaalsContact O-CG2 3.31Å; I589-V592 WeakPolarHBondContact O-CG2 3.46Å; V592-E595 PolarHBondContact O-N 2.9Å; V592-S596 WeakPolarHBondContact O-CB 3.45Å; V592-S596 PolarHBondContact O-N 3.13Å; V592-S596 PolarHBondContact O-OG 2.95Å; V592-A631 HydrophobicContact CG2-CB 4.27Å; V592-L634 HydrophobicContact CB-CB 4.33Å; V592-L634 HydrophobicContact CG1-CB 4.34Å; V592-I635 HydrophobicContact CG1-CB 4.15Å; V592-I635 HydrophobicContact CG1-CG1 4.41Å; V592-I635 HydrophobicContact CG2-CB 4.14Å; V592-I635 HydrophobicContact CG2-CD1 4.3Å; V592-I635 HydrophobicContact CG2-CG1 4.39Å
593	A	93.6	Very high	92	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-71.2	-33.1	174.3	0	0	0	0	0	111.9	I576 I589 T590 A591 S596 G597 A598 H599 Y609	I576-A593 HydrophobicContact CD1-CB 4.38Å; I589-A593 WeakPolarHBondContact O-CB 3.48Å; I589-A593 PolarHBondContact O-N 3.48Å; I589-A593 VanDerWaalsContact O-N 3.08Å; T590-A593 PolarHBondContact O-N 2.96Å; A591-A593 VanDerWaalsContact C-N 3.3Å; A591-A593 PolarHBondContact O-N 3.02Å; A593-S596 PolarHBondContact O-OG 3.37Å; A593-G597 CarbonylContact O-C 3.52Å; A593-G597 PolarHBondContact O-N 3.44Å; A593-A598 HydrophobicContact CB-CB 4.32Å; A593-A598 PolarHBondContact O-N 3.31Å; A593-H599 HydrophobicContact CB-CB 4.16Å; A593-H599 PolarHBondContact O-N 2.85Å; A593-Y609 HydrophobicContact CB-CE1 4Å; A593-Y609 WeakPolarHBondContact CB-OH 3.35Å
594	M	90.9	Very high	92.1	Very high	87 Å²	87	42 Å²	42	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-69.7	-40.8	172.5	-71.2	179.5	-168.1	0	0	111.3	T590 A591 G597 H599 R657	T590-M594 WeakPolarHBondContact O-CG 3.47Å; T590-M594 PolarHBondContact O-N 2.76Å; A591-M594 PolarHBondContact O-N 3.39Å; A591-M594 VanDerWaalsContact O-N 3.16Å; M594-G597 PolarHBondContact O-N 3.16Å; M594-H599 HydrophobicContact CB-CB 4.39Å; M594-H599 HydrophobicContact CG-CB 3.68Å; M594-R657 PolarHBondContact O-NH1 3Å
595	E	87.4	Confident	92	Very high	68 Å²	68	43.9 Å²	43.9	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-62.2	-40.3	175.8	-76	178.3	-164.4	0	0	112.6	A591 V592 G597 L634 L661	A591-E595 WeakPolarHBondContact O-CG 3.12Å; A591-E595 PolarHBondContact O-N 3.41Å; V592-E595 PolarHBondContact O-N 2.9Å; E595-G597 VanDerWaalsContact C-N 3.34Å; E595-L634 HydrophobicContact CB-CD1 4.02Å; E595-L661 HydrophobicContact CB-CD1 3.96Å; E595-L661 HydrophobicContact CG-CD1 4.01Å
596	S	88.4	Confident	91.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7	179.5	79.2	0	0	0	0	114.6	V592 A593 A598 A627 A631	V592-S596 WeakPolarHBondContact O-CB 3.45Å; V592-S596 PolarHBondContact O-N 3.13Å; V592-S596 PolarHBondContact O-OG 2.95Å; A593-S596 PolarHBondContact O-OG 3.37Å; S596-A598 VanDerWaalsContact C-N 3.29Å; S596-A598 WeakPolarHBondContact OG-CB 3.38Å; S596-A598 PolarHBondContact OG-N 3.37Å; S596-A627 VanDerWaalsContact CB-O 3.26Å; S596-A627 WeakPolarHBondContact CB-O 3.4Å; S596-A627 PolarHBondContact OG-O 2.85Å; S596-A631 WeakPolarHBondContact OG-CB 3.47Å
597	G	87.6	Confident	91.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	9.4	-173.3	0	0	0	0	0	114.7	A593 M594 E595 N654	A593-G597 CarbonylContact O-C 3.52Å; A593-G597 PolarHBondContact O-N 3.44Å; M594-G597 PolarHBondContact O-N 3.16Å; E595-G597 VanDerWaalsContact C-N 3.34Å; G597-N654 VanDerWaalsContact CA-OD1 3.27Å; G597-N654 WeakPolarHBondContact CA-OD1 3.22Å
598	A	91.5	Very high	91.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.267	C	S	.	.			trans	-80.1	-26.5	179.3	0	0	0	0	0	114.2	A593 S596 D600 F601 I602 A627	A593-A598 HydrophobicContact CB-CB 4.32Å; A593-A598 PolarHBondContact O-N 3.31Å; S596-A598 VanDerWaalsContact C-N 3.29Å; S596-A598 WeakPolarHBondContact OG-CB 3.38Å; S596-A598 PolarHBondContact OG-N 3.37Å; A598-D600 VanDerWaalsContact C-N 3.32Å; A598-D600 PolarHBondContact O-N 3.48Å; A598-F601 VanDerWaalsContact CA-CE1 3.43Å; A598-F601 HydrophobicContact CB-CE1 3.82Å; A598-F601 HydrophobicContact CB-CZ 4.19Å; A598-F601 WeakPolarHBondContact O-CD1 3.36Å; A598-I602 HydrophobicContact CB-CD1 3.77Å; A598-I602 WeakPolarHBondContact O-CB 3.42Å; A598-I602 WeakPolarHBondContact O-CD1 3.48Å; A598-I602 WeakPolarHBondContact O-CG1 3.42Å; A598-I602 PolarHBondContact O-N 2.97Å; A598-I602 VanDerWaalsContact O-N 3.08Å; A598-A627 HydrophobicContact CB-CB 4.02Å
599	H	93.9	Very high	91.6	Very high	44 Å²	44	43.5 Å²	43.5	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-43.1	-175.2	179.9	71.9	0	0	0	113	A593 M594 F601 I602 S603 Y609	A593-H599 HydrophobicContact CB-CB 4.16Å; A593-H599 PolarHBondContact O-N 2.85Å; M594-H599 HydrophobicContact CB-CB 4.39Å; M594-H599 HydrophobicContact CG-CB 3.68Å; H599-F601 VanDerWaalsContact C-N 3.32Å; H599-F601 PolarHBondContact O-N 2.87Å; H599-I602 PolarHBondContact O-N 3.22Å; H599-S603 PolarHBondContact CE1-OG 3.39Å; H599-S603 PolarHBondContact ND1-OG 2.98Å; H599-S603 PolarHBondContact NE2-OG 3.08Å; H599-S603 WeakPolarHBondContact O-CB 3.39Å; H599-S603 PolarHBondContact O-N 3.11Å; H599-S603 PolarHBondContact O-OG 3.34Å; H599-Y609 AromaticContact ND1-CE2 3.96Å; H599-Y609 AromaticContact ND1-CZ 3.87Å; H599-Y609 PolarHBondContact ND1-OH 3.41Å
600	D	90	Very high	91.5	Very high	91 Å²	91	47.3 Å²	47.3	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-40	-170.9	-63.6	-16.4	0	0	0	111.7	A598 R657	A598-D600 VanDerWaalsContact C-N 3.32Å; A598-D600 PolarHBondContact O-N 3.48Å; D600-R657 IonicContact OD2-CZ 3.74Å; D600-R657 IonicContact OD2-NH2 3.78Å; D600-R657 PolarHBondContact OD2-NH2 3.03Å; D600-R657 VanDerWaalsContact OD2-NH2 3.08Å
601	F	90.5	Very high	91.4	Very high	37 Å²	37	46.4 Å²	46.4	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-85.8	-34.3	177.3	79.1	-101.9	0	0	0	112.9	F572 A598 H599 S603 G604 F605 L620 Q624 A627 V628	F572-F601 AromaticContact CE1-CE2 3.87Å; F572-F601 HydrophobicContact CE1-CE2 3.87Å; F572-F601 HydrophobicContact CE1-CZ 4.48Å; F572-F601 HydrophobicContact CZ-CE2 4.01Å; A598-F601 VanDerWaalsContact CA-CE1 3.43Å; A598-F601 HydrophobicContact CB-CE1 3.82Å; A598-F601 HydrophobicContact CB-CZ 4.19Å; A598-F601 WeakPolarHBondContact O-CD1 3.36Å; H599-F601 VanDerWaalsContact C-N 3.32Å; H599-F601 PolarHBondContact O-N 2.87Å; F601-S603 VanDerWaalsContact C-N 3.31Å; F601-S603 PolarHBondContact O-N 3.32Å; F601-G604 PolarHBondContact O-N 3.08Å; F601-G604 VanDerWaalsContact O-N 3.09Å; F601-F605 AromaticContact CD2-CE2 4Å; F601-F605 HydrophobicContact CD2-CE2 4Å; F601-F605 HydrophobicContact CE2-CE2 4.48Å; F601-F605 VanDerWaalsContact O-CD2 3.31Å; F601-F605 WeakPolarHBondContact O-CD2 3.16Å; F601-L620 HydrophobicContact CE2-CD2 4.5Å; F601-Q624 HydrophobicContact CD1-CG 3.96Å; F601-Q624 HydrophobicContact CD2-CG 4.05Å; F601-Q624 HydrophobicContact CE1-CB 4.05Å; F601-Q624 HydrophobicContact CE1-CG 3.89Å; F601-Q624 HydrophobicContact CE2-CB 4.09Å; F601-Q624 HydrophobicContact CE2-CG 4.03Å; F601-Q624 HydrophobicContact CG-CG 4.02Å; F601-Q624 HydrophobicContact CZ-CB 3.78Å; F601-Q624 HydrophobicContact CZ-CG 3.95Å; F601-A627 HydrophobicContact CE1-CB 4.08Å; F601-V628 HydrophobicContact CZ-CG2 3.77Å
602	I	93.9	Very high	91.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-43.6	178.2	-69.4	169.1	0	0	0	109.9	F572 I576 A598 H599 G604 F605 G608 Y609	F572-I602 HydrophobicContact CB-CD1 4.24Å; F572-I602 HydrophobicContact CB-CG2 4.34Å; F572-I602 HydrophobicContact CD1-CD1 4.02Å; F572-I602 HydrophobicContact CD1-CG1 3.94Å; F572-I602 HydrophobicContact CD2-CG1 4.24Å; F572-I602 HydrophobicContact CD2-CG2 4.03Å; F572-I602 HydrophobicContact CE1-CG1 4.1Å; F572-I602 HydrophobicContact CE2-CG1 4.4Å; F572-I602 HydrophobicContact CG-CD1 4.14Å; F572-I602 HydrophobicContact CG-CG1 4Å; F572-I602 HydrophobicContact CG-CG2 4.24Å; F572-I602 HydrophobicContact CZ-CG1 4.33Å; I576-I602 HydrophobicContact CD1-CD1 4.29Å; A598-I602 HydrophobicContact CB-CD1 3.77Å; A598-I602 WeakPolarHBondContact O-CB 3.42Å; A598-I602 WeakPolarHBondContact O-CD1 3.48Å; A598-I602 WeakPolarHBondContact O-CG1 3.42Å; A598-I602 PolarHBondContact O-N 2.97Å; A598-I602 VanDerWaalsContact O-N 3.08Å; H599-I602 PolarHBondContact O-N 3.22Å; I602-G604 PolarHBondContact O-N 3.47Å; I602-F605 PolarHBondContact O-N 3.47Å; I602-F605 VanDerWaalsContact O-N 3.12Å; I602-G608 WeakPolarHBondContact O-CA 3.49Å; I602-Y609 HydrophobicContact CD1-CD1 4.46Å; I602-Y609 HydrophobicContact CD1-CE1 4.04Å; I602-Y609 HydrophobicContact CG2-CD1 3.78Å; I602-Y609 HydrophobicContact CG2-CD2 3.91Å; I602-Y609 HydrophobicContact CG2-CE1 3.93Å; I602-Y609 HydrophobicContact CG2-CE2 4.04Å; I602-Y609 HydrophobicContact CG2-CG 3.77Å
603	S	92.3	Very high	91	Very high	60 Å²	60	50.6 Å²	50.6	42%	0.42	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.9	177.3	-62	0	0	0	0	113.4	H599 F601 F605	H599-S603 PolarHBondContact CE1-OG 3.39Å; H599-S603 PolarHBondContact ND1-OG 2.98Å; H599-S603 PolarHBondContact NE2-OG 3.08Å; H599-S603 WeakPolarHBondContact O-CB 3.39Å; H599-S603 PolarHBondContact O-N 3.11Å; H599-S603 PolarHBondContact O-OG 3.34Å; F601-S603 VanDerWaalsContact C-N 3.31Å; F601-S603 PolarHBondContact O-N 3.32Å; S603-F605 VanDerWaalsContact C-N 3.33Å
604	G	90.4	Very high	90.4	Very high	67 Å²	67	51.6 Å²	51.6	69%	0.691	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-14.5	174.6	0	0	0	0	0	114.3	F601 I602	F601-G604 PolarHBondContact O-N 3.08Å; F601-G604 VanDerWaalsContact O-N 3.09Å; I602-G604 PolarHBondContact O-N 3.47Å
605	F	91.6	Very high	89.6	Confident	61 Å²	61	55.4 Å²	55.4	27%	0.268	31%	0.31	S	S	.	.	S	Bend	trans	-79.5	148.4	176.7	-77.9	-89.5	0	0	0	112.1	F572 F601 I602 S603 Q607 G608 T611 L620	F572-F605 AromaticContact CE2-CD2 3.91Å; F572-F605 HydrophobicContact CE2-CD2 3.91Å; F572-F605 HydrophobicContact CE2-CE2 4.05Å; F572-F605 HydrophobicContact CE2-CG 4.33Å; F572-F605 HydrophobicContact CZ-CD2 4.19Å; F572-F605 AromaticContact CZ-CE2 3.88Å; F572-F605 HydrophobicContact CZ-CE2 3.88Å; F572-F605 HydrophobicContact CZ-CZ 4.35Å; F601-F605 AromaticContact CD2-CE2 4Å; F601-F605 HydrophobicContact CD2-CE2 4Å; F601-F605 HydrophobicContact CE2-CE2 4.48Å; F601-F605 VanDerWaalsContact O-CD2 3.31Å; F601-F605 WeakPolarHBondContact O-CD2 3.16Å; I602-F605 PolarHBondContact O-N 3.47Å; I602-F605 VanDerWaalsContact O-N 3.12Å; S603-F605 VanDerWaalsContact C-N 3.33Å; F605-Q607 PolarHBondContact O-N 3.06Å; F605-Q607 VanDerWaalsContact O-N 3.12Å; F605-G608 PolarHBondContact O-N 3.2Å; F605-T611 HydrophobicContact CB-CG2 4.13Å; F605-T611 VanDerWaalsContact CB-OG1 3.29Å; F605-T611 WeakPolarHBondContact CB-OG1 3.44Å; F605-T611 HydrophobicContact CD1-CG2 3.75Å; F605-T611 HydrophobicContact CE1-CG2 4.41Å; F605-T611 HydrophobicContact CG-CG2 4.07Å; F605-L620 HydrophobicContact CE2-CD2 4.39Å; F605-L620 HydrophobicContact CZ-CD2 4.02Å
606	P	86.9	Confident	88.7	Confident	135 Å²	135	55.4 Å²	55.4	88%	0.877	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.5	-177	-26.5	34.3	0	0	0	115.4
607	Q	91.6	Very high	87.8	Confident	133 Å²	133	55.4 Å²	55.4	62%	0.621	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	10.2	178.4	-63.1	-179.6	-17	0	0	112.3	F605 Y609 D610	F605-Q607 PolarHBondContact O-N 3.06Å; F605-Q607 VanDerWaalsContact O-N 3.12Å; Q607-Y609 PolarHBondContact O-N 3.03Å; Q607-D610 PolarHBondContact O-N 2.89Å
608	G	93.4	Very high	87.1	Confident	16 Å²	16	61.3 Å²	61.3	17%	0.165	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	51.9	-122.6	-179.2	0	0	0	0	0	112.7	I602 F605 D610 T611	I602-G608 WeakPolarHBondContact O-CA 3.49Å; F605-G608 PolarHBondContact O-N 3.2Å; G608-D610 VanDerWaalsContact C-N 3.28Å; G608-D610 PolarHBondContact O-N 3.23Å; G608-T611 PolarHBondContact N-OG1 3.44Å; G608-T611 VanDerWaalsContact O-CB 3.29Å; G608-T611 WeakPolarHBondContact O-CB 3.48Å; G608-T611 PolarHBondContact O-N 2.92Å; G608-T611 PolarHBondContact O-OG1 3.18Å
609	Y	94.1	Very high	86.3	Confident	21 Å²	21	67.9 Å²	67.9	8%	0.082	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-68.8	-19.6	179.1	-74.8	-89.5	0	0	0	115.4	F572 R573 I576 M586 I589 T590 A593 H599 I602 Q607 T611	F572-Y609 HydrophobicContact CB-CD1 4.48Å; F572-Y609 PolarHBondContact N-O 3.44Å; R573-Y609 PolarHBondContact N-O 2.9Å; I576-Y609 HydrophobicContact CD1-CD1 4.4Å; I576-Y609 HydrophobicContact CD1-CE1 4.1Å; M586-Y609 HydrophobicContact CE-CD1 3.64Å; M586-Y609 HydrophobicContact CE-CD2 3.47Å; M586-Y609 VanDerWaalsContact CE-CD2 3.47Å; M586-Y609 HydrophobicContact CE-CE1 3.87Å; M586-Y609 HydrophobicContact CE-CE2 3.73Å; M586-Y609 HydrophobicContact CE-CG 3.42Å; M586-Y609 VanDerWaalsContact CE-CG 3.42Å; I589-Y609 HydrophobicContact CG2-CD1 3.87Å; I589-Y609 HydrophobicContact CG2-CE1 3.78Å; T590-Y609 HydrophobicContact CG2-CE2 3.93Å; A593-Y609 HydrophobicContact CB-CE1 4Å; A593-Y609 WeakPolarHBondContact CB-OH 3.35Å; H599-Y609 AromaticContact ND1-CE2 3.96Å; H599-Y609 AromaticContact ND1-CZ 3.87Å; H599-Y609 PolarHBondContact ND1-OH 3.41Å; I602-Y609 HydrophobicContact CD1-CD1 4.46Å; I602-Y609 HydrophobicContact CD1-CE1 4.04Å; I602-Y609 HydrophobicContact CG2-CD1 3.78Å; I602-Y609 HydrophobicContact CG2-CD2 3.91Å; I602-Y609 HydrophobicContact CG2-CE1 3.93Å; I602-Y609 HydrophobicContact CG2-CE2 4.04Å; I602-Y609 HydrophobicContact CG2-CG 3.77Å; Q607-Y609 PolarHBondContact O-N 3.03Å; Y609-T611 VanDerWaalsContact C-N 3.29Å
610	D	94.3	Very high	85.9	Confident	83 Å²	83	66.4 Å²	66.4	44%	0.444	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-88.3	-3.4	179.7	-59.1	-39.6	0	0	0	111.7	R573 Q607 G608 E612	R573-D610 IonicContact CZ-OD1 3.41Å; R573-D610 IonicContact NE-OD1 2.78Å; R573-D610 PolarHBondContact NE-OD1 3.26Å; R573-D610 IonicContact NH2-OD1 3.44Å; R573-D610 PolarHBondContact NH2-OD1 2.9Å; R573-D610 IonicContact NH2-OD2 2.92Å; R573-D610 PolarHBondContact NH2-OD2 2.94Å; Q607-D610 PolarHBondContact O-N 2.89Å; G608-D610 VanDerWaalsContact C-N 3.28Å; G608-D610 PolarHBondContact O-N 3.23Å; D610-E612 PolarHBondContact O-N 2.94Å
611	T	92.6	Very high	85.8	Confident	16 Å²	16	65.1 Å²	65.1	10%	0.098	37%	0.368	C	S	.	.			trans	-60.3	128.2	173.2	-49.4	0	0	0	0	111.6	S571 F572 F605 G608 Y609	S571-T611 VanDerWaalsContact CA-O 3.26Å; S571-T611 WeakPolarHBondContact CA-O 3.44Å; F572-T611 HydrophobicContact CE2-CG2 4.15Å; F572-T611 PolarHBondContact N-O 2.88Å; F572-T611 VanDerWaalsContact N-O 3.17Å; F605-T611 HydrophobicContact CB-CG2 4.13Å; F605-T611 VanDerWaalsContact CB-OG1 3.29Å; F605-T611 WeakPolarHBondContact CB-OG1 3.44Å; F605-T611 HydrophobicContact CD1-CG2 3.75Å; F605-T611 HydrophobicContact CE1-CG2 4.41Å; F605-T611 HydrophobicContact CG-CG2 4.07Å; G608-T611 PolarHBondContact N-OG1 3.44Å; G608-T611 VanDerWaalsContact O-CB 3.29Å; G608-T611 WeakPolarHBondContact O-CB 3.48Å; G608-T611 PolarHBondContact O-N 2.92Å; G608-T611 PolarHBondContact O-OG1 3.18Å; Y609-T611 VanDerWaalsContact C-N 3.29Å
612	E	90.5	Very high	85.6	Confident	142 Å²	142	64.8 Å²	64.8	66%	0.664	38%	0.375	S	S	*	.	B	Isolated β-bridge	trans	-74.4	131.7	174.2	-65.6	-173.4	173	0	0	112.1	D610 G614	D610-E612 PolarHBondContact O-N 2.94Å; E612-G614 VanDerWaalsContact C-N 3.33Å; E612-G614 PolarHBondContact O-N 3.47Å
613	V	85.8	Confident	85.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.012	38%	0.38	C	S	.	.			trans	-82.7	-11.5	-173.5	177.9	0	0	0	0	113.1	L567 R570 F572 L620	L567-V613 HydrophobicContact CB-CG1 4.06Å; L567-V613 HydrophobicContact CD1-CG1 3.69Å; R570-V613 WeakPolarHBondContact O-CG2 3.47Å; R570-V613 PolarHBondContact O-N 3.19Å; F572-V613 HydrophobicContact CD1-CG2 3.59Å; F572-V613 HydrophobicContact CD2-CG2 4.27Å; F572-V613 HydrophobicContact CE1-CG2 3.62Å; F572-V613 HydrophobicContact CE2-CG2 4.29Å; F572-V613 HydrophobicContact CG-CG2 3.94Å; F572-V613 HydrophobicContact CZ-CG2 3.98Å; V613-L620 HydrophobicContact CG1-CD1 3.57Å; V613-L620 HydrophobicContact CG1-CG 4.12Å
614	G	80.1	Confident	85.1	Confident	20 Å²	20	64.9 Å²	64.9	21%	0.206	37%	0.372	C	S	.	.			trans	74.1	172.3	-175.6	0	0	0	0	0	114	G569 E612 T616 G617	G569-G614 WeakPolarHBondContact CA-O 3.38Å; E612-G614 VanDerWaalsContact C-N 3.33Å; E612-G614 PolarHBondContact O-N 3.47Å; G614-T616 PolarHBondContact O-N 3.17Å; G614-G617 PolarHBondContact O-N 3.41Å
615	E	75.3	Confident	85.2	Confident	168 Å²	168	64.8 Å²	64.8	79%	0.785	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-59.1	126.5	-178.9	-66.5	-175	169.9	0	0	111.4	G617 N618	E615-G617 PolarHBondContact O-N 3.37Å; E615-N618 PolarHBondContact O-N 2.88Å
616	T	68.9	Low	85.1	Confident	67 Å²	67	62.1 Å²	62.1	41%	0.411	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	57.1	7.8	-178.8	58.8	0	0	0	0	116.1	L567 G614 N618	L567-T616 WeakPolarHBondContact O-CA 2.99Å; G614-T616 PolarHBondContact O-N 3.17Å; T616-N618 PolarHBondContact OG1-ND2 3.34Å; T616-N618 PolarHBondContact OG1-OD1 2.83Å
617	G	67.8	Low	85.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	68.3	29.4	-176.5	0	0	0	0	0	114.7	G614 E615 Q619 L620	G614-G617 PolarHBondContact O-N 3.41Å; E615-G617 PolarHBondContact O-N 3.37Å; G617-Q619 PolarHBondContact O-N 3Å; G617-Q619 VanDerWaalsContact O-N 3.07Å; G617-L620 PolarHBondContact O-N 2.83Å
618	N	72.9	Confident	85.5	Confident	124 Å²	124	49.4 Å²	49.4	66%	0.663	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.4	179.2	-75.1	-19.7	0	0	0	114.3	E615 T616 L620	E615-N618 PolarHBondContact O-N 2.88Å; T616-N618 PolarHBondContact OG1-ND2 3.34Å; T616-N618 PolarHBondContact OG1-OD1 2.83Å; N618-L620 VanDerWaalsContact C-N 3.28Å
619	Q	76.1	Confident	85.4	Confident	138 Å²	138	49 Å²	49	65%	0.645	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-9.4	175.3	-60.9	-176.8	5.9	0	0	113.2	G617	G617-Q619 PolarHBondContact O-N 3Å; G617-Q619 VanDerWaalsContact O-N 3.07Å
620	L	85.1	Confident	85.4	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.073	26%	0.261	C	S	.	.	S	Bend	trans	-107.6	147.4	-175.9	-60.5	-178.1	0	0	0	112.2	L567 F572 F601 F605 V613 G617 N618 Q624 R625	L567-L620 HydrophobicContact CD1-CD1 3.56Å; F572-L620 HydrophobicContact CE1-CD1 3.72Å; F572-L620 HydrophobicContact CE1-CD2 4.26Å; F572-L620 HydrophobicContact CZ-CD1 4.2Å; F572-L620 HydrophobicContact CZ-CD2 3.93Å; F601-L620 HydrophobicContact CE2-CD2 4.5Å; F605-L620 HydrophobicContact CE2-CD2 4.39Å; F605-L620 HydrophobicContact CZ-CD2 4.02Å; V613-L620 HydrophobicContact CG1-CD1 3.57Å; V613-L620 HydrophobicContact CG1-CG 4.12Å; G617-L620 PolarHBondContact O-N 2.83Å; N618-L620 VanDerWaalsContact C-N 3.28Å; L620-Q624 HydrophobicContact CB-CB 4.02Å; L620-Q624 HydrophobicContact CD2-CB 4.49Å; L620-R625 HydrophobicContact CB-CG 3.76Å; L620-R625 HydrophobicContact CD1-CG 4.33Å
621	S	87.8	Confident	85.3	Confident	63 Å²	63	44.3 Å²	44.3	44%	0.441	24%	0.239	S	C	.	.			trans	-65.6	161.4	170.5	77.2	0	0	0	0	111.4	G623 Q624 R625	S621-G623 VanDerWaalsContact C-N 3.32Å; S621-G623 PolarHBondContact O-N 3.42Å; S621-Q624 PolarHBondContact O-N 3.17Å; S621-Q624 VanDerWaalsContact OG-CG 3.3Å; S621-Q624 WeakPolarHBondContact OG-CG 3.43Å; S621-Q624 PolarHBondContact OG-N 3.47Å; S621-R625 WeakPolarHBondContact O-CG 3.02Å; S621-R625 PolarHBondContact O-N 3.16Å
622	G	86.1	Confident	85.4	Confident	31 Å²	31	45.2 Å²	45.2	32%	0.32	24%	0.241	S	C	.	.	H	α-helix	trans	-53.3	-47.2	175.5	0	0	0	0	0	112.8	R625 Q626	G622-R625 PolarHBondContact O-N 2.95Å; G622-Q626 WeakPolarHBondContact O-CG 3.47Å; G622-Q626 PolarHBondContact O-N 3.28Å
623	G	87.1	Confident	85.5	Confident	10 Å²	10	38.7 Å²	38.7	10%	0.103	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-40.5	177.1	0	0	0	0	0	113.7	S621 R625 Q626 A627 A649 L650	S621-G623 VanDerWaalsContact C-N 3.32Å; S621-G623 PolarHBondContact O-N 3.42Å; G623-R625 VanDerWaalsContact C-N 3.35Å; G623-R625 PolarHBondContact O-N 2.96Å; G623-Q626 PolarHBondContact O-N 3.28Å; G623-A627 PolarHBondContact O-N 3.49Å; G623-A649 WeakPolarHBondContact CA-O 3.45Å; G623-A649 PolarHBondContact N-O 3.24Å; G623-L650 VanDerWaalsContact O-CD2 3.23Å; G623-L650 WeakPolarHBondContact O-CD2 3.49Å
624	Q	89.6	Confident	85.8	Confident	52 Å²	52	38.8 Å²	38.8	24%	0.243	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-42.5	175.7	-74.5	170	-16.8	0	0	111.6	F601 L620 S621 Q626 A627 V628	F601-Q624 HydrophobicContact CD1-CG 3.96Å; F601-Q624 HydrophobicContact CD2-CG 4.05Å; F601-Q624 HydrophobicContact CE1-CB 4.05Å; F601-Q624 HydrophobicContact CE1-CG 3.89Å; F601-Q624 HydrophobicContact CE2-CB 4.09Å; F601-Q624 HydrophobicContact CE2-CG 4.03Å; F601-Q624 HydrophobicContact CG-CG 4.02Å; F601-Q624 HydrophobicContact CZ-CB 3.78Å; F601-Q624 HydrophobicContact CZ-CG 3.95Å; L620-Q624 HydrophobicContact CB-CB 4.02Å; L620-Q624 HydrophobicContact CD2-CB 4.49Å; S621-Q624 PolarHBondContact O-N 3.17Å; S621-Q624 VanDerWaalsContact OG-CG 3.3Å; S621-Q624 WeakPolarHBondContact OG-CG 3.43Å; S621-Q624 PolarHBondContact OG-N 3.47Å; Q624-Q626 VanDerWaalsContact C-N 3.34Å; Q624-Q626 PolarHBondContact O-N 3.02Å; Q624-A627 PolarHBondContact O-N 3.29Å; Q624-V628 WeakPolarHBondContact O-CG2 3.34Å; Q624-V628 PolarHBondContact O-N 3.49Å; Q624-V628 VanDerWaalsContact O-N 3.09Å
625	R	91.1	Very high	86.4	Confident	64 Å²	64	38.1 Å²	38.1	24%	0.242	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-42.3	175.4	-68.5	-174.2	-72.1	176.1	2.8	111.8	P565 L567 L620 S621 G622 G623 V628 A629	P565-R625 HydrophobicContact CG-CB 4.3Å; L567-R625 HydrophobicContact CD1-CB 4.39Å; L567-R625 HydrophobicContact CD1-CG 4Å; L567-R625 HydrophobicContact CG-CG 4.46Å; L620-R625 HydrophobicContact CB-CG 3.76Å; L620-R625 HydrophobicContact CD1-CG 4.33Å; S621-R625 WeakPolarHBondContact O-CG 3.02Å; S621-R625 PolarHBondContact O-N 3.16Å; G622-R625 PolarHBondContact O-N 2.95Å; G623-R625 VanDerWaalsContact C-N 3.35Å; G623-R625 PolarHBondContact O-N 2.96Å; R625-V628 PolarHBondContact O-N 2.93Å; R625-A629 WeakPolarHBondContact O-CB 3.5Å; R625-A629 PolarHBondContact O-N 3.33Å
626	Q	90.6	Very high	87.1	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.028	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-44.9	174.9	-74.4	-177.1	-16.8	0	0	112.3	Q563 P565 G622 G623 Q624 V628 A629 L630 D645 A646 A649 L650	Q563-Q626 PolarHBondContact O-NE2 3.33Å; Q563-Q626 VanDerWaalsContact O-NE2 3.13Å; P565-Q626 HydrophobicContact CG-CB 4.48Å; P565-Q626 HydrophobicContact CG-CG 3.93Å; G622-Q626 WeakPolarHBondContact O-CG 3.47Å; G622-Q626 PolarHBondContact O-N 3.28Å; G623-Q626 PolarHBondContact O-N 3.28Å; Q624-Q626 VanDerWaalsContact C-N 3.34Å; Q624-Q626 PolarHBondContact O-N 3.02Å; Q626-V628 PolarHBondContact O-N 2.79Å; Q626-A629 PolarHBondContact O-N 2.94Å; Q626-L630 WeakPolarHBondContact O-CB 3.21Å; Q626-L630 PolarHBondContact O-N 3.45Å; Q626-D645 PolarHBondContact NE2-O 3.46Å; Q626-A646 PolarHBondContact OE1-O 3.32Å; Q626-A649 VanDerWaalsContact OE1-N 3.11Å; Q626-L650 HydrophobicContact CB-CD2 4.2Å; Q626-L650 HydrophobicContact CB-CG 4.47Å
627	A	91.8	Very high	88.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-39.3	178.8	0	0	0	0	0	113	S596 A598 F601 G623 Q624 A631 L650	S596-A627 VanDerWaalsContact CB-O 3.26Å; S596-A627 WeakPolarHBondContact CB-O 3.4Å; S596-A627 PolarHBondContact OG-O 2.85Å; A598-A627 HydrophobicContact CB-CB 4.02Å; F601-A627 HydrophobicContact CE1-CB 4.08Å; G623-A627 PolarHBondContact O-N 3.49Å; Q624-A627 PolarHBondContact O-N 3.29Å; A627-A631 PolarHBondContact O-N 2.91Å; A627-L650 HydrophobicContact CB-CD2 4Å
628	V	93.6	Very high	89.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-42.3	174.7	178.3	0	0	0	0	111.2	L567 F572 N575 I576 F601 Q624 R625 Q626 L630 A631 R632	L567-V628 HydrophobicContact CD1-CB 4.25Å; L567-V628 HydrophobicContact CD1-CG1 4.26Å; L567-V628 HydrophobicContact CD2-CB 4.13Å; L567-V628 HydrophobicContact CD2-CG1 3.77Å; F572-V628 HydrophobicContact CD1-CG2 3.97Å; F572-V628 HydrophobicContact CE1-CG2 4.04Å; N575-V628 HydrophobicContact CB-CG1 4.19Å; I576-V628 HydrophobicContact CG1-CG1 4.19Å; F601-V628 HydrophobicContact CZ-CG2 3.77Å; Q624-V628 WeakPolarHBondContact O-CG2 3.34Å; Q624-V628 PolarHBondContact O-N 3.49Å; Q624-V628 VanDerWaalsContact O-N 3.09Å; R625-V628 PolarHBondContact O-N 2.93Å; Q626-V628 PolarHBondContact O-N 2.79Å; V628-L630 VanDerWaalsContact C-N 3.29Å; V628-L630 PolarHBondContact O-N 3.5Å; V628-A631 PolarHBondContact O-N 3.33Å; V628-R632 PolarHBondContact O-N 3.36Å
629	A	93.1	Very high	90.2	Very high	9 Å²	9	34.4 Å²	34.4	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-35.4	177.7	0	0	0	0	0	112.1	V561 P565 R625 Q626 R632 A633	V561-A629 HydrophobicContact CG1-CB 3.91Å; P565-A629 HydrophobicContact CB-CB 3.33Å; P565-A629 HydrophobicContact CG-CB 3.72Å; R625-A629 WeakPolarHBondContact O-CB 3.5Å; R625-A629 PolarHBondContact O-N 3.33Å; Q626-A629 PolarHBondContact O-N 2.94Å; A629-R632 WeakPolarHBondContact O-CB 3.25Å; A629-R632 PolarHBondContact O-N 3.32Å; A629-A633 PolarHBondContact O-N 2.95Å
630	L	92.6	Very high	91.1	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-65.1	-48.7	171.8	-175.7	62.4	0	0	0	110.8	V561 Q626 V628 R632 A633 L634 L643 V658	V561-L630 HydrophobicContact CG2-CD1 4.15Å; Q626-L630 WeakPolarHBondContact O-CB 3.21Å; Q626-L630 PolarHBondContact O-N 3.45Å; V628-L630 VanDerWaalsContact C-N 3.29Å; V628-L630 PolarHBondContact O-N 3.5Å; L630-R632 VanDerWaalsContact C-N 3.25Å; L630-R632 PolarHBondContact O-N 3.12Å; L630-A633 WeakPolarHBondContact O-CA 3.41Å; L630-A633 WeakPolarHBondContact O-CB 3.15Å; L630-A633 PolarHBondContact O-N 3.34Å; L630-L634 HydrophobicContact CD1-CD2 4.27Å; L630-L634 HydrophobicContact CD1-CG 4.22Å; L630-L634 HydrophobicContact CG-CD1 4.05Å; L630-L634 HydrophobicContact CG-CG 4.18Å; L630-L634 VanDerWaalsContact O-CG 3.28Å; L630-L634 WeakPolarHBondContact O-CG 3.27Å; L630-L634 PolarHBondContact O-N 2.95Å; L630-L643 HydrophobicContact CD1-CD2 3.89Å; L630-V658 HydrophobicContact CD2-CB 4.37Å; L630-V658 HydrophobicContact CD2-CG1 4.04Å; L630-V658 HydrophobicContact CD2-CG2 3.39Å
631	A	93.5	Very high	91.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-53.7	-42.3	173.4	0	0	0	0	0	112.5	I576 V592 S596 A627 V628 A633 L634 I635	I576-A631 HydrophobicContact CD1-CB 4.23Å; I576-A631 HydrophobicContact CG1-CB 4.04Å; I576-A631 HydrophobicContact CG2-CB 4.18Å; V592-A631 HydrophobicContact CG2-CB 4.27Å; S596-A631 WeakPolarHBondContact OG-CB 3.47Å; A627-A631 PolarHBondContact O-N 2.91Å; V628-A631 PolarHBondContact O-N 3.33Å; A631-A633 VanDerWaalsContact C-N 3.29Å; A631-A633 PolarHBondContact O-N 3.35Å; A631-L634 PolarHBondContact O-N 3.36Å; A631-I635 PolarHBondContact O-N 3.43Å
632	R	94.2	Very high	91.9	Very high	35 Å²	35	24.3 Å²	24.3	13%	0.132	12%	0.115	C	C	.	.	H	α-helix	trans	-61.1	-33.7	174.8	-177.9	-167.8	-63.1	166.6	1	112.9	L566 N575 V628 A629 L630 I635	L566-R632 PolarHBondContact O-NH1 2.75Å; N575-R632 PolarHBondContact O-NE 3.45Å; N575-R632 PolarHBondContact O-NH2 3.26Å; N575-R632 PolarHBondContact OD1-NH2 3.26Å; V628-R632 PolarHBondContact O-N 3.36Å; A629-R632 WeakPolarHBondContact O-CB 3.25Å; A629-R632 PolarHBondContact O-N 3.32Å; L630-R632 VanDerWaalsContact C-N 3.25Å; L630-R632 PolarHBondContact O-N 3.12Å; R632-I635 WeakPolarHBondContact O-CG2 3.41Å
633	A	92.8	Very high	92.2	Very high	5 Å²	5	22.9 Å²	22.9	4%	0.041	10%	0.1	C	C	.	.	H	α-helix	trans	-76.4	-43.3	174.3	0	0	0	0	0	111.8	A559 V561 A629 L630 A631 I635 R636 P638 L641	A559-A633 HydrophobicContact CB-CB 3.87Å; V561-A633 HydrophobicContact CG2-CB 3.68Å; A629-A633 PolarHBondContact O-N 2.95Å; L630-A633 WeakPolarHBondContact O-CA 3.41Å; L630-A633 WeakPolarHBondContact O-CB 3.15Å; L630-A633 PolarHBondContact O-N 3.34Å; A631-A633 VanDerWaalsContact C-N 3.29Å; A631-A633 PolarHBondContact O-N 3.35Å; A633-I635 PolarHBondContact O-N 3.45Å; A633-R636 PolarHBondContact O-N 3.06Å; A633-P638 WeakPolarHBondContact O-CD 3.31Å; A633-L641 HydrophobicContact CB-CD1 4.06Å
634	L	91.5	Very high	92.4	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-38.6	-176.2	-62.9	178.7	0	0	0	112.7	V592 E595 L630 A631 R636 K637 L661 W668	V592-L634 HydrophobicContact CB-CB 4.33Å; V592-L634 HydrophobicContact CG1-CB 4.34Å; E595-L634 HydrophobicContact CB-CD1 4.02Å; L630-L634 HydrophobicContact CD1-CD2 4.27Å; L630-L634 HydrophobicContact CD1-CG 4.22Å; L630-L634 HydrophobicContact CG-CD1 4.05Å; L630-L634 HydrophobicContact CG-CG 4.18Å; L630-L634 VanDerWaalsContact O-CG 3.28Å; L630-L634 WeakPolarHBondContact O-CG 3.27Å; L630-L634 PolarHBondContact O-N 2.95Å; A631-L634 PolarHBondContact O-N 3.36Å; L634-R636 PolarHBondContact O-N 3.5Å; L634-R636 VanDerWaalsContact O-N 3.11Å; L634-K637 PolarHBondContact O-N 2.94Å; L634-L661 HydrophobicContact CD1-CD2 4.21Å; L634-L661 HydrophobicContact CD2-CD2 3.7Å; L634-W668 HydrophobicContact CD2-CH2 3.47Å; L634-W668 VanDerWaalsContact CD2-CH2 3.47Å; L634-W668 HydrophobicContact CD2-CZ2 3.19Å; L634-W668 HydrophobicContact CG-CZ2 4.49Å
635	I	92.8	Very high	92.2	Very high	7 Å²	7	21.6 Å²	21.6	4%	0.036	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.2	-178.8	-160.5	166.5	0	0	0	113.8	I576 L580 P584 I589 V592 A631 R632 A633 K637	I576-I635 HydrophobicContact CG2-CD1 3.93Å; I576-I635 WeakPolarHBondContact O-CG2 3.43Å; L580-I635 HydrophobicContact CD1-CD1 3.99Å; L580-I635 HydrophobicContact CD1-CG1 4.08Å; L580-I635 HydrophobicContact CD1-CG2 4.05Å; P584-I635 HydrophobicContact CB-CD1 3.81Å; P584-I635 HydrophobicContact CG-CD1 3.9Å; I589-I635 HydrophobicContact CG1-CD1 4.08Å; V592-I635 HydrophobicContact CG1-CB 4.15Å; V592-I635 HydrophobicContact CG1-CG1 4.41Å; V592-I635 HydrophobicContact CG2-CB 4.14Å; V592-I635 HydrophobicContact CG2-CD1 4.3Å; V592-I635 HydrophobicContact CG2-CG1 4.39Å; A631-I635 PolarHBondContact O-N 3.43Å; R632-I635 WeakPolarHBondContact O-CG2 3.41Å; A633-I635 PolarHBondContact O-N 3.45Å; I635-K637 VanDerWaalsContact C-N 3.27Å; I635-K637 PolarHBondContact O-N 3.41Å
636	R	90.6	Very high	91.6	Very high	62 Å²	62	18.7 Å²	18.7	23%	0.234	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-14.8	176.9	-62.9	-177.5	-179.4	-164.4	1	113.1	H555 Y578 L580 A633 L634	H555-R636 PolarHBondContact O-NH1 3.08Å; H555-R636 VanDerWaalsContact O-NH1 3.08Å; Y578-R636 PolarHBondContact O-NH2 2.96Å; L580-R636 HydrophobicContact CD2-CG 4.01Å; A633-R636 PolarHBondContact O-N 3.06Å; L634-R636 PolarHBondContact O-N 3.5Å; L634-R636 VanDerWaalsContact O-N 3.11Å
637	K	89.8	Confident	91	Very high	126 Å²	126	18.6 Å²	18.6	55%	0.548	8%	0.082	S	C	.	.			trans	49.2	55.4	-173.6	-59.5	-178.4	177.9	-176.9	0	112.2	L634 I635	L634-K637 PolarHBondContact O-N 2.94Å; I635-K637 VanDerWaalsContact C-N 3.27Å; I635-K637 PolarHBondContact O-N 3.41Å
638	P	92.4	Very high	90.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.097	C	C	.	.			trans	-66.7	150.2	-173.5	31.7	-39.2	0	0	0	112	Q557 A559 A633 L641 W668 R671	Q557-P638 CarbonylContact O-C 3.55Å; Q557-P638 WeakPolarHBondContact O-CA 3.13Å; Q557-P638 VanDerWaalsContact O-CB 3.27Å; Q557-P638 WeakPolarHBondContact O-CB 3.37Å; A559-P638 HydrophobicContact CB-CB 3.75Å; A559-P638 HydrophobicContact CB-CG 3.68Å; A633-P638 WeakPolarHBondContact O-CD 3.31Å; P638-L641 HydrophobicContact CG-CB 4.41Å; P638-L641 HydrophobicContact CG-CD1 4.4Å; P638-W668 HydrophobicContact CG-CH2 4.37Å; P638-R671 VanDerWaalsContact O-CD 3.29Å; P638-R671 WeakPolarHBondContact O-CD 3.48Å
639	R	92.5	Very high	89.6	Confident	92 Å²	92	23.1 Å²	23.1	35%	0.347	12%	0.116	S	C	.	.	S	Bend	trans	-78.8	-29.3	170	-69.2	-70.4	-176.3	-179.7	1.3	112.5	M476 Q557 T672	M476-R639 HydrophobicContact CB-CG 4.3Å; M476-R639 HydrophobicContact CG-CB 4.45Å; M476-R639 HydrophobicContact SD-CB 4.11Å; Q557-R639 PolarHBondContact O-N 3.38Å; R639-T672 PolarHBondContact O-N 3Å
640	L	94.1	Very high	89	Confident	2 Å²	2	23 Å²	23	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.1	174.5	178.4	64.1	0	0	0	109.4	V480 L505 L528 Q557 V558 A559 I642 T672	V480-L640 HydrophobicContact CG2-CD1 4.31Å; V480-L640 HydrophobicContact CG2-CD2 3.91Å; L505-L640 HydrophobicContact CD1-CD1 4.48Å; L528-L640 HydrophobicContact CD2-CD2 4.23Å; Q557-L640 PolarHBondContact O-N 2.8Å; V558-L640 WeakPolarHBondContact CA-O 3.2Å; V558-L640 HydrophobicContact CG1-CB 4.44Å; V558-L640 HydrophobicContact CG1-CD2 3.98Å; V558-L640 HydrophobicContact CG1-CG 4.26Å; V558-L640 HydrophobicContact CG2-CB 4.16Å; V558-L640 HydrophobicContact CG2-CD2 4.03Å; A559-L640 PolarHBondContact N-O 3.44Å; L640-I642 HydrophobicContact CG-CG1 4.4Å; L640-T672 WeakPolarHBondContact CA-O 3.49Å; L640-T672 HydrophobicContact CD1-CG2 3.53Å
641	L	94.4	Very high	88.5	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.8	174.5	178.9	67.2	0	0	0	110	A559 A633 P638 L643 L662 W668 T672 V673 L674	A559-L641 HydrophobicContact CB-CD1 4.26Å; A559-L641 WeakPolarHBondContact O-CA 3.26Å; A633-L641 HydrophobicContact CB-CD1 4.06Å; P638-L641 HydrophobicContact CG-CB 4.41Å; P638-L641 HydrophobicContact CG-CD1 4.4Å; L641-L643 HydrophobicContact CD1-CD2 4.13Å; L641-L643 HydrophobicContact CD2-CD1 4.16Å; L641-L643 HydrophobicContact CD2-CD2 4.11Å; L641-L643 HydrophobicContact CD2-CG 4.13Å; L641-L643 HydrophobicContact CG-CD2 4.09Å; L641-L643 HydrophobicContact CG-CG 4.1Å; L641-L662 HydrophobicContact CD2-CD2 3.96Å; L641-W668 HydrophobicContact CB-CH2 4.5Å; L641-W668 HydrophobicContact CB-CZ3 3.86Å; L641-W668 HydrophobicContact CD2-CE3 4.3Å; L641-W668 HydrophobicContact CD2-CH2 3.73Å; L641-W668 HydrophobicContact CD2-CZ3 3.41Å; L641-W668 VanDerWaalsContact CD2-CZ3 3.41Å; L641-W668 HydrophobicContact CG-CZ3 4.2Å; L641-T672 PolarHBondContact N-O 3.17Å; L641-V673 HydrophobicContact CB-CG2 4.47Å; L641-V673 CarbonylContact O-C 3.56Å; L641-V673 WeakPolarHBondContact O-CA 3.35Å; L641-L674 PolarHBondContact O-N 3.28Å
642	I	95.1	Very high	87.8	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.5	176.6	-53.6	166.9	0	0	0	108.2	A525 L528 Q529 V558 A559 A560 V561 L640 L674	A525-I642 HydrophobicContact CB-CG2 3.77Å; L528-I642 HydrophobicContact CB-CD1 3.61Å; L528-I642 HydrophobicContact CD1-CD1 3.94Å; L528-I642 HydrophobicContact CD1-CG1 4.36Å; L528-I642 HydrophobicContact CG-CD1 4.43Å; Q529-I642 HydrophobicContact CG-CD1 4.03Å; V558-I642 HydrophobicContact CG1-CD1 3.97Å; A559-I642 PolarHBondContact O-N 3.48Å; A560-I642 CarbonylContact C-O 3.47Å; A560-I642 VanDerWaalsContact CA-O 3.28Å; A560-I642 WeakPolarHBondContact CA-O 3.25Å; A560-I642 HydrophobicContact CB-CB 3.99Å; A560-I642 HydrophobicContact CB-CD1 4.45Å; V561-I642 PolarHBondContact N-O 2.96Å; L640-I642 HydrophobicContact CG-CG1 4.4Å; I642-L674 WeakPolarHBondContact CA-O 3.49Å; I642-L674 HydrophobicContact CG1-CB 4.43Å; I642-L674 HydrophobicContact CG2-CD2 4.26Å
643	L	93.2	Very high	87.2	Confident	2 Å²	2	31 Å²	31	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	106.8	177.6	-61.9	176.7	0	0	0	108	V561 L630 L641 A646 L662 L674 L675 I676	V561-L643 HydrophobicContact CB-CD2 3.95Å; V561-L643 HydrophobicContact CG2-CD2 3.8Å; L630-L643 HydrophobicContact CD1-CD2 3.89Å; L641-L643 HydrophobicContact CD1-CD2 4.13Å; L641-L643 HydrophobicContact CD2-CD1 4.16Å; L641-L643 HydrophobicContact CD2-CD2 4.11Å; L641-L643 HydrophobicContact CD2-CG 4.13Å; L641-L643 HydrophobicContact CG-CD2 4.09Å; L641-L643 HydrophobicContact CG-CG 4.1Å; L643-A646 HydrophobicContact CB-CB 4.29Å; L643-A646 HydrophobicContact CD2-CB 4.18Å; L643-L662 HydrophobicContact CD1-CD1 3.65Å; L643-L662 HydrophobicContact CD1-CD2 4.17Å; L643-L674 PolarHBondContact N-O 3.34Å; L643-L675 HydrophobicContact CB-CD1 3.77Å; L643-L675 HydrophobicContact CD1-CD1 4.15Å; L643-I676 PolarHBondContact O-N 3.02Å
644	D	91.9	Very high	86.7	Confident	19 Å²	19	31.7 Å²	31.7	10%	0.102	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	92.9	177.1	-164.9	7.3	0	0	0	110.4	S522 V561 G562 Q563 A646 I676	S522-D644 WeakPolarHBondContact CB-OD2 3.27Å; S522-D644 PolarHBondContact OG-OD2 3.38Å; V561-D644 PolarHBondContact O-N 3.45Å; G562-D644 CarbonylContact C-O 3.57Å; Q563-D644 WeakPolarHBondContact CA-O 3.41Å; Q563-D644 PolarHBondContact N-O 3.49Å; D644-A646 PolarHBondContact O-N 2.93Å; D644-I676 HydrophobicContact CB-CD1 4.13Å; D644-I676 WeakPolarHBondContact OD1-CB 3.47Å; D644-I676 VanDerWaalsContact OD1-CG2 3.25Å; D644-I676 WeakPolarHBondContact OD1-CG2 3.36Å
645	D	84.7	Confident	86.2	Confident	15 Å²	15	34 Å²	34	8%	0.08	19%	0.194	C	C	.	.	S	Bend	trans	50.2	26.2	-176.2	-156.1	45.3	0	0	0	114.1	Q563 Q626 T647 S648 I676	Q563-D645 HydrophobicContact CB-CB 4.49Å; Q563-D645 HydrophobicContact CG-CB 4.17Å; Q626-D645 PolarHBondContact NE2-O 3.46Å; D645-T647 PolarHBondContact O-N 2.95Å; D645-S648 VanDerWaalsContact CG-OG 3.26Å; D645-S648 PolarHBondContact O-N 3Å; D645-S648 PolarHBondContact O-OG 2.69Å; D645-S648 WeakPolarHBondContact OD1-CB 3.37Å; D645-S648 VanDerWaalsContact OD2-CB 3.23Å; D645-S648 WeakPolarHBondContact OD2-CB 3.46Å; D645-S648 PolarHBondContact OD2-OG 2.98Å; D645-I676 WeakPolarHBondContact CA-O 3.36Å; D645-I676 PolarHBondContact N-O 2.91Å
646	A	78.4	Confident	85.8	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.025	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-2.6	-171.2	0	0	0	0	0	114.5	V561 Q626 L643 D644	V561-A646 HydrophobicContact CB-CB 3.74Å; V561-A646 HydrophobicContact CG1-CB 3.48Å; V561-A646 VanDerWaalsContact CG1-CB 3.48Å; Q626-A646 PolarHBondContact OE1-O 3.32Å; L643-A646 HydrophobicContact CB-CB 4.29Å; L643-A646 HydrophobicContact CD2-CB 4.18Å; D644-A646 PolarHBondContact O-N 2.93Å
647	T	78.3	Confident	85.5	Confident	4 Å²	4	39 Å²	39	3%	0.025	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-5.7	179.3	57	0	0	0	0	113	D645 A649 L650 Q655 V658 Q679 L682	D645-T647 PolarHBondContact O-N 2.95Å; T647-A649 PolarHBondContact O-N 2.96Å; T647-L650 HydrophobicContact CG2-CD1 4.26Å; T647-L650 PolarHBondContact O-N 2.72Å; T647-Q655 WeakPolarHBondContact O-CG 3.09Å; T647-Q655 PolarHBondContact O-NE2 3.49Å; T647-V658 HydrophobicContact CG2-CB 4.41Å; T647-V658 HydrophobicContact CG2-CG1 3.88Å; T647-Q679 PolarHBondContact OG1-OE1 3.08Å; T647-L682 HydrophobicContact CG2-CD1 4.45Å; T647-L682 WeakPolarHBondContact OG1-CD1 3.45Å
648	S	78.1	Confident	85.3	Confident	46 Å²	46	33 Å²	33	32%	0.322	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-33	-171.6	60.6	0	0	0	0	113.8	D645	D645-S648 VanDerWaalsContact CG-OG 3.26Å; D645-S648 PolarHBondContact O-N 3Å; D645-S648 PolarHBondContact O-OG 2.69Å; D645-S648 WeakPolarHBondContact OD1-CB 3.37Å; D645-S648 VanDerWaalsContact OD2-CB 3.23Å; D645-S648 WeakPolarHBondContact OD2-CB 3.46Å; D645-S648 PolarHBondContact OD2-OG 2.98Å
649	A	77.4	Confident	84.9	Confident	49 Å²	49	34.3 Å²	34.3	41%	0.405	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0.2	179.8	0	0	0	0	0	113.6	G623 Q626 T647	G623-A649 WeakPolarHBondContact CA-O 3.45Å; G623-A649 PolarHBondContact N-O 3.24Å; Q626-A649 VanDerWaalsContact OE1-N 3.11Å; T647-A649 PolarHBondContact O-N 2.96Å
650	L	79.8	Confident	84.6	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.042	21%	0.205	C	C	.	.	S	Bend	trans	-74.5	145.7	173.1	-66.3	177.1	0	0	0	110.6	G623 Q626 A627 T647 N654 Q655 V658	G623-L650 VanDerWaalsContact O-CD2 3.23Å; G623-L650 WeakPolarHBondContact O-CD2 3.49Å; Q626-L650 HydrophobicContact CB-CD2 4.2Å; Q626-L650 HydrophobicContact CB-CG 4.47Å; A627-L650 HydrophobicContact CB-CD2 4Å; T647-L650 HydrophobicContact CG2-CD1 4.26Å; T647-L650 PolarHBondContact O-N 2.72Å; L650-N654 HydrophobicContact CB-CB 4.32Å; L650-N654 HydrophobicContact CD2-CB 4.42Å; L650-Q655 HydrophobicContact CB-CG 3.72Å; L650-Q655 PolarHBondContact O-NE2 3.07Å; L650-Q655 VanDerWaalsContact O-NE2 3.08Å; L650-V658 HydrophobicContact CD1-CG2 4.02Å
651	D	82.2	Confident	84.2	Confident	87 Å²	87	37 Å²	37	47%	0.465	21%	0.209	S	C	.	.			trans	-65.4	157.1	169.4	61.4	-69	0	0	0	111.2	G653 N654 Q655	D651-G653 PolarHBondContact O-N 3Å; D651-G653 VanDerWaalsContact O-N 3.12Å; D651-G653 PolarHBondContact OD2-N 2.94Å; D651-N654 PolarHBondContact O-N 3.33Å; D651-N654 VanDerWaalsContact O-N 3.1Å; D651-N654 VanDerWaalsContact OD1-CB 3.3Å; D651-N654 WeakPolarHBondContact OD1-CB 3.15Å; D651-N654 VanDerWaalsContact OD1-CG 3.26Å; D651-N654 PolarHBondContact OD1-ND2 3.43Å; D651-N654 PolarHBondContact OD2-N 3.48Å; D651-Q655 WeakPolarHBondContact O-CG 3.32Å; D651-Q655 PolarHBondContact O-N 2.98Å
652	A	80.6	Confident	83.7	Confident	78 Å²	78	37.5 Å²	37.5	65%	0.645	21%	0.212	S	C	*	.	H	α-helix	trans	-56.5	-33.3	-175.1	0	0	0	0	0	113.5	L656	A652-L656 PolarHBondContact O-N 3.39Å; A652-L656 VanDerWaalsContact O-N 3.13Å
653	G	80.5	Confident	83.2	Confident	41 Å²	41	39.5 Å²	39.5	42%	0.423	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-49	177.1	0	0	0	0	0	112	D651 L656 R657	D651-G653 PolarHBondContact O-N 3Å; D651-G653 VanDerWaalsContact O-N 3.12Å; D651-G653 PolarHBondContact OD2-N 2.94Å; G653-L656 PolarHBondContact O-N 3.47Å; G653-R657 PolarHBondContact O-N 3.45Å
654	N	81.8	Confident	82.7	Confident	19 Å²	19	44.7 Å²	44.7	10%	0.102	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-37	176.9	-74.1	-27.8	0	0	0	112.9	G597 L650 D651 L656 R657 V658	G597-N654 VanDerWaalsContact CA-OD1 3.27Å; G597-N654 WeakPolarHBondContact CA-OD1 3.22Å; L650-N654 HydrophobicContact CB-CB 4.32Å; L650-N654 HydrophobicContact CD2-CB 4.42Å; D651-N654 PolarHBondContact O-N 3.33Å; D651-N654 VanDerWaalsContact O-N 3.1Å; D651-N654 VanDerWaalsContact OD1-CB 3.3Å; D651-N654 WeakPolarHBondContact OD1-CB 3.15Å; D651-N654 VanDerWaalsContact OD1-CG 3.26Å; D651-N654 PolarHBondContact OD1-ND2 3.43Å; D651-N654 PolarHBondContact OD2-N 3.48Å; N654-L656 VanDerWaalsContact C-N 3.31Å; N654-L656 PolarHBondContact O-N 2.87Å; N654-R657 WeakPolarHBondContact O-CB 3.42Å; N654-R657 PolarHBondContact O-N 3.41Å; N654-R657 VanDerWaalsContact O-N 3.15Å; N654-V658 WeakPolarHBondContact O-CG2 3.49Å; N654-V658 PolarHBondContact O-N 3.43Å
655	Q	82.6	Confident	82.1	Confident	52 Å²	52	45.2 Å²	45.2	24%	0.243	25%	0.249	C	C	.	.	H	α-helix	trans	-56.5	-45.1	172.7	-74	178	-16.5	0	0	111.8	T647 L650 D651 R657 V658 Q659 Q679	T647-Q655 WeakPolarHBondContact O-CG 3.09Å; T647-Q655 PolarHBondContact O-NE2 3.49Å; L650-Q655 HydrophobicContact CB-CG 3.72Å; L650-Q655 PolarHBondContact O-NE2 3.07Å; L650-Q655 VanDerWaalsContact O-NE2 3.08Å; D651-Q655 WeakPolarHBondContact O-CG 3.32Å; D651-Q655 PolarHBondContact O-N 2.98Å; Q655-R657 VanDerWaalsContact C-N 3.33Å; Q655-R657 PolarHBondContact O-N 2.95Å; Q655-V658 PolarHBondContact O-N 3.39Å; Q655-Q659 WeakPolarHBondContact O-CB 3.27Å; Q655-Q659 PolarHBondContact O-N 2.87Å; Q655-Q679 VanDerWaalsContact NE2-NE2 3.1Å
656	L	83.9	Confident	81.6	Confident	74 Å²	74	49.9 Å²	49.9	39%	0.387	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-40.6	177.3	-165.6	85.4	0	0	0	111.6	A652 G653 N654 Q659 R660	A652-L656 PolarHBondContact O-N 3.39Å; A652-L656 VanDerWaalsContact O-N 3.13Å; G653-L656 PolarHBondContact O-N 3.47Å; N654-L656 VanDerWaalsContact C-N 3.31Å; N654-L656 PolarHBondContact O-N 2.87Å; L656-Q659 PolarHBondContact O-N 2.99Å; L656-R660 WeakPolarHBondContact O-CG 3.31Å; L656-R660 PolarHBondContact O-N 3.49Å
657	R	84.3	Confident	81.3	Confident	100 Å²	100	54.7 Å²	54.7	38%	0.377	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-48.1	176.2	-70.1	-177	-176.2	-147.8	15.6	111.7	M594 D600 G653 N654 Q655 Q659 R660 L661	M594-R657 PolarHBondContact O-NH1 3Å; D600-R657 IonicContact OD2-CZ 3.74Å; D600-R657 IonicContact OD2-NH2 3.78Å; D600-R657 PolarHBondContact OD2-NH2 3.03Å; D600-R657 VanDerWaalsContact OD2-NH2 3.08Å; G653-R657 PolarHBondContact O-N 3.45Å; N654-R657 WeakPolarHBondContact O-CB 3.42Å; N654-R657 PolarHBondContact O-N 3.41Å; N654-R657 VanDerWaalsContact O-N 3.15Å; Q655-R657 VanDerWaalsContact C-N 3.33Å; Q655-R657 PolarHBondContact O-N 2.95Å; R657-Q659 VanDerWaalsContact C-N 3.3Å; R657-Q659 PolarHBondContact O-N 3.24Å; R657-R660 PolarHBondContact O-N 2.85Å; R657-L661 WeakPolarHBondContact O-CB 3.49Å; R657-L661 PolarHBondContact O-N 3.18Å
658	V	84.8	Confident	81.2	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-40.3	177.4	178.7	0	0	0	0	110.8	L630 T647 L650 N654 Q655 L661 L662	L630-V658 HydrophobicContact CD2-CB 4.37Å; L630-V658 HydrophobicContact CD2-CG1 4.04Å; L630-V658 HydrophobicContact CD2-CG2 3.39Å; T647-V658 HydrophobicContact CG2-CB 4.41Å; T647-V658 HydrophobicContact CG2-CG1 3.88Å; L650-V658 HydrophobicContact CD1-CG2 4.02Å; N654-V658 WeakPolarHBondContact O-CG2 3.49Å; N654-V658 PolarHBondContact O-N 3.43Å; Q655-V658 PolarHBondContact O-N 3.39Å; V658-L661 WeakPolarHBondContact O-CB 3.31Å; V658-L661 PolarHBondContact O-N 3Å; V658-L662 HydrophobicContact CG1-CD1 4.06Å; V658-L662 HydrophobicContact CG1-CG 4.36Å; V658-L662 VanDerWaalsContact O-CG 3.32Å; V658-L662 WeakPolarHBondContact O-CG 3.29Å; V658-L662 PolarHBondContact O-N 3.21Å
659	Q	85.2	Confident	80.9	Confident	27 Å²	27	56 Å²	56	13%	0.126	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-45.7	176.9	-167.6	-178.2	36.5	0	0	112	Q655 L656 R657 L661 L662 Y663 L682	Q655-Q659 WeakPolarHBondContact O-CB 3.27Å; Q655-Q659 PolarHBondContact O-N 2.87Å; L656-Q659 PolarHBondContact O-N 2.99Å; R657-Q659 VanDerWaalsContact C-N 3.3Å; R657-Q659 PolarHBondContact O-N 3.24Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 2.97Å; Q659-L662 PolarHBondContact O-N 3.44Å; Q659-Y663 HydrophobicContact CG-CD2 3.89Å; Q659-Y663 HydrophobicContact CG-CE2 4.22Å; Q659-Y663 WeakPolarHBondContact O-CD2 3.33Å; Q659-Y663 PolarHBondContact O-N 3.02Å; Q659-L682 HydrophobicContact CB-CD2 4.31Å; Q659-L682 HydrophobicContact CG-CD2 3.98Å
660	R	85.8	Confident	81	Confident	133 Å²	133	56.6 Å²	56.6	50%	0.502	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-40.6	174.6	-68.9	-177.1	177.4	157.3	-1.2	111.6	L656 R657 L662 E664 S665	L656-R660 WeakPolarHBondContact O-CG 3.31Å; L656-R660 PolarHBondContact O-N 3.49Å; R657-R660 PolarHBondContact O-N 2.85Å; R660-L662 PolarHBondContact O-N 3.43Å; R660-E664 WeakPolarHBondContact CG-OE2 3.42Å; R660-E664 WeakPolarHBondContact O-CA 3.4Å; R660-E664 VanDerWaalsContact O-CB 3.27Å; R660-E664 WeakPolarHBondContact O-CB 3.33Å; R660-E664 PolarHBondContact O-N 3.47Å; R660-S665 PolarHBondContact O-N 3.02Å
661	L	84.8	Confident	81.4	Confident	16 Å²	16	57.3 Å²	57.3	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-47	175.4	-175.6	104.8	0	0	0	111.7	E595 L634 R657 V658 Q659 S665 W668	E595-L661 HydrophobicContact CB-CD1 3.96Å; E595-L661 HydrophobicContact CG-CD1 4.01Å; L634-L661 HydrophobicContact CD1-CD2 4.21Å; L634-L661 HydrophobicContact CD2-CD2 3.7Å; R657-L661 WeakPolarHBondContact O-CB 3.49Å; R657-L661 PolarHBondContact O-N 3.18Å; V658-L661 WeakPolarHBondContact O-CB 3.31Å; V658-L661 PolarHBondContact O-N 3Å; Q659-L661 VanDerWaalsContact C-N 3.32Å; Q659-L661 PolarHBondContact O-N 2.97Å; L661-S665 WeakPolarHBondContact O-CB 3.43Å; L661-W668 HydrophobicContact CD2-CD2 4.47Å; L661-W668 HydrophobicContact CD2-CZ2 4.24Å
662	L	84.6	Confident	82	Confident	12 Å²	12	53.2 Å²	53.2	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-73.3	-34	-175.7	-66.1	175.5	0	0	0	113.8	L641 L643 V658 Q659 R660 V673	L641-L662 HydrophobicContact CD2-CD2 3.96Å; L643-L662 HydrophobicContact CD1-CD1 3.65Å; L643-L662 HydrophobicContact CD1-CD2 4.17Å; V658-L662 HydrophobicContact CG1-CD1 4.06Å; V658-L662 HydrophobicContact CG1-CG 4.36Å; V658-L662 VanDerWaalsContact O-CG 3.32Å; V658-L662 WeakPolarHBondContact O-CG 3.29Å; V658-L662 PolarHBondContact O-N 3.21Å; Q659-L662 PolarHBondContact O-N 3.44Å; R660-L662 PolarHBondContact O-N 3.43Å; L662-V673 HydrophobicContact CD2-CG1 4.12Å; L662-V673 HydrophobicContact CD2-CG2 4.26Å
663	Y	84.3	Confident	82.6	Confident	43 Å²	43	49.6 Å²	49.6	17%	0.169	27%	0.265	C	S	.	.	H	α-helix	trans	-108.6	-26.7	-171.3	-69.4	-75	0	0	0	114.7	V510 Q659 L682 R685 A686 H687	V510-Y663 HydrophobicContact CB-CE1 3.86Å; V510-Y663 HydrophobicContact CG1-CE1 4.14Å; V510-Y663 HydrophobicContact CG2-CD1 4.16Å; V510-Y663 HydrophobicContact CG2-CE1 3.81Å; Q659-Y663 HydrophobicContact CG-CD2 3.89Å; Q659-Y663 HydrophobicContact CG-CE2 4.22Å; Q659-Y663 WeakPolarHBondContact O-CD2 3.33Å; Q659-Y663 PolarHBondContact O-N 3.02Å; Y663-L682 PolarHBondContact OH-O 3.08Å; Y663-R685 HydrophobicContact CE1-CB 4.19Å; Y663-R685 WeakPolarHBondContact CE1-O 3.4Å; Y663-R685 HydrophobicContact CE2-CB 4.16Å; Y663-A686 WeakPolarHBondContact OH-CA 3.21Å; Y663-A686 PolarHBondContact OH-N 3.32Å; Y663-H687 AromaticContact CD1-CE1 3.92Å
664	E	82.1	Confident	83.3	Confident	111 Å²	111	47.6 Å²	47.6	52%	0.519	25%	0.245	S	C	.	.	H	α-helix	trans	-112.4	-18.6	-171.9	-59.1	169.1	-161.8	0	0	112.6	R660 R685	R660-E664 WeakPolarHBondContact CG-OE2 3.42Å; R660-E664 WeakPolarHBondContact O-CA 3.4Å; R660-E664 VanDerWaalsContact O-CB 3.27Å; R660-E664 WeakPolarHBondContact O-CB 3.33Å; R660-E664 PolarHBondContact O-N 3.47Å; E664-R685 IonicContact OE1-NH2 3.5Å
665	S	80.6	Confident	83.9	Confident	30 Å²	30	46.8 Å²	46.8	21%	0.21	24%	0.241	C	C	.	.			trans	-77	124.9	-177.8	-173.6	0	0	0	0	112.7	R660 L661 E667 W668 A669	R660-S665 PolarHBondContact O-N 3.02Å; L661-S665 WeakPolarHBondContact O-CB 3.43Å; S665-E667 PolarHBondContact O-N 3.39Å; S665-W668 PolarHBondContact O-N 3.38Å; S665-W668 VanDerWaalsContact O-N 3.09Å; S665-A669 PolarHBondContact O-N 3.48Å
666	P	73.3	Confident	84.4	Confident	112 Å²	112	44.4 Å²	44.4	73%	0.727	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.7	179.3	24.1	-31.6	0	0	0	112.9	W668 A669	P666-W668 PolarHBondContact O-N 3.31Å; P666-A669 WeakPolarHBondContact O-CB 3.3Å; P666-A669 PolarHBondContact O-N 3.16Å
667	E	73.1	Confident	84.6	Confident	104 Å²	104	41 Å²	41	49%	0.486	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-24.2	176.4	-61.7	-162.8	173.7	0	0	113.4	S665 R671	S665-E667 PolarHBondContact O-N 3.39Å; E667-R671 PolarHBondContact O-NE 3.3Å; E667-R671 VanDerWaalsContact O-NE 3.07Å
668	W	74.9	Confident	84.4	Confident	8 Å²	8	41 Å²	41	3%	0.03	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-12.9	-177.5	-70.6	83.8	0	0	0	112.8	L634 P638 L641 L661 S665 P666 S670 R671 V673	L634-W668 HydrophobicContact CD2-CH2 3.47Å; L634-W668 VanDerWaalsContact CD2-CH2 3.47Å; L634-W668 HydrophobicContact CD2-CZ2 3.19Å; L634-W668 HydrophobicContact CG-CZ2 4.49Å; P638-W668 HydrophobicContact CG-CH2 4.37Å; L641-W668 HydrophobicContact CB-CH2 4.5Å; L641-W668 HydrophobicContact CB-CZ3 3.86Å; L641-W668 HydrophobicContact CD2-CE3 4.3Å; L641-W668 HydrophobicContact CD2-CH2 3.73Å; L641-W668 HydrophobicContact CD2-CZ3 3.41Å; L641-W668 VanDerWaalsContact CD2-CZ3 3.41Å; L641-W668 HydrophobicContact CG-CZ3 4.2Å; L661-W668 HydrophobicContact CD2-CD2 4.47Å; L661-W668 HydrophobicContact CD2-CZ2 4.24Å; S665-W668 PolarHBondContact O-N 3.38Å; S665-W668 VanDerWaalsContact O-N 3.09Å; P666-W668 PolarHBondContact O-N 3.31Å; W668-S670 PolarHBondContact O-N 3.17Å; W668-R671 HydrophobicContact CE3-CB 4.21Å; W668-R671 VanDerWaalsContact CE3-CD 3.42Å; W668-R671 HydrophobicContact CE3-CG 4.41Å; W668-R671 PolarHBondContact O-N 2.78Å; W668-V673 HydrophobicContact CE3-CG2 4.41Å
669	A	73.3	Confident	84.1	Confident	70 Å²	70	43 Å²	43	58%	0.579	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.3	177.6	0	0	0	0	0	114.4	G508 S665 P666	G508-A669 WeakPolarHBondContact CA-O 3.31Å; S665-A669 PolarHBondContact O-N 3.48Å; P666-A669 WeakPolarHBondContact O-CB 3.3Å; P666-A669 PolarHBondContact O-N 3.16Å
670	S	78.3	Confident	83.9	Confident	62 Å²	62	43.9 Å²	43.9	43%	0.434	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	0.8	177.1	65.8	0	0	0	0	114.4	W668	W668-S670 PolarHBondContact O-N 3.17Å
671	R	89.5	Confident	83.7	Confident	23 Å²	23	40.9 Å²	40.9	9%	0.087	23%	0.23	C	C	.	.	S	Bend	trans	-102.8	149.4	-173.3	-59	176.4	-169.5	-162.9	8.7	110.8	G508 P638 E667 W668	G508-R671 VanDerWaalsContact CA-O 3.27Å; G508-R671 WeakPolarHBondContact CA-O 3.47Å; G508-R671 PolarHBondContact N-O 2.98Å; P638-R671 VanDerWaalsContact O-CD 3.29Å; P638-R671 WeakPolarHBondContact O-CD 3.48Å; E667-R671 PolarHBondContact O-NE 3.3Å; E667-R671 VanDerWaalsContact O-NE 3.07Å; W668-R671 HydrophobicContact CE3-CB 4.21Å; W668-R671 VanDerWaalsContact CE3-CD 3.42Å; W668-R671 HydrophobicContact CE3-CG 4.41Å; W668-R671 PolarHBondContact O-N 2.78Å
672	T	93.9	Very high	83.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.4	173.7	-55.3	0	0	0	0	108.4	G478 L505 P507 R639 L640 L641	G478-T672 WeakPolarHBondContact O-CB 3.37Å; G478-T672 PolarHBondContact O-OG1 3.21Å; L505-T672 HydrophobicContact CB-CG2 3.67Å; P507-T672 VanDerWaalsContact CA-OG1 3.29Å; P507-T672 WeakPolarHBondContact CA-OG1 3.39Å; R639-T672 PolarHBondContact O-N 3Å; L640-T672 WeakPolarHBondContact CA-O 3.49Å; L640-T672 HydrophobicContact CD1-CG2 3.53Å; L641-T672 PolarHBondContact N-O 3.17Å
673	V	94	Very high	83.6	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.7	178.1	-177.2	0	0	0	0	109.3	K509 V510 T511 L641 L662 W668	K509-V673 PolarHBondContact O-N 2.93Å; V510-V673 HydrophobicContact CB-CB 4.42Å; V510-V673 HydrophobicContact CG1-CB 4.26Å; V510-V673 HydrophobicContact CG1-CG1 4.16Å; V510-V673 HydrophobicContact CG2-CB 4.14Å; V510-V673 HydrophobicContact CG2-CG2 4.41Å; T511-V673 PolarHBondContact N-O 3.28Å; L641-V673 HydrophobicContact CB-CG2 4.47Å; L641-V673 CarbonylContact O-C 3.56Å; L641-V673 WeakPolarHBondContact O-CA 3.35Å; L662-V673 HydrophobicContact CD2-CG1 4.12Å; L662-V673 HydrophobicContact CD2-CG2 4.26Å; W668-V673 HydrophobicContact CE3-CG2 4.41Å
674	L	95.3	Very high	83.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	113.6	166.8	179.2	66.8	0	0	0	108.8	L505 T511 L513 V524 L528 L641 I642 L643	L505-L674 HydrophobicContact CD1-CB 4.25Å; L505-L674 HydrophobicContact CD1-CD1 4.44Å; L505-L674 HydrophobicContact CD2-CD1 4.16Å; T511-L674 WeakPolarHBondContact O-CA 3.28Å; L513-L674 HydrophobicContact CB-CD1 4.04Å; V524-L674 HydrophobicContact CG1-CD2 4.28Å; L528-L674 HydrophobicContact CD1-CD2 3.31Å; L641-L674 PolarHBondContact O-N 3.28Å; I642-L674 WeakPolarHBondContact CA-O 3.49Å; I642-L674 HydrophobicContact CG1-CB 4.43Å; I642-L674 HydrophobicContact CG2-CD2 4.26Å; L643-L674 PolarHBondContact N-O 3.34Å
675	L	93.9	Very high	84	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.2	177.6	179.3	67.6	0	0	0	109.5	V510 T511 A512 L513 L643 T677 L682	V510-L675 HydrophobicContact CG1-CB 4.42Å; T511-L675 PolarHBondContact O-N 3.14Å; A512-L675 CarbonylContact C-O 3.51Å; A512-L675 WeakPolarHBondContact CA-O 3.36Å; L513-L675 PolarHBondContact N-O 3.39Å; L643-L675 HydrophobicContact CB-CD1 3.77Å; L643-L675 HydrophobicContact CD1-CD1 4.15Å; L675-T677 HydrophobicContact CD2-CG2 3.93Å; L675-T677 HydrophobicContact CG-CG2 3.99Å; L675-L682 HydrophobicContact CD2-CB 3.86Å
676	I	93.5	Very high	84.5	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	117.3	167	-56	163.5	0	0	0	106.1	L513 K521 A525 L643 D644 D645	L513-I676 HydrophobicContact CB-CG1 4.09Å; L513-I676 HydrophobicContact CD2-CD1 4.47Å; L513-I676 HydrophobicContact CD2-CG1 4.09Å; K521-I676 HydrophobicContact CB-CD1 4.34Å; K521-I676 HydrophobicContact CB-CG2 3.71Å; K521-I676 HydrophobicContact CD-CG2 3.89Å; K521-I676 HydrophobicContact CG-CG2 4.36Å; K521-I676 WeakPolarHBondContact O-CD1 3.23Å; A525-I676 HydrophobicContact CB-CD1 3.86Å; L643-I676 PolarHBondContact O-N 3.02Å; D644-I676 HydrophobicContact CB-CD1 4.13Å; D644-I676 WeakPolarHBondContact OD1-CB 3.47Å; D644-I676 VanDerWaalsContact OD1-CG2 3.25Å; D644-I676 WeakPolarHBondContact OD1-CG2 3.36Å; D645-I676 WeakPolarHBondContact CA-O 3.36Å; D645-I676 PolarHBondContact N-O 2.91Å
677	T	86.5	Confident	85.4	Confident	3 Å²	3	40 Å²	40	2%	0.018	21%	0.211	C	C	.	.			trans	-147.1	146.9	-176.5	-171.4	0	0	0	0	111.2	L675 Q679 L682 A683	L675-T677 HydrophobicContact CD2-CG2 3.93Å; L675-T677 HydrophobicContact CG-CG2 3.99Å; T677-Q679 WeakPolarHBondContact OG1-CB 3.38Å; T677-Q679 PolarHBondContact OG1-N 3.04Å; T677-L682 HydrophobicContact CG2-CB 4.24Å; T677-A683 HydrophobicContact CG2-CB 4.09Å
678	Q	80.8	Confident	86.4	Confident	100 Å²	100	37 Å²	37	47%	0.467	20%	0.197	S	C	.	.	S	Bend	trans	-95.7	-8.8	165.7	-56	-169.2	4.7	0	0	111.8	N517 L680	N517-Q678 PolarHBondContact OD1-NE2 3.35Å; Q678-L680 PolarHBondContact O-N 3.31Å
679	Q	79.1	Confident	87.3	Confident	44 Å²	44	36.6 Å²	36.6	21%	0.206	20%	0.195	C	C	.	.			trans	-79.8	114.3	-179.2	-62.4	-178.4	-35.2	0	0	110.1	T647 Q655 T677 S681 L682 A683	T647-Q679 PolarHBondContact OG1-OE1 3.08Å; Q655-Q679 VanDerWaalsContact NE2-NE2 3.1Å; T677-Q679 WeakPolarHBondContact OG1-CB 3.38Å; T677-Q679 PolarHBondContact OG1-N 3.04Å; Q679-S681 VanDerWaalsContact C-N 3.31Å; Q679-S681 PolarHBondContact O-N 3.37Å; Q679-L682 HydrophobicContact CB-CD1 4.38Å; Q679-L682 HydrophobicContact CB-CG 4.46Å; Q679-L682 PolarHBondContact O-N 3.4Å; Q679-A683 PolarHBondContact O-N 3.35Å
680	L	80	Confident	88.3	Confident	46 Å²	46	33.2 Å²	33.2	24%	0.241	17%	0.168	C	C	.	.	H	α-helix	trans	-57.5	-43.8	-178.7	-177	62.9	0	0	0	112.2	Q678 L682 A683 E684 V717	Q678-L680 PolarHBondContact O-N 3.31Å; L680-L682 PolarHBondContact O-N 2.73Å; L680-L682 VanDerWaalsContact O-N 3.17Å; L680-A683 PolarHBondContact O-N 2.9Å; L680-A683 VanDerWaalsContact O-N 3.08Å; L680-E684 HydrophobicContact CD1-CG 4Å; L680-E684 WeakPolarHBondContact CD2-OE1 3.41Å; L680-E684 HydrophobicContact CG-CG 4.01Å; L680-E684 VanDerWaalsContact CG-OE1 3.29Å; L680-E684 WeakPolarHBondContact CG-OE1 3.37Å; L680-E684 WeakPolarHBondContact O-CB 3.34Å; L680-E684 VanDerWaalsContact O-CG 3.28Å; L680-E684 WeakPolarHBondContact O-CG 3.49Å; L680-E684 PolarHBondContact O-N 3.13Å; L680-V717 HydrophobicContact CD1-CB 4.42Å; L680-V717 HydrophobicContact CD1-CG1 4.12Å; L680-V717 HydrophobicContact CD1-CG2 3.65Å; L680-V717 HydrophobicContact CD2-CG1 3.89Å
681	S	81.3	Confident	89	Confident	70 Å²	70	30.8 Å²	30.8	49%	0.49	15%	0.149	S	C	.	.	H	α-helix	trans	-59	-30.2	-178.1	57	0	0	0	0	114.4	Q679	Q679-S681 VanDerWaalsContact C-N 3.31Å; Q679-S681 PolarHBondContact O-N 3.37Å
682	L	82.4	Confident	89.2	Confident	11 Å²	11	29.7 Å²	29.7	6%	0.058	15%	0.145	C	C	.	.	H	α-helix	trans	-85.1	-35.8	175.9	-67.9	179	0	0	0	112.3	T647 Q659 Y663 L675 T677 Q679 L680	T647-L682 HydrophobicContact CG2-CD1 4.45Å; T647-L682 WeakPolarHBondContact OG1-CD1 3.45Å; Q659-L682 HydrophobicContact CB-CD2 4.31Å; Q659-L682 HydrophobicContact CG-CD2 3.98Å; Y663-L682 PolarHBondContact OH-O 3.08Å; L675-L682 HydrophobicContact CD2-CB 3.86Å; T677-L682 HydrophobicContact CG2-CB 4.24Å; Q679-L682 HydrophobicContact CB-CD1 4.38Å; Q679-L682 HydrophobicContact CB-CG 4.46Å; Q679-L682 PolarHBondContact O-N 3.4Å; L680-L682 PolarHBondContact O-N 2.73Å; L680-L682 VanDerWaalsContact O-N 3.17Å
683	A	85.7	Confident	89	Confident	2 Å²	2	33.7 Å²	33.7	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-67.2	-39.6	175.9	0	0	0	0	0	111.9	A512 V514 T677 Q679 L680 R685 A686 I689	A512-A683 HydrophobicContact CB-CB 4.36Å; V514-A683 HydrophobicContact CG2-CB 4.03Å; T677-A683 HydrophobicContact CG2-CB 4.09Å; Q679-A683 PolarHBondContact O-N 3.35Å; L680-A683 PolarHBondContact O-N 2.9Å; L680-A683 VanDerWaalsContact O-N 3.08Å; A683-R685 VanDerWaalsContact C-N 3.32Å; A683-R685 PolarHBondContact O-N 2.65Å; A683-A686 VanDerWaalsContact O-CB 3.26Å; A683-A686 WeakPolarHBondContact O-CB 3.29Å; A683-A686 PolarHBondContact O-N 3.49Å; A683-A686 VanDerWaalsContact O-N 3.13Å; A683-I689 VanDerWaalsContact O-CD1 3.25Å; A683-I689 WeakPolarHBondContact O-CD1 3.46Å
684	E	87.7	Confident	88.7	Confident	82 Å²	82	40.4 Å²	40.4	38%	0.383	19%	0.194	S	C	.	.	H	α-helix	trans	-59.1	-38.8	179.4	-78.8	178.4	173.6	0	0	113.3	L680 A686 H703	L680-E684 HydrophobicContact CD1-CG 4Å; L680-E684 WeakPolarHBondContact CD2-OE1 3.41Å; L680-E684 HydrophobicContact CG-CG 4.01Å; L680-E684 VanDerWaalsContact CG-OE1 3.29Å; L680-E684 WeakPolarHBondContact CG-OE1 3.37Å; L680-E684 WeakPolarHBondContact O-CB 3.34Å; L680-E684 VanDerWaalsContact O-CG 3.28Å; L680-E684 WeakPolarHBondContact O-CG 3.49Å; L680-E684 PolarHBondContact O-N 3.13Å; E684-A686 VanDerWaalsContact C-N 3.29Å; E684-A686 PolarHBondContact O-N 3.5Å; E684-H703 IonicContact OE1-CE1 3.87Å
685	R	87.7	Confident	88.3	Confident	108 Å²	108	40.5 Å²	40.5	41%	0.408	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.5	179.5	-68.4	-178.4	75.4	172.7	-0.1	113.6	Y663 E664 A683	Y663-R685 HydrophobicContact CE1-CB 4.19Å; Y663-R685 WeakPolarHBondContact CE1-O 3.4Å; Y663-R685 HydrophobicContact CE2-CB 4.16Å; E664-R685 IonicContact OE1-NH2 3.5Å; A683-R685 VanDerWaalsContact C-N 3.32Å; A683-R685 PolarHBondContact O-N 2.65Å
686	A	90.4	Very high	88.1	Confident	8 Å²	8	42.5 Å²	42.5	7%	0.066	21%	0.209	C	C	.	.			trans	-66.7	142.8	-177.4	0	0	0	0	0	111.4	A512 Y663 A683 E684 H688 I689	A512-A686 HydrophobicContact CB-CB 3.53Å; Y663-A686 WeakPolarHBondContact OH-CA 3.21Å; Y663-A686 PolarHBondContact OH-N 3.32Å; A683-A686 VanDerWaalsContact O-CB 3.26Å; A683-A686 WeakPolarHBondContact O-CB 3.29Å; A683-A686 PolarHBondContact O-N 3.49Å; A683-A686 VanDerWaalsContact O-N 3.13Å; E684-A686 VanDerWaalsContact C-N 3.29Å; E684-A686 PolarHBondContact O-N 3.5Å; A686-H688 PolarHBondContact O-N 2.93Å; A686-I689 HydrophobicContact CB-CG1 4.2Å
687	H	92.2	Very high	88.1	Confident	95 Å²	95	44.2 Å²	44.2	44%	0.44	22%	0.219	S	C	.	.	S	Bend	trans	-69.1	-27	178.9	-60.2	86.6	0	0	0	111.8	K509 V510 Y663	K509-H687 HydrophobicContact CB-CB 4.2Å; K509-H687 HydrophobicContact CD-CB 4.47Å; K509-H687 HydrophobicContact CG-CB 4.42Å; V510-H687 PolarHBondContact N-ND1 3.49Å; V510-H687 PolarHBondContact O-N 3.07Å; Y663-H687 AromaticContact CD1-CE1 3.92Å
688	H	93.8	Very high	88.2	Confident	39 Å²	39	46.9 Å²	46.9	18%	0.181	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	138.2	177.6	-168	51.3	0	0	0	109.5	V510 T511 A512 A686 G701	V510-H688 PolarHBondContact O-N 3.36Å; T511-H688 CarbonylContact C-O 3.33Å; T511-H688 VanDerWaalsContact CA-O 3.24Å; T511-H688 WeakPolarHBondContact CA-O 3.28Å; T511-H688 HydrophobicContact CG2-CB 4.23Å; A512-H688 PolarHBondContact N-O 2.89Å; A686-H688 PolarHBondContact O-N 2.93Å; H688-G701 PolarHBondContact ND1-O 3.36Å
689	I	94.8	Very high	88.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133	178.6	-56.4	177.5	0	0	0	108.1	A512 V514 A683 A686 Q700 G701 H703 L706 Y713	A512-I689 HydrophobicContact CB-CG1 4.36Å; A512-I689 CarbonylContact O-C 3.13Å; A512-I689 WeakPolarHBondContact O-CA 3.38Å; V514-I689 HydrophobicContact CG2-CG2 4.21Å; A683-I689 VanDerWaalsContact O-CD1 3.25Å; A683-I689 WeakPolarHBondContact O-CD1 3.46Å; A686-I689 HydrophobicContact CB-CG1 4.2Å; I689-Q700 VanDerWaalsContact O-CA 3.25Å; I689-Q700 WeakPolarHBondContact O-CA 3.43Å; I689-G701 PolarHBondContact N-O 2.94Å; I689-G701 PolarHBondContact O-N 2.95Å; I689-G701 VanDerWaalsContact O-N 3.13Å; I689-H703 HydrophobicContact CD1-CB 3.9Å; I689-L706 HydrophobicContact CB-CD1 3.73Å; I689-L706 HydrophobicContact CD1-CD1 4.49Å; I689-L706 HydrophobicContact CG2-CD1 3.78Å; I689-Y713 HydrophobicContact CD1-CE2 4.16Å; I689-Y713 WeakPolarHBondContact CD1-OH 3.49Å; I689-Y713 HydrophobicContact CG2-CD2 4.12Å; I689-Y713 HydrophobicContact CG2-CE2 3.83Å
690	L	94.1	Very high	89.4	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.7	173.3	-63	173.8	0	0	0	108.3	F503 T511 A512 L513 V514 V697 Q700	F503-L690 HydrophobicContact CB-CD1 4.15Å; F503-L690 HydrophobicContact CB-CD2 4.14Å; F503-L690 HydrophobicContact CD1-CD1 4.38Å; F503-L690 HydrophobicContact CD2-CD1 3.43Å; F503-L690 VanDerWaalsContact CD2-CD1 3.43Å; F503-L690 HydrophobicContact CE2-CD1 3.87Å; F503-L690 HydrophobicContact CG-CD1 3.73Å; T511-L690 HydrophobicContact CG2-CD1 3.72Å; T511-L690 HydrophobicContact CG2-CG 3.89Å; A512-L690 PolarHBondContact O-N 3.29Å; L513-L690 WeakPolarHBondContact CA-O 3.24Å; L513-L690 HydrophobicContact CD1-CB 3.71Å; L513-L690 HydrophobicContact CD1-CD1 4.45Å; V514-L690 PolarHBondContact N-O 2.91Å; L690-V697 HydrophobicContact CD2-CG1 4.36Å; L690-Q700 HydrophobicContact CD2-CB 3.66Å
691	F	93.2	Very high	90	Very high	10 Å²	10	44 Å²	44	4%	0.044	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.5	174.5	-169.5	-89.5	0	0	0	110.4	V514 K693 C698 E699 C712 Y713 M716	V514-F691 CarbonylContact O-C 3.57Å; V514-F691 WeakPolarHBondContact O-CA 3.38Å; F691-K693 HydrophobicContact CE1-CB 4.21Å; F691-C698 HydrophobicContact CD1-CB 4.24Å; F691-C698 PolarHBondContact O-N 2.91Å; F691-E699 HydrophobicContact CB-CB 4.16Å; F691-E699 PolarHBondContact N-O 3.42Å; F691-C712 HydrophobicContact CD1-CB 3.75Å; F691-C712 HydrophobicContact CE1-CB 3.37Å; F691-C712 HydrophobicContact CZ-CB 3.88Å; F691-Y713 HydrophobicContact CD2-CD2 4.12Å; F691-M716 HydrophobicContact CD2-SD 4.43Å; F691-M716 HydrophobicContact CE2-CB 4.05Å; F691-M716 HydrophobicContact CE2-CE 4.36Å; F691-M716 HydrophobicContact CE2-CG 4.47Å; F691-M716 HydrophobicContact CE2-SD 3.7Å
692	L	92.6	Very high	90.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.1	-174.5	-155.6	79.9	0	0	0	110.7	L501 L513 V514 G515 P516 S519 K521 S696 V697	L501-L692 HydrophobicContact CD1-CD1 3.44Å; L501-L692 VanDerWaalsContact CD1-CD1 3.44Å; L513-L692 HydrophobicContact CD1-CB 4Å; L513-L692 HydrophobicContact CD1-CD1 4.28Å; L513-L692 HydrophobicContact CD1-CD2 4.48Å; V514-L692 PolarHBondContact O-N 3.31Å; G515-L692 WeakPolarHBondContact CA-O 3.49Å; P516-L692 WeakPolarHBondContact CD-O 3.45Å; S519-L692 VanDerWaalsContact CB-O 3.27Å; S519-L692 WeakPolarHBondContact CB-O 3.39Å; S519-L692 WeakPolarHBondContact O-CD2 3.46Å; S519-L692 PolarHBondContact OG-O 3.17Å; K521-L692 HydrophobicContact CG-CD2 4.14Å; L692-S696 WeakPolarHBondContact CA-O 3.46Å; L692-V697 HydrophobicContact CD1-CG2 4.17Å
693	K	90.6	Very high	90.9	Very high	84 Å²	84	44.3 Å²	44.3	37%	0.365	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.6	175.8	-167.8	-176.2	174.6	-177.1	0	109.3	F691 G695 S696 C698	F691-K693 HydrophobicContact CE1-CB 4.21Å; K693-G695 PolarHBondContact O-N 2.98Å; K693-S696 PolarHBondContact N-O 3.33Å; K693-S696 PolarHBondContact O-N 3.19Å; K693-S696 PolarHBondContact O-OG 3.18Å; K693-S696 VanDerWaalsContact O-OG 3.14Å; K693-C698 WeakPolarHBondContact CB-SG 3.42Å
694	E	87.4	Confident	91.2	Very high	144 Å²	144	50 Å²	50	67%	0.673	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	35.5	176.5	-66.6	167.3	-150.7	0	0	113.7	S696	E694-S696 PolarHBondContact O-N 3.43Å
695	G	86.4	Confident	91.4	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	5.3	177.4	0	0	0	0	0	116.2	V497 L498 Q499 S519 K693	V497-G695 WeakPolarHBondContact O-CA 3.29Å; L498-G695 WeakPolarHBondContact CA-O 2.84Å; Q499-G695 PolarHBondContact N-O 2.87Å; S519-G695 WeakPolarHBondContact O-CA 3.36Å; S519-G695 PolarHBondContact O-N 3.35Å; K693-G695 PolarHBondContact O-N 2.98Å
696	S	90.7	Very high	91.5	Very high	44 Å²	44	45.7 Å²	45.7	31%	0.308	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	156.2	178	68.7	0	0	0	0	111.9	L692 K693 E694 C698	L692-S696 WeakPolarHBondContact CA-O 3.46Å; K693-S696 PolarHBondContact N-O 3.33Å; K693-S696 PolarHBondContact O-N 3.19Å; K693-S696 PolarHBondContact O-OG 3.18Å; K693-S696 VanDerWaalsContact O-OG 3.14Å; E694-S696 PolarHBondContact O-N 3.43Å; S696-C698 PolarHBondContact O-N 3.33Å
697	V	91.9	Very high	91.5	Very high	38 Å²	38	47.5 Å²	47.5	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	111.8	171.8	-176.6	0	0	0	0	108.2	L501 F503 L690 L692 Q700	L501-V697 HydrophobicContact CD1-CG2 3.47Å; L501-V697 VanDerWaalsContact CD1-CG2 3.47Å; L501-V697 HydrophobicContact CG-CG2 4.37Å; F503-V697 HydrophobicContact CD1-CG2 4.25Å; L690-V697 HydrophobicContact CD2-CG1 4.36Å; L692-V697 HydrophobicContact CD1-CG2 4.17Å; V697-Q700 HydrophobicContact CG1-CB 4.4Å
698	C	89.4	Confident	91.4	Very high	59 Å²	59	50.6 Å²	50.6	40%	0.399	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-44.3	174.7	-67.5	0	0	0	0	111.6	F691 K693 S696	F691-C698 HydrophobicContact CD1-CB 4.24Å; F691-C698 PolarHBondContact O-N 2.91Å; K693-C698 WeakPolarHBondContact CB-SG 3.42Å; S696-C698 PolarHBondContact O-N 3.33Å
699	E	91.8	Very high	91.1	Very high	32 Å²	32	55.1 Å²	55.1	15%	0.15	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.1	-172.8	-65.5	170.4	-170.7	0	0	110.7	F691 L706 G711 C712 Y713	F691-E699 HydrophobicContact CB-CB 4.16Å; F691-E699 PolarHBondContact N-O 3.42Å; E699-L706 HydrophobicContact CB-CD2 3.78Å; E699-G711 WeakPolarHBondContact OE1-CA 3.44Å; E699-C712 PolarHBondContact OE1-N 3.03Å; E699-C712 PolarHBondContact OE2-N 3.17Å; E699-Y713 PolarHBondContact OE2-N 3.47Å; E699-Y713 VanDerWaalsContact OE2-N 3.09Å
700	Q	92.8	Very high	90.5	Very high	93 Å²	93	57.2 Å²	57.2	44%	0.435	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.9	174.4	63.6	-178	6.2	0	0	110.6	I689 L690 V697	I689-Q700 VanDerWaalsContact O-CA 3.25Å; I689-Q700 WeakPolarHBondContact O-CA 3.43Å; L690-Q700 HydrophobicContact CD2-CB 3.66Å; V697-Q700 HydrophobicContact CG1-CB 4.4Å
701	G	92.4	Very high	90.3	Very high	4 Å²	4	58 Å²	58	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.4	-167	-177.2	0	0	0	0	0	112.9	H688 I689	H688-G701 PolarHBondContact ND1-O 3.36Å; I689-G701 PolarHBondContact N-O 2.94Å; I689-G701 PolarHBondContact O-N 2.95Å; I689-G701 VanDerWaalsContact O-N 3.13Å
702	T	93.2	Very high	90	Very high	50 Å²	50	59.6 Å²	59.6	31%	0.307	32%	0.317	S	S	.	.			trans	-84.6	164.5	164.9	65	0	0	0	0	110.4	L704 Q705 L706	T702-L704 VanDerWaalsContact C-N 3.32Å; T702-L704 PolarHBondContact O-N 3.04Å; T702-Q705 VanDerWaalsContact N-OE1 3.11Å; T702-Q705 PolarHBondContact O-N 3.12Å; T702-Q705 VanDerWaalsContact OG1-CG 3.27Å; T702-Q705 WeakPolarHBondContact OG1-CG 3.18Å; T702-Q705 PolarHBondContact OG1-N 3.29Å; T702-L706 WeakPolarHBondContact O-CG 3.29Å; T702-L706 PolarHBondContact O-N 2.93Å
703	H	91.2	Very high	89.8	Confident	37 Å²	37	59.6 Å²	59.6	17%	0.171	32%	0.317	C	S	.	.	H	α-helix	trans	-50.6	-50.9	176.3	176	71.7	0	0	0	112.3	E684 I689 Q705 L706 M707 Y713	E684-H703 IonicContact OE1-CE1 3.87Å; I689-H703 HydrophobicContact CD1-CB 3.9Å; H703-Q705 PolarHBondContact O-N 3.38Å; H703-L706 PolarHBondContact O-N 3.19Å; H703-M707 VanDerWaalsContact O-CG 3.3Å; H703-M707 WeakPolarHBondContact O-CG 3.05Å; H703-M707 PolarHBondContact O-N 3.38Å; H703-Y713 AromaticContact ND1-CE1 3.51Å; H703-Y713 AromaticContact ND1-CZ 3.65Å; H703-Y713 PolarHBondContact ND1-OH 3.49Å
704	L	90.8	Very high	89.7	Confident	123 Å²	123	60.1 Å²	60.1	64%	0.644	32%	0.317	S	S	*	.	H	α-helix	trans	-59.1	-46.2	179.3	-64.4	173.4	0	0	0	112.3	T702 L706 M707 E708	T702-L704 VanDerWaalsContact C-N 3.32Å; T702-L704 PolarHBondContact O-N 3.04Å; L704-L706 VanDerWaalsContact C-N 3.3Å; L704-L706 PolarHBondContact O-N 2.99Å; L704-M707 PolarHBondContact O-N 3.11Å; L704-E708 WeakPolarHBondContact O-CG 3.42Å; L704-E708 PolarHBondContact O-N 3.49Å
705	Q	91.9	Very high	89.7	Confident	99 Å²	99	56.5 Å²	56.5	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-37.1	179.1	-72.1	172	-7.7	0	0	112.5	T702 H703 K709	T702-Q705 VanDerWaalsContact N-OE1 3.11Å; T702-Q705 PolarHBondContact O-N 3.12Å; T702-Q705 VanDerWaalsContact OG1-CG 3.27Å; T702-Q705 WeakPolarHBondContact OG1-CG 3.18Å; T702-Q705 PolarHBondContact OG1-N 3.29Å; H703-Q705 PolarHBondContact O-N 3.38Å; Q705-K709 VanDerWaalsContact O-CG 3.27Å; Q705-K709 WeakPolarHBondContact O-CG 3.29Å; Q705-K709 PolarHBondContact O-N 3.08Å
706	L	90.3	Very high	89.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-75.7	-34.8	179.6	-67.3	-180	0	0	0	112.2	I689 E699 T702 H703 L704 K709 Y713	I689-L706 HydrophobicContact CB-CD1 3.73Å; I689-L706 HydrophobicContact CD1-CD1 4.49Å; I689-L706 HydrophobicContact CG2-CD1 3.78Å; E699-L706 HydrophobicContact CB-CD2 3.78Å; T702-L706 WeakPolarHBondContact O-CG 3.29Å; T702-L706 PolarHBondContact O-N 2.93Å; H703-L706 PolarHBondContact O-N 3.19Å; L704-L706 VanDerWaalsContact C-N 3.3Å; L704-L706 PolarHBondContact O-N 2.99Å; L706-K709 HydrophobicContact CD2-CD 4.45Å; L706-K709 PolarHBondContact O-N 2.83Å; L706-Y713 HydrophobicContact CB-CD1 3.41Å; L706-Y713 VanDerWaalsContact CB-CD1 3.41Å; L706-Y713 HydrophobicContact CB-CE1 4.04Å; L706-Y713 HydrophobicContact CB-CG 3.9Å; L706-Y713 HydrophobicContact CD1-CD1 4.06Å; L706-Y713 HydrophobicContact CD1-CD2 4.16Å; L706-Y713 HydrophobicContact CD1-CE1 4.48Å; L706-Y713 HydrophobicContact CD1-CG 3.87Å; L706-Y713 HydrophobicContact CG-CD1 4.39Å
707	M	90.3	Very high	89.5	Confident	46 Å²	46	56.7 Å²	56.7	23%	0.227	31%	0.305	C	S	.	.	H	α-helix	trans	-67.9	-38	174.3	-69.5	-59.7	-71.9	0	0	112.4	H703 L704 G710 Y713 R714 V717	H703-M707 VanDerWaalsContact O-CG 3.3Å; H703-M707 WeakPolarHBondContact O-CG 3.05Å; H703-M707 PolarHBondContact O-N 3.38Å; L704-M707 PolarHBondContact O-N 3.11Å; M707-G710 PolarHBondContact O-N 3.39Å; M707-Y713 HydrophobicContact CG-CE1 4.27Å; M707-Y713 HydrophobicContact SD-CD1 4.18Å; M707-Y713 HydrophobicContact SD-CE1 4.02Å; M707-R714 HydrophobicContact CE-CG 4.07Å; M707-R714 PolarHBondContact O-NH1 2.95Å; M707-R714 HydrophobicContact SD-CB 4.18Å; M707-R714 HydrophobicContact SD-CG 4.12Å; M707-V717 HydrophobicContact CE-CG1 4.14Å; M707-V717 HydrophobicContact SD-CB 4.16Å; M707-V717 HydrophobicContact SD-CG1 4.21Å; M707-V717 HydrophobicContact SD-CG2 4.08Å
708	E	90.5	Very high	89.2	Confident	160 Å²	160	59.4 Å²	59.4	75%	0.748	32%	0.315	S	S	*	.	H	α-helix	trans	-67.7	-37.3	175.2	-74.7	174.3	177.7	0	0	112.7	L704 G710	L704-E708 WeakPolarHBondContact O-CG 3.42Å; L704-E708 PolarHBondContact O-N 3.49Å; E708-G710 PolarHBondContact O-N 3.3Å
709	K	87.9	Confident	88.8	Confident	133 Å²	133	60 Å²	60	58%	0.578	33%	0.325	S	S	*	.	H	α-helix	trans	-63.6	-19.8	178.4	-81.3	175.6	-178	-178.8	0	113.9	Q705 L706 G711	Q705-K709 VanDerWaalsContact O-CG 3.27Å; Q705-K709 WeakPolarHBondContact O-CG 3.29Å; Q705-K709 PolarHBondContact O-N 3.08Å; L706-K709 HydrophobicContact CD2-CD 4.45Å; L706-K709 PolarHBondContact O-N 2.83Å; K709-G711 PolarHBondContact O-N 2.93Å
710	G	81.9	Confident	88	Confident	44 Å²	44	63.4 Å²	63.4	45%	0.454	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	23.2	178.4	0	0	0	0	0	114.4	M707 E708	M707-G710 PolarHBondContact O-N 3.39Å; E708-G710 PolarHBondContact O-N 3.3Å
711	G	89.1	Confident	86.8	Confident	17 Å²	17	62.6 Å²	62.6	18%	0.175	35%	0.352	C	S	.	.	S	Bend	trans	-92.8	-158.7	-170.6	0	0	0	0	0	115.3	E699 K709 Y713 R714 S715	E699-G711 WeakPolarHBondContact OE1-CA 3.44Å; K709-G711 PolarHBondContact O-N 2.93Å; G711-Y713 VanDerWaalsContact C-N 3.26Å; G711-Y713 PolarHBondContact O-N 2.74Å; G711-R714 PolarHBondContact O-N 3.31Å; G711-R714 VanDerWaalsContact O-N 3.13Å; G711-S715 PolarHBondContact O-N 3.06Å; G711-S715 VanDerWaalsContact O-N 3.16Å; G711-S715 PolarHBondContact O-OG 3.33Å
712	C	86.8	Confident	85.2	Confident	43 Å²	43	65.1 Å²	65.1	29%	0.291	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-36.2	-177.6	-63.3	0	0	0	0	112.7	F691 E699 S715 M716	F691-C712 HydrophobicContact CD1-CB 3.75Å; F691-C712 HydrophobicContact CE1-CB 3.37Å; F691-C712 HydrophobicContact CZ-CB 3.88Å; E699-C712 PolarHBondContact OE1-N 3.03Å; E699-C712 PolarHBondContact OE2-N 3.17Å; C712-S715 PolarHBondContact O-N 3.18Å; C712-M716 PolarHBondContact O-N 3.05Å; C712-M716 VanDerWaalsContact O-N 3.17Å
713	Y	88.3	Confident	82.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-62.1	-47.2	176.4	177.4	-100	0	0	0	111.3	I689 F691 E699 H703 L706 M707 G711 S715 M716 V717	I689-Y713 HydrophobicContact CD1-CE2 4.16Å; I689-Y713 WeakPolarHBondContact CD1-OH 3.49Å; I689-Y713 HydrophobicContact CG2-CD2 4.12Å; I689-Y713 HydrophobicContact CG2-CE2 3.83Å; F691-Y713 HydrophobicContact CD2-CD2 4.12Å; E699-Y713 PolarHBondContact OE2-N 3.47Å; E699-Y713 VanDerWaalsContact OE2-N 3.09Å; H703-Y713 AromaticContact ND1-CE1 3.51Å; H703-Y713 AromaticContact ND1-CZ 3.65Å; H703-Y713 PolarHBondContact ND1-OH 3.49Å; L706-Y713 HydrophobicContact CB-CD1 3.41Å; L706-Y713 VanDerWaalsContact CB-CD1 3.41Å; L706-Y713 HydrophobicContact CB-CE1 4.04Å; L706-Y713 HydrophobicContact CB-CG 3.9Å; L706-Y713 HydrophobicContact CD1-CD1 4.06Å; L706-Y713 HydrophobicContact CD1-CD2 4.16Å; L706-Y713 HydrophobicContact CD1-CE1 4.48Å; L706-Y713 HydrophobicContact CD1-CG 3.87Å; L706-Y713 HydrophobicContact CG-CD1 4.39Å; M707-Y713 HydrophobicContact CG-CE1 4.27Å; M707-Y713 HydrophobicContact SD-CD1 4.18Å; M707-Y713 HydrophobicContact SD-CE1 4.02Å; G711-Y713 VanDerWaalsContact C-N 3.26Å; G711-Y713 PolarHBondContact O-N 2.74Å; Y713-S715 PolarHBondContact O-N 3.39Å; Y713-M716 HydrophobicContact CD2-CE 3.92Å; Y713-M716 HydrophobicContact CE2-CE 3.9Å; Y713-M716 WeakPolarHBondContact O-CB 3.48Å; Y713-M716 PolarHBondContact O-N 3.23Å; Y713-V717 HydrophobicContact CD1-CG2 4.13Å; Y713-V717 HydrophobicContact CE1-CG2 3.75Å; Y713-V717 HydrophobicContact CE2-CG2 4.32Å; Y713-V717 WeakPolarHBondContact O-CG2 3.39Å; Y713-V717 PolarHBondContact O-N 3.4Å
714	R	88.6	Confident	80.4	Confident	95 Å²	95	72 Å²	72	36%	0.358	42%	0.424	S	S	.	.	H	α-helix	trans	-61.4	-44	178.9	-177.5	-178	177.5	149.6	-6.7	111.6	M707 G711 M716 V717 E718	M707-R714 HydrophobicContact CE-CG 4.07Å; M707-R714 PolarHBondContact O-NH1 2.95Å; M707-R714 HydrophobicContact SD-CB 4.18Å; M707-R714 HydrophobicContact SD-CG 4.12Å; G711-R714 PolarHBondContact O-N 3.31Å; G711-R714 VanDerWaalsContact O-N 3.13Å; R714-M716 VanDerWaalsContact C-N 3.25Å; R714-M716 PolarHBondContact O-N 3.46Å; R714-V717 PolarHBondContact O-N 3.33Å; R714-V717 VanDerWaalsContact O-N 3.08Å; R714-E718 HydrophobicContact CG-CG 4.25Å; R714-E718 IonicContact CZ-OE1 3.47Å; R714-E718 IonicContact NE-OE1 2.74Å; R714-E718 PolarHBondContact NE-OE1 3.37Å; R714-E718 IonicContact NH2-OE1 3.27Å; R714-E718 PolarHBondContact NH2-OE1 2.9Å; R714-E718 WeakPolarHBondContact O-CG 3.5Å; R714-E718 PolarHBondContact O-N 3.16Å
715	S	86.9	Confident	77.7	Confident	69 Å²	69	76.9 Å²	76.9	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-59	-37.5	177.1	-54.8	0	0	0	0	112.4	G711 C712 Y713 A719	G711-S715 PolarHBondContact O-N 3.06Å; G711-S715 VanDerWaalsContact O-N 3.16Å; G711-S715 PolarHBondContact O-OG 3.33Å; C712-S715 PolarHBondContact O-N 3.18Å; Y713-S715 PolarHBondContact O-N 3.39Å; S715-A719 VanDerWaalsContact O-CB 3.23Å; S715-A719 WeakPolarHBondContact O-CB 3.35Å; S715-A719 PolarHBondContact O-N 2.95Å
716	M	86.4	Confident	77	Confident	36 Å²	36	75.8 Å²	75.8	18%	0.177	45%	0.45	C	S	.	.	H	α-helix	trans	-67.6	-42.3	174.1	178.2	-161.8	73.7	0	0	111.7	V514 F691 C712 Y713 R714 A719 L720	V514-M716 HydrophobicContact CB-CE 4.34Å; V514-M716 HydrophobicContact CG1-CE 3.42Å; V514-M716 VanDerWaalsContact CG1-CE 3.42Å; V514-M716 HydrophobicContact CG1-SD 3.47Å; V514-M716 WeakPolarHBondContact CG1-SD 3.3Å; F691-M716 HydrophobicContact CD2-SD 4.43Å; F691-M716 HydrophobicContact CE2-CB 4.05Å; F691-M716 HydrophobicContact CE2-CE 4.36Å; F691-M716 HydrophobicContact CE2-CG 4.47Å; F691-M716 HydrophobicContact CE2-SD 3.7Å; C712-M716 PolarHBondContact O-N 3.05Å; C712-M716 VanDerWaalsContact O-N 3.17Å; Y713-M716 HydrophobicContact CD2-CE 3.92Å; Y713-M716 HydrophobicContact CE2-CE 3.9Å; Y713-M716 WeakPolarHBondContact O-CB 3.48Å; Y713-M716 PolarHBondContact O-N 3.23Å; R714-M716 VanDerWaalsContact C-N 3.25Å; R714-M716 PolarHBondContact O-N 3.46Å; M716-A719 PolarHBondContact O-N 3.3Å; M716-L720 HydrophobicContact CG-CD1 3.97Å; M716-L720 WeakPolarHBondContact O-CB 3.35Å; M716-L720 VanDerWaalsContact O-CG 3.3Å; M716-L720 WeakPolarHBondContact O-CG 2.93Å; M716-L720 PolarHBondContact O-N 3.33Å
717	V	86.5	Confident	76.3	Confident	12 Å²	12	79.7 Å²	79.7	7%	0.073	47%	0.474	C	S	.	.	H	α-helix	trans	-61.8	-46.2	176.9	175.9	0	0	0	0	111	L680 M707 Y713 R714 L720 A721	L680-V717 HydrophobicContact CD1-CB 4.42Å; L680-V717 HydrophobicContact CD1-CG1 4.12Å; L680-V717 HydrophobicContact CD1-CG2 3.65Å; L680-V717 HydrophobicContact CD2-CG1 3.89Å; M707-V717 HydrophobicContact CE-CG1 4.14Å; M707-V717 HydrophobicContact SD-CB 4.16Å; M707-V717 HydrophobicContact SD-CG1 4.21Å; M707-V717 HydrophobicContact SD-CG2 4.08Å; Y713-V717 HydrophobicContact CD1-CG2 4.13Å; Y713-V717 HydrophobicContact CE1-CG2 3.75Å; Y713-V717 HydrophobicContact CE2-CG2 4.32Å; Y713-V717 WeakPolarHBondContact O-CG2 3.39Å; Y713-V717 PolarHBondContact O-N 3.4Å; R714-V717 PolarHBondContact O-N 3.33Å; R714-V717 VanDerWaalsContact O-N 3.08Å; V717-L720 PolarHBondContact O-N 3.24Å; V717-A721 WeakPolarHBondContact O-CB 3.48Å; V717-A721 PolarHBondContact O-N 3.39Å
718	E	85.8	Confident	75.5	Confident	96 Å²	96	81.6 Å²	81.6	45%	0.449	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-40.5	177.9	-71.5	175	170.7	0	0	111.8	R714 L720 A721 A722	R714-E718 HydrophobicContact CG-CG 4.25Å; R714-E718 IonicContact CZ-OE1 3.47Å; R714-E718 IonicContact NE-OE1 2.74Å; R714-E718 PolarHBondContact NE-OE1 3.37Å; R714-E718 IonicContact NH2-OE1 3.27Å; R714-E718 PolarHBondContact NH2-OE1 2.9Å; R714-E718 WeakPolarHBondContact O-CG 3.5Å; R714-E718 PolarHBondContact O-N 3.16Å; E718-L720 VanDerWaalsContact C-N 3.33Å; E718-L720 PolarHBondContact O-N 3.17Å; E718-A721 PolarHBondContact O-N 3.41Å; E718-A722 PolarHBondContact O-N 3.4Å
719	A	82.1	Confident	74.7	Confident	72 Å²	72	77 Å²	77	60%	0.595	47%	0.473	S	S	*	.	H	α-helix	trans	-65.6	-33.6	175.8	0	0	0	0	0	113.2	S715 M716	S715-A719 VanDerWaalsContact O-CB 3.23Å; S715-A719 WeakPolarHBondContact O-CB 3.35Å; S715-A719 PolarHBondContact O-N 2.95Å; M716-A719 PolarHBondContact O-N 3.3Å
720	L	74.1	Confident	73.8	Confident	103 Å²	103	73.5 Å²	73.5	54%	0.539	47%	0.466	S	S	.	.	H	α-helix	trans	-77.4	-24.2	174.8	-72.7	167.5	0	0	0	112.8	M716 V717 E718	M716-L720 HydrophobicContact CG-CD1 3.97Å; M716-L720 WeakPolarHBondContact O-CB 3.35Å; M716-L720 VanDerWaalsContact O-CG 3.3Å; M716-L720 WeakPolarHBondContact O-CG 2.93Å; M716-L720 PolarHBondContact O-N 3.33Å; V717-L720 PolarHBondContact O-N 3.24Å; E718-L720 VanDerWaalsContact C-N 3.33Å; E718-L720 PolarHBondContact O-N 3.17Å
721	A	68.6	Low	73.3	Confident	76 Å²	76	75.5 Å²	75.5	63%	0.628	47%	0.467	S	S	*	.	H	α-helix	trans	-88.6	-17.2	177.7	0	0	0	0	0	113.3	V717 E718	V717-A721 WeakPolarHBondContact O-CB 3.48Å; V717-A721 PolarHBondContact O-N 3.39Å; E718-A721 PolarHBondContact O-N 3.41Å
722	A	57.2	Low	72.2	Confident	57 Å²	57	79.6 Å²	79.6	47%	0.471	49%	0.488	S	S	.	.	S	Bend	trans	-67.4	131.9	173.7	0	0	0	0	0	110	E718 S724	E718-A722 PolarHBondContact O-N 3.4Å; A722-S724 PolarHBondContact O-N 3.35Å
723	P	41.7	Very low	71	Confident	108 Å²	108	82.5 Å²	82.5	70%	0.701	50%	0.503	S	S	*	.			trans	-59.4	130.1	174.3	23.9	-30.1	0	0	0	109	D725	P723-D725 PolarHBondContact O-N 3.41Å
724	S	42.3	Very low	69.6	Low	122 Å²	122	89.3 Å²	89.3	85%	0.853	55%	0.545	S	S	*	.			trans	-66.3	100.7	167.9	52.9	0	0	0	0	107.9	A722	A722-S724 PolarHBondContact O-N 3.35Å
725	D	35.1	Very low	67.9	Low	226 Å²	226	88.8 Å²	88.8	100%	1.209	56%	0.562	S	S	*	*			trans	-62	0	172.7	-77.3	-23.1	0	0	0	112.5	P723	P723-D725 PolarHBondContact O-N 3.41Å

Retrieved 725 of 725 residues in 518.9 ms (Link to these results)

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