A0A096MBU8_POEFO Loading...

Solute carrier family 15 member 1

Electrogenic proton-coupled amino-acid transporter that transports oligopeptides of 2 to 4 amino acids with a preference for dipeptides. Transports neutral and monovalently charged peptides with a proton to peptide stoichiometry of 1:1 or 2:1. Primarily responsible for the absorption of dietary di- and tripeptides from the small intestinal lumen. Mediates transepithelial transport of muramyl and N-formylated bacterial dipeptides contributing to recognition of pathogenic bacteria by the mucosal immune system.

AlphaFold DB , UniProt , Accession A0A096MBU8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 732 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	34	Very low	32.6	Very low	256 Å²	256	175.5 Å²	175.5	100%	1.261	87%	0.872	S	S	*	*				0	105.3	0	-108.2	168.6	158.3	0	0	105.9
2	G	30.2	Very low	33.5	Very low	70 Å²	70	178 Å²	178	72%	0.722	87%	0.874	S	S	*	*			cis	169.5	100.9	11	0	0	0	0	0	103.1	K4	G2-K4 PolarHBondContact O-N 3.25Å
3	D	30.9	Very low	35.1	Very low	178 Å²	178	169.8 Å²	169.8	95%	0.952	85%	0.845	S	S	*	*			trans	-74.3	68.3	-170.7	-151.1	6.7	0	0	0	110.6
4	K	32.8	Very low	36.6	Very low	194 Å²	194	164.1 Å²	164.1	84%	0.843	82%	0.824	S	S	*	*			trans	-142.4	79.1	-179.4	-81.8	-171.7	176.8	178.8	0	109.8	G2	G2-K4 PolarHBondContact O-N 3.25Å
5	E	30.4	Very low	38.1	Very low	180 Å²	180	159.1 Å²	159.1	84%	0.841	81%	0.805	S	S	*	*	S	Bend	trans	-149.1	113.6	149.9	-117	175.1	179.9	0	0	112.4
6	K	31.2	Very low	39.2	Very low	174 Å²	174	154.4 Å²	154.4	76%	0.757	78%	0.782	S	S	*	*			trans	71	66.7	160.4	-67.1	176.3	-179.3	169.7	0	118.8	M8	K6-M8 PolarHBondContact O-N 2.94Å; K6-M8 VanDerWaalsContact O-N 3.11Å
7	K	30	Very low	40.3	Very low	217 Å²	217	157.1 Å²	157.1	94%	0.943	79%	0.788	S	S	*	*			trans	-70.3	81.1	133.7	-78.7	-176.2	179.3	177.2	0	108.9	G9	K7-G9 PolarHBondContact O-N 3.37Å
8	M	30	Very low	41.7	Very low	164 Å²	164	150.4 Å²	150.4	81%	0.808	77%	0.765	S	S	*	*			trans	-67.9	113.5	157.8	-96.6	169.3	69.4	0	0	106.6	K6 K10	K6-M8 PolarHBondContact O-N 2.94Å; K6-M8 VanDerWaalsContact O-N 3.11Å; M8-K10 PolarHBondContact O-N 3.46Å; M8-K10 VanDerWaalsContact O-N 3.14Å
9	G	29.6	Very low	43	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	74%	0.737	S	S	*	*			trans	-53.9	119.2	-178.4	0	0	0	0	0	111.1	K7 R11	K7-G9 PolarHBondContact O-N 3.37Å; G9-R11 PolarHBondContact O-N 3.01Å
10	K	39.3	Very low	44.5	Very low	196 Å²	196	138.8 Å²	138.8	85%	0.852	70%	0.703	S	S	*	*			trans	-54.3	113.5	162.8	-82.8	-176.8	173.4	-177.4	0	106.9	M8 K12	M8-K10 PolarHBondContact O-N 3.46Å; M8-K10 VanDerWaalsContact O-N 3.14Å; K10-K12 PolarHBondContact O-N 3.31Å
11	R	40.6	Very low	46.1	Very low	228 Å²	228	134.3 Å²	134.3	86%	0.86	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-50.3	123.1	169.1	-97.8	178.2	169.7	167.2	-3.3	107.4	G9 S13	G9-R11 PolarHBondContact O-N 3.01Å; R11-S13 PolarHBondContact O-N 3.08Å
12	K	43.2	Very low	48.4	Very low	206 Å²	206	122.4 Å²	122.4	90%	0.896	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-54.9	116.5	171	-76.5	-176.8	175.6	-178.5	0	107.1	K10 V14	K10-K12 PolarHBondContact O-N 3.31Å; K12-V14 PolarHBondContact O-N 2.94Å
13	S	53.6	Low	51	Low	71 Å²	71	119.7 Å²	119.7	50%	0.497	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-63.5	128.2	174.5	55.6	0	0	0	0	107.8	R11 T15	R11-S13 PolarHBondContact O-N 3.08Å; S13-T15 PolarHBondContact O-N 3.27Å
14	V	57	Low	53.7	Low	91 Å²	91	117.5 Å²	117.5	55%	0.552	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-64.9	123.8	173.2	179.1	0	0	0	0	106.8	K12 L21	K12-V14 PolarHBondContact O-N 2.94Å; V14-L21 HydrophobicContact CB-CB 4.48Å; V14-L21 HydrophobicContact CB-CD2 4.37Å; V14-L21 HydrophobicContact CG1-CD2 4.29Å; V14-L21 VanDerWaalsContact O-CB 3.23Å; V14-L21 WeakPolarHBondContact O-CB 3.46Å; V14-L21 PolarHBondContact O-N 2.9Å
15	T	58.9	Low	56.5	Low	88 Å²	88	110 Å²	110	54%	0.54	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.3	179.5	49.5	0	0	0	0	110	S13 Y19	S13-T15 PolarHBondContact O-N 3.27Å; T15-Y19 CarbonylContact C-O 3.45Å; T15-Y19 VanDerWaalsContact CA-O 3.22Å; T15-Y19 WeakPolarHBondContact CA-O 3.42Å
16	I	55.1	Low	59.4	Low	85 Å²	85	101.4 Å²	101.4	44%	0.436	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.6	169.7	-69.3	-167.6	0	0	0	106.8	G18 Y19 L21	I16-G18 PolarHBondContact O-N 3.46Å; I16-G18 VanDerWaalsContact O-N 3.08Å; I16-Y19 PolarHBondContact N-O 3.49Å; I16-Y19 PolarHBondContact O-N 3.03Å; I16-L21 HydrophobicContact CD1-CD1 3.61Å; I16-L21 HydrophobicContact CG1-CD1 4.17Å
17	F	58.8	Low	62.2	Low	200 Å²	200	94 Å²	94	88%	0.877	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	29	-175	-59.5	-67.3	0	0	0	114.8	Y19	F17-Y19 VanDerWaalsContact C-N 3.33Å; F17-Y19 WeakPolarHBondContact O-CD2 3.48Å
18	G	64.3	Low	65.2	Low	37 Å²	37	85.3 Å²	85.3	38%	0.381	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	2	-178	0	0	0	0	0	115.2	I16 Q165	I16-G18 PolarHBondContact O-N 3.46Å; I16-G18 VanDerWaalsContact O-N 3.08Å; G18-Q165 PolarHBondContact O-NE2 3.33Å
19	Y	67.8	Low	68.2	Low	60 Å²	60	77.5 Å²	77.5	24%	0.235	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.2	175.8	-67.2	-89	0	0	0	111.5	T15 I16 F17 L21 I23 F158 Q165 T168	T15-Y19 CarbonylContact C-O 3.45Å; T15-Y19 VanDerWaalsContact CA-O 3.22Å; T15-Y19 WeakPolarHBondContact CA-O 3.42Å; I16-Y19 PolarHBondContact N-O 3.49Å; I16-Y19 PolarHBondContact O-N 3.03Å; F17-Y19 VanDerWaalsContact C-N 3.33Å; F17-Y19 WeakPolarHBondContact O-CD2 3.48Å; Y19-L21 PolarHBondContact O-N 2.99Å; Y19-I23 HydrophobicContact CD1-CD1 4.13Å; Y19-F158 HydrophobicContact CD1-CE1 4.11Å; Y19-F158 HydrophobicContact CD1-CZ 4.31Å; Y19-F158 HydrophobicContact CE1-CE1 4.48Å; Y19-Q165 HydrophobicContact CD1-CB 4.44Å; Y19-Q165 HydrophobicContact CE1-CB 3.93Å; Y19-Q165 HydrophobicContact CE1-CG 4.41Å; Y19-T168 VanDerWaalsContact OH-CB 3.23Å; Y19-T168 WeakPolarHBondContact OH-CB 3.42Å; Y19-T168 VanDerWaalsContact OH-CG2 3.22Å; Y19-T168 WeakPolarHBondContact OH-CG2 3.31Å
20	P	72.4	Confident	71.2	Confident	8 Å²	8	74.2 Å²	74.2	5%	0.052	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.3	126.1	165.9	-25	27.7	0	0	0	111.8	S22 I23	P20-S22 WeakPolarHBondContact CB-OG 3.24Å; P20-S22 PolarHBondContact O-N 3.01Å; P20-I23 HydrophobicContact CB-CD1 3.86Å; P20-I23 HydrophobicContact CB-CG1 4.3Å; P20-I23 VanDerWaalsContact CD-CD1 3.43Å; P20-I23 HydrophobicContact CG-CD1 3.76Å; P20-I23 WeakPolarHBondContact O-CB 3.3Å; P20-I23 PolarHBondContact O-N 3.15Å
21	L	78.2	Confident	73.8	Confident	45 Å²	45	67.6 Å²	67.6	24%	0.236	33%	0.333	C	S	.	.	H	α-helix	trans	-57.7	-22.1	177.2	175.6	62.8	0	0	0	112.6	V14 I16 Y19 I23 F24 F25 M229	V14-L21 HydrophobicContact CB-CB 4.48Å; V14-L21 HydrophobicContact CB-CD2 4.37Å; V14-L21 HydrophobicContact CG1-CD2 4.29Å; V14-L21 VanDerWaalsContact O-CB 3.23Å; V14-L21 WeakPolarHBondContact O-CB 3.46Å; V14-L21 PolarHBondContact O-N 2.9Å; I16-L21 HydrophobicContact CD1-CD1 3.61Å; I16-L21 HydrophobicContact CG1-CD1 4.17Å; Y19-L21 PolarHBondContact O-N 2.99Å; L21-I23 PolarHBondContact O-N 3.29Å; L21-F24 PolarHBondContact O-N 2.83Å; L21-F25 HydrophobicContact CG-CE2 4.21Å; L21-F25 WeakPolarHBondContact O-CD2 3.49Å; L21-M229 HydrophobicContact CB-CE 3.54Å; L21-M229 HydrophobicContact CD2-CE 3.76Å; L21-M229 HydrophobicContact CG-CE 3.62Å
22	S	81.5	Confident	76.4	Confident	5 Å²	5	57.1 Å²	57.1	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-56.9	-32.3	172	50.2	0	0	0	0	113.5	P20 F24 F25 Y230	P20-S22 WeakPolarHBondContact CB-OG 3.24Å; P20-S22 PolarHBondContact O-N 3.01Å; S22-F24 VanDerWaalsContact C-N 3.33Å; S22-F24 PolarHBondContact O-N 2.85Å; S22-F25 PolarHBondContact O-N 2.84Å; S22-Y230 WeakPolarHBondContact O-CE1 3.45Å
23	I	85	Confident	78.8	Confident	13 Å²	13	47.3 Å²	47.3	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-36.8	-177	-67.9	154	0	0	0	111.6	Y19 P20 L21 F25 I26 V27 Q157 F158 F169	Y19-I23 HydrophobicContact CD1-CD1 4.13Å; P20-I23 HydrophobicContact CB-CD1 3.86Å; P20-I23 HydrophobicContact CB-CG1 4.3Å; P20-I23 VanDerWaalsContact CD-CD1 3.43Å; P20-I23 HydrophobicContact CG-CD1 3.76Å; P20-I23 WeakPolarHBondContact O-CB 3.3Å; P20-I23 PolarHBondContact O-N 3.15Å; L21-I23 PolarHBondContact O-N 3.29Å; I23-F25 VanDerWaalsContact C-N 3.27Å; I23-F25 PolarHBondContact O-N 2.98Å; I23-I26 WeakPolarHBondContact O-CB 3.47Å; I23-I26 PolarHBondContact O-N 3.39Å; I23-V27 HydrophobicContact CG2-CG2 3.93Å; I23-V27 WeakPolarHBondContact O-CG2 3.45Å; I23-V27 PolarHBondContact O-N 3.21Å; I23-Q157 HydrophobicContact CG1-CB 4.38Å; I23-F158 HydrophobicContact CD1-CE1 3.57Å; I23-F158 HydrophobicContact CD1-CE2 3.92Å; I23-F158 HydrophobicContact CD1-CZ 3.18Å; I23-F158 HydrophobicContact CG1-CE2 4.27Å; I23-F158 HydrophobicContact CG1-CZ 3.98Å; I23-F169 HydrophobicContact CG2-CD2 3.45Å; I23-F169 VanDerWaalsContact CG2-CD2 3.45Å; I23-F169 HydrophobicContact CG2-CE2 3.83Å
24	F	87.8	Confident	80.7	Confident	132 Å²	132	44.9 Å²	44.9	58%	0.579	23%	0.232	S	C	*	.	H	α-helix	trans	-58	-42.3	-179	-176.3	-99.8	0	0	0	111.5	L21 S22 I26 V27 V28	L21-F24 PolarHBondContact O-N 2.83Å; S22-F24 VanDerWaalsContact C-N 3.33Å; S22-F24 PolarHBondContact O-N 2.85Å; F24-I26 VanDerWaalsContact C-N 3.3Å; F24-I26 PolarHBondContact O-N 3.13Å; F24-V27 PolarHBondContact O-N 3.38Å; F24-V28 HydrophobicContact CD1-CG2 4.16Å; F24-V28 HydrophobicContact CD2-CG2 4.48Å; F24-V28 HydrophobicContact CE1-CG2 3.75Å; F24-V28 HydrophobicContact CE2-CG2 4.1Å; F24-V28 HydrophobicContact CZ-CG2 3.71Å; F24-V28 WeakPolarHBondContact O-CG2 3.23Å; F24-V28 PolarHBondContact O-N 2.9Å
25	F	91.9	Very high	82.6	Confident	37 Å²	37	41 Å²	41	16%	0.162	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-36	175.7	-62.1	-82.1	0	0	0	112.8	L21 S22 I23 N29 I222 V225 M229 Y230	L21-F25 HydrophobicContact CG-CE2 4.21Å; L21-F25 WeakPolarHBondContact O-CD2 3.49Å; S22-F25 PolarHBondContact O-N 2.84Å; I23-F25 VanDerWaalsContact C-N 3.27Å; I23-F25 PolarHBondContact O-N 2.98Å; F25-N29 VanDerWaalsContact O-CB 3.23Å; F25-N29 WeakPolarHBondContact O-CB 3.47Å; F25-N29 PolarHBondContact O-N 3.16Å; F25-N29 VanDerWaalsContact O-N 3.08Å; F25-I222 HydrophobicContact CB-CG2 4.25Å; F25-I222 HydrophobicContact CD1-CG2 3.73Å; F25-I222 VanDerWaalsContact CD1-O 3.29Å; F25-I222 WeakPolarHBondContact CD1-O 3.19Å; F25-I222 HydrophobicContact CG-CG2 4.47Å; F25-V225 HydrophobicContact CE1-CG1 4.02Å; F25-M229 HydrophobicContact CE2-SD 3.93Å; F25-Y230 WeakPolarHBondContact CB-OH 3.38Å
26	I	91.1	Very high	84.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-72.1	-42.9	179.1	-58.7	177.1	0	0	0	110.4	I23 F24 N29 E30 V150 F153 Q157 F223 Y230	I23-I26 WeakPolarHBondContact O-CB 3.47Å; I23-I26 PolarHBondContact O-N 3.39Å; F24-I26 VanDerWaalsContact C-N 3.3Å; F24-I26 PolarHBondContact O-N 3.13Å; I26-N29 PolarHBondContact O-N 3.47Å; I26-E30 PolarHBondContact O-N 2.97Å; I26-V150 HydrophobicContact CG2-CG1 4.19Å; I26-F153 HydrophobicContact CD1-CD1 3.94Å; I26-F153 HydrophobicContact CD1-CE1 4.12Å; I26-Q157 HydrophobicContact CD1-CG 3.71Å; I26-F223 HydrophobicContact CG1-CE2 4.27Å; I26-Y230 HydrophobicContact CD1-CD1 4.3Å; I26-Y230 HydrophobicContact CD1-CE1 3.97Å; I26-Y230 HydrophobicContact CG1-CE1 3.78Å
27	V	91.1	Very high	86.2	Confident	18 Å²	18	32.8 Å²	32.8	11%	0.109	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-45	179.7	174	0	0	0	0	111.2	I23 F24 N29 E30 F31 F169 I172 S176	I23-V27 HydrophobicContact CG2-CG2 3.93Å; I23-V27 WeakPolarHBondContact O-CG2 3.45Å; I23-V27 PolarHBondContact O-N 3.21Å; F24-V27 PolarHBondContact O-N 3.38Å; V27-N29 VanDerWaalsContact C-N 3.35Å; V27-E30 PolarHBondContact O-N 3.06Å; V27-F31 PolarHBondContact O-N 3.07Å; V27-F169 HydrophobicContact CG2-CD2 4.29Å; V27-F169 HydrophobicContact CG2-CE2 3.99Å; V27-I172 HydrophobicContact CG1-CG2 3.91Å; V27-I172 HydrophobicContact CG2-CG2 4.21Å; V27-S176 VanDerWaalsContact CG1-OG 3.25Å; V27-S176 WeakPolarHBondContact CG1-OG 3.37Å
28	V	92.3	Very high	87.9	Confident	34 Å²	34	26.1 Å²	26.1	21%	0.206	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-40.5	176.5	174.6	0	0	0	0	111.2	F24 E30 F31 C32 I222	F24-V28 HydrophobicContact CD1-CG2 4.16Å; F24-V28 HydrophobicContact CD2-CG2 4.48Å; F24-V28 HydrophobicContact CE1-CG2 3.75Å; F24-V28 HydrophobicContact CE2-CG2 4.1Å; F24-V28 HydrophobicContact CZ-CG2 3.71Å; F24-V28 WeakPolarHBondContact O-CG2 3.23Å; F24-V28 PolarHBondContact O-N 2.9Å; V28-E30 VanDerWaalsContact C-N 3.34Å; V28-E30 PolarHBondContact O-N 3.33Å; V28-F31 PolarHBondContact O-N 2.94Å; V28-C32 PolarHBondContact O-N 3.07Å; V28-C32 PolarHBondContact O-SG 3.14Å; V28-I222 HydrophobicContact CB-CG2 4.38Å; V28-I222 HydrophobicContact CG1-CD1 3.71Å; V28-I222 HydrophobicContact CG1-CG2 4.26Å
29	N	93.1	Very high	89.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.5	-44.9	173.4	175.1	87.6	0	0	0	111.6	F25 I26 V27 C32 E33 A219 F223	F25-N29 VanDerWaalsContact O-CB 3.23Å; F25-N29 WeakPolarHBondContact O-CB 3.47Å; F25-N29 PolarHBondContact O-N 3.16Å; F25-N29 VanDerWaalsContact O-N 3.08Å; I26-N29 PolarHBondContact O-N 3.47Å; V27-N29 VanDerWaalsContact C-N 3.35Å; N29-C32 PolarHBondContact O-N 2.84Å; N29-E33 WeakPolarHBondContact O-CB 3.37Å; N29-E33 PolarHBondContact O-N 3.11Å; N29-A219 PolarHBondContact OD1-O 3.42Å; N29-F223 HydrophobicContact CB-CB 4.33Å; N29-F223 HydrophobicContact CB-CD2 4.26Å
30	E	91.7	Very high	90.7	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.019	10%	0.101	C	C	.	.	H	α-helix	trans	-62.8	-45	177.3	-173.3	67.5	-164.1	0	0	111.7	I26 V27 V28 C32 E33 R34 V150 F173 I177	I26-E30 PolarHBondContact O-N 2.97Å; V27-E30 PolarHBondContact O-N 3.06Å; V28-E30 VanDerWaalsContact C-N 3.34Å; V28-E30 PolarHBondContact O-N 3.33Å; E30-C32 PolarHBondContact O-N 2.94Å; E30-E33 PolarHBondContact O-N 2.79Å; E30-R34 HydrophobicContact CG-CG 4.22Å; E30-R34 WeakPolarHBondContact O-CB 3.4Å; E30-R34 WeakPolarHBondContact O-CG 3.44Å; E30-R34 PolarHBondContact O-N 3.3Å; E30-R34 IonicContact OE1-CZ 3.05Å; E30-R34 VanDerWaalsContact OE1-CZ 3.22Å; E30-R34 IonicContact OE1-NE 2.64Å; E30-R34 PolarHBondContact OE1-NE 3.49Å; E30-R34 IonicContact OE1-NH2 3.37Å; E30-R34 PolarHBondContact OE1-NH2 3.25Å; E30-R34 IonicContact OE2-NH2 3.98Å; E30-V150 WeakPolarHBondContact OE2-CG1 3.44Å; E30-F173 HydrophobicContact CB-CD2 4.16Å; E30-F173 HydrophobicContact CB-CE2 3.64Å; E30-F173 HydrophobicContact CB-CZ 4.19Å; E30-F173 HydrophobicContact CG-CD2 3.97Å; E30-F173 HydrophobicContact CG-CE1 4.08Å; E30-F173 HydrophobicContact CG-CE2 3.39Å; E30-F173 HydrophobicContact CG-CZ 3.46Å; E30-F173 VanDerWaalsContact CG-CZ 3.46Å; E30-F173 VanDerWaalsContact OE2-CZ 3.26Å; E30-F173 WeakPolarHBondContact OE2-CZ 3.46Å; E30-I177 HydrophobicContact CG-CG1 4.07Å
31	F	95.1	Very high	91.7	Very high	57 Å²	57	22 Å²	22	25%	0.25	10%	0.102	C	C	.	.	H	α-helix	trans	-57.3	-49.5	176.9	172.5	-94.2	0	0	0	111.8	V27 V28 R34 F35 A179 L183	V27-F31 PolarHBondContact O-N 3.07Å; V28-F31 PolarHBondContact O-N 2.94Å; F31-R34 PolarHBondContact O-N 2.85Å; F31-F35 WeakPolarHBondContact O-CB 3.33Å; F31-F35 PolarHBondContact O-N 3.49Å; F31-A179 HydrophobicContact CD2-CB 4.39Å; F31-A179 HydrophobicContact CE2-CB 4.14Å; F31-L183 HydrophobicContact CE2-CD1 3.99Å; F31-L183 HydrophobicContact CZ-CD1 3.79Å
32	C	95.2	Very high	92.5	Very high	8 Å²	8	19.8 Å²	19.8	5%	0.054	9%	0.091	C	C	.	.	H	α-helix	trans	-66.9	-38.8	-178.5	-63.4	0	0	0	0	112	V28 N29 E30 S36 A219	V28-C32 PolarHBondContact O-N 3.07Å; V28-C32 PolarHBondContact O-SG 3.14Å; N29-C32 PolarHBondContact O-N 2.84Å; E30-C32 PolarHBondContact O-N 2.94Å; C32-S36 WeakPolarHBondContact O-CB 3.32Å; C32-S36 PolarHBondContact O-N 3.26Å; C32-A219 HydrophobicContact CB-CB 3.58Å
33	E	93.6	Very high	93.2	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-64.8	-44.2	175.8	-170.6	-84.6	162.3	0	0	111.4	N29 E30 S36 Y37 Y98 T143 I146 M216	N29-E33 WeakPolarHBondContact O-CB 3.37Å; N29-E33 PolarHBondContact O-N 3.11Å; E30-E33 PolarHBondContact O-N 2.79Å; E33-S36 PolarHBondContact O-N 3.34Å; E33-Y37 WeakPolarHBondContact O-CB 3.36Å; E33-Y37 PolarHBondContact O-N 2.83Å; E33-Y98 HydrophobicContact CG-CE1 3.92Å; E33-T143 PolarHBondContact OE1-OG1 2.85Å; E33-I146 HydrophobicContact CG-CD1 3.7Å; E33-M216 HydrophobicContact CB-SD 4.32Å; E33-M216 HydrophobicContact CG-SD 4.12Å
34	R	93.9	Very high	93.8	Very high	19 Å²	19	19 Å²	19	7%	0.072	9%	0.086	C	C	.	.	H	α-helix	trans	-65.1	-42.2	177.9	-67.9	-74.9	161.9	-112.3	-28.4	111.4	E30 F31 S36 Y37 Y38 I177	E30-R34 HydrophobicContact CG-CG 4.22Å; E30-R34 WeakPolarHBondContact O-CB 3.4Å; E30-R34 WeakPolarHBondContact O-CG 3.44Å; E30-R34 PolarHBondContact O-N 3.3Å; E30-R34 IonicContact OE1-CZ 3.05Å; E30-R34 VanDerWaalsContact OE1-CZ 3.22Å; E30-R34 IonicContact OE1-NE 2.64Å; E30-R34 PolarHBondContact OE1-NE 3.49Å; E30-R34 IonicContact OE1-NH2 3.37Å; E30-R34 PolarHBondContact OE1-NH2 3.25Å; E30-R34 IonicContact OE2-NH2 3.98Å; F31-R34 PolarHBondContact O-N 2.85Å; R34-S36 VanDerWaalsContact C-N 3.33Å; R34-S36 PolarHBondContact O-N 3.5Å; R34-Y37 PolarHBondContact O-N 2.82Å; R34-Y38 HydrophobicContact CB-CD2 4.41Å; R34-Y38 VanDerWaalsContact O-CD2 3.27Å; R34-Y38 WeakPolarHBondContact O-CD2 3.4Å; R34-Y38 PolarHBondContact O-N 3.05Å; R34-I177 HydrophobicContact CG-CB 4.35Å; R34-I177 HydrophobicContact CG-CG1 3.93Å; R34-I177 HydrophobicContact CG-CG2 4.48Å
35	F	95.9	Very high	94.2	Very high	10 Å²	10	12.7 Å²	12.7	4%	0.044	6%	0.058	C	C	.	.	H	α-helix	trans	-57.4	-48.5	172.6	-175.6	-74.8	0	0	0	111.1	F31 Y37 G39 L183 S184 I187 V211 L215	F31-F35 WeakPolarHBondContact O-CB 3.33Å; F31-F35 PolarHBondContact O-N 3.49Å; F35-Y37 PolarHBondContact O-N 2.85Å; F35-G39 PolarHBondContact O-N 3.36Å; F35-L183 HydrophobicContact CD2-CB 4.15Å; F35-L183 HydrophobicContact CE2-CB 4.07Å; F35-S184 WeakPolarHBondContact O-CB 3.48Å; F35-I187 HydrophobicContact CE2-CD1 4.18Å; F35-I187 HydrophobicContact CZ-CB 4.24Å; F35-I187 HydrophobicContact CZ-CG2 4.27Å; F35-V211 HydrophobicContact CE1-CG1 4.33Å; F35-L215 HydrophobicContact CD1-CD1 3.28Å; F35-L215 HydrophobicContact CE1-CD1 3.43Å; F35-L215 VanDerWaalsContact CE1-CD1 3.43Å; F35-L215 HydrophobicContact CG-CD1 3.9Å; F35-L215 HydrophobicContact CZ-CD1 4.14Å
36	S	95.1	Very high	94.4	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-61.4	-45.3	-179.3	158.5	0	0	0	0	112.4	C32 E33 R34 M40 Y98 Q102	C32-S36 WeakPolarHBondContact O-CB 3.32Å; C32-S36 PolarHBondContact O-N 3.26Å; E33-S36 PolarHBondContact O-N 3.34Å; R34-S36 VanDerWaalsContact C-N 3.33Å; R34-S36 PolarHBondContact O-N 3.5Å; S36-M40 VanDerWaalsContact O-CB 3.31Å; S36-M40 WeakPolarHBondContact O-CB 3.34Å; S36-M40 PolarHBondContact O-N 3.33Å; S36-Y98 PolarHBondContact OG-OH 3.31Å; S36-Q102 PolarHBondContact OG-NE2 3.41Å
37	Y	94.8	Very high	94.6	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.4	-54.1	-178.9	177.4	-100.3	0	0	0	112.4	E33 R34 F35 R41 C70 Y98 T143	E33-Y37 WeakPolarHBondContact O-CB 3.36Å; E33-Y37 PolarHBondContact O-N 2.83Å; R34-Y37 PolarHBondContact O-N 2.82Å; F35-Y37 PolarHBondContact O-N 2.85Å; Y37-R41 WeakPolarHBondContact O-CB 3.25Å; Y37-R41 PolarHBondContact O-N 2.83Å; Y37-C70 HydrophobicContact CE2-CB 4.42Å; Y37-Y98 WeakPolarHBondContact CA-OH 3.22Å; Y37-Y98 PolarHBondContact N-OH 3.32Å; Y37-T143 HydrophobicContact CD2-CG2 3.99Å; Y37-T143 HydrophobicContact CE2-CG2 3.97Å
38	Y	95	Very high	94.8	Very high	60 Å²	60	10.1 Å²	10.1	24%	0.235	5%	0.046	C	C	.	.	H	α-helix	trans	-71	-36.7	-176.1	-75.1	-71.9	0	0	0	112.2	R34 R41 A42 S184	R34-Y38 HydrophobicContact CB-CD2 4.41Å; R34-Y38 VanDerWaalsContact O-CD2 3.27Å; R34-Y38 WeakPolarHBondContact O-CD2 3.4Å; R34-Y38 PolarHBondContact O-N 3.05Å; Y38-R41 PolarHBondContact O-N 3.47Å; Y38-A42 WeakPolarHBondContact O-CB 3.36Å; Y38-A42 PolarHBondContact O-N 3.4Å; Y38-S184 WeakPolarHBondContact CB-OG 3.47Å
39	G	94.6	Very high	94.9	Very high	0 Å²	0	10 Å²	10	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-63.5	-50.1	177.6	0	0	0	0	0	112.6	F35 A42 S184 T188	F35-G39 PolarHBondContact O-N 3.36Å; G39-A42 PolarHBondContact O-N 2.83Å; G39-S184 PolarHBondContact N-OG 3.49Å; G39-T188 VanDerWaalsContact CA-OG1 3.3Å; G39-T188 WeakPolarHBondContact CA-OG1 3.42Å; G39-T188 WeakPolarHBondContact O-CG2 3.27Å
40	M	94.6	Very high	94.7	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.9	-45.2	176.4	178.9	-80.8	-64.4	0	0	111.2	S36 A42 V43 L44 F66 L136 I139 F209	S36-M40 VanDerWaalsContact O-CB 3.31Å; S36-M40 WeakPolarHBondContact O-CB 3.34Å; S36-M40 PolarHBondContact O-N 3.33Å; M40-A42 VanDerWaalsContact C-N 3.3Å; M40-A42 PolarHBondContact O-N 3.46Å; M40-V43 WeakPolarHBondContact O-CG2 3.47Å; M40-V43 PolarHBondContact O-N 3.43Å; M40-L44 WeakPolarHBondContact O-CB 2.99Å; M40-L44 PolarHBondContact O-N 3.07Å; M40-L44 HydrophobicContact SD-CB 4.47Å; M40-L44 HydrophobicContact SD-CD1 4.12Å; M40-L44 HydrophobicContact SD-CD2 4.05Å; M40-L44 HydrophobicContact SD-CG 4.45Å; M40-F66 HydrophobicContact CE-CE1 3.94Å; M40-F66 HydrophobicContact CE-CE2 4.47Å; M40-F66 HydrophobicContact CE-CZ 3.58Å; M40-L136 HydrophobicContact SD-CD2 4.43Å; M40-I139 HydrophobicContact CE-CD1 4.2Å; M40-I139 HydrophobicContact CE-CG2 3.9Å; M40-F209 HydrophobicContact CB-CD1 4.31Å; M40-F209 HydrophobicContact CG-CD1 3.65Å; M40-F209 HydrophobicContact CG-CE1 3.75Å
41	R	95.1	Very high	94.7	Very high	18 Å²	18	10.9 Å²	10.9	7%	0.068	5%	0.046	C	C	.	.	H	α-helix	trans	-60	-38.4	179.7	-176.9	-178.8	176.2	-165.2	0.8	112.3	Y37 Y38 V43 L44 Y63 D305	Y37-R41 WeakPolarHBondContact O-CB 3.25Å; Y37-R41 PolarHBondContact O-N 2.83Å; Y38-R41 PolarHBondContact O-N 3.47Å; R41-V43 VanDerWaalsContact C-N 3.35Å; R41-V43 PolarHBondContact O-N 3.34Å; R41-L44 WeakPolarHBondContact O-CB 3.14Å; R41-L44 PolarHBondContact O-N 3.34Å; R41-Y63 HydrophobicContact CG-CE2 3.78Å; R41-Y63 PolarHBondContact NE-OH 2.8Å; R41-Y63 PolarHBondContact NH2-OH 2.99Å; R41-D305 IonicContact CZ-OD1 2.68Å; R41-D305 IonicContact NH1-OD1 2.86Å; R41-D305 IonicContact NH2-OD1 3.84Å; R41-D305 PolarHBondContact NH2-OD1 2.97Å
42	A	95.1	Very high	94.6	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-62	-39.6	-176.5	0	0	0	0	0	113.2	Y38 G39 M40 T185 Q333	Y38-A42 WeakPolarHBondContact O-CB 3.36Å; Y38-A42 PolarHBondContact O-N 3.4Å; G39-A42 PolarHBondContact O-N 2.83Å; M40-A42 VanDerWaalsContact C-N 3.3Å; M40-A42 PolarHBondContact O-N 3.46Å; A42-T185 HydrophobicContact CB-CG2 4.41Å; A42-Q333 PolarHBondContact O-NE2 3.48Å; A42-Q333 VanDerWaalsContact O-NE2 3.09Å
43	V	96.1	Very high	94.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-90.1	-8.6	-177.1	-55.3	0	0	0	0	113.4	M40 R41 V45 L46 Y47 T188 P189 R192 A208 F209 D330	M40-V43 WeakPolarHBondContact O-CG2 3.47Å; M40-V43 PolarHBondContact O-N 3.43Å; R41-V43 VanDerWaalsContact C-N 3.35Å; R41-V43 PolarHBondContact O-N 3.34Å; V43-V45 PolarHBondContact O-N 3.18Å; V43-L46 PolarHBondContact O-N 3.19Å; V43-Y47 PolarHBondContact O-N 3.38Å; V43-T188 HydrophobicContact CG1-CG2 3.95Å; V43-T188 HydrophobicContact CG2-CG2 4.41Å; V43-P189 HydrophobicContact CG1-CG 4.15Å; V43-R192 HydrophobicContact CG1-CB 4.35Å; V43-A208 HydrophobicContact CG2-CB 4.42Å; V43-F209 HydrophobicContact CG2-CD1 4.14Å; V43-F209 HydrophobicContact CG2-CE1 3.46Å; V43-F209 VanDerWaalsContact CG2-CE1 3.46Å; V43-F209 HydrophobicContact CG2-CZ 4.02Å; V43-D330 WeakPolarHBondContact CG1-OD2 3.27Å
44	L	96.4	Very high	94.4	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.9	-39.9	-165.2	-172.2	62.7	0	0	0	113.5	M40 R41 L46 Y47 F48 Y63 F66 L136 F209	M40-L44 WeakPolarHBondContact O-CB 2.99Å; M40-L44 PolarHBondContact O-N 3.07Å; M40-L44 HydrophobicContact SD-CB 4.47Å; M40-L44 HydrophobicContact SD-CD1 4.12Å; M40-L44 HydrophobicContact SD-CD2 4.05Å; M40-L44 HydrophobicContact SD-CG 4.45Å; R41-L44 WeakPolarHBondContact O-CB 3.14Å; R41-L44 PolarHBondContact O-N 3.34Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 PolarHBondContact O-N 2.75Å; L44-Y47 HydrophobicContact CD1-CD1 4.4Å; L44-Y47 WeakPolarHBondContact O-CB 3.1Å; L44-Y47 PolarHBondContact O-N 3.43Å; L44-F48 HydrophobicContact CD1-CE1 3.69Å; L44-F48 HydrophobicContact CD1-CE2 4.25Å; L44-F48 HydrophobicContact CD1-CZ 3.52Å; L44-F48 HydrophobicContact CD2-CE2 4.1Å; L44-F48 HydrophobicContact CD2-CZ 3.84Å; L44-F48 HydrophobicContact CG-CD2 4.47Å; L44-F48 HydrophobicContact CG-CE1 4.07Å; L44-F48 HydrophobicContact CG-CE2 3.69Å; L44-F48 HydrophobicContact CG-CZ 3.44Å; L44-F48 VanDerWaalsContact CG-CZ 3.44Å; L44-F48 WeakPolarHBondContact O-CD2 3.35Å; L44-F48 WeakPolarHBondContact O-CG 3.21Å; L44-F48 PolarHBondContact O-N 2.84Å; L44-F48 VanDerWaalsContact O-N 3.1Å; L44-Y63 HydrophobicContact CB-CD2 4.36Å; L44-Y63 HydrophobicContact CD2-CD2 4.19Å; L44-F66 HydrophobicContact CD2-CD1 3.87Å; L44-F66 HydrophobicContact CD2-CE1 4.25Å; L44-F66 HydrophobicContact CD2-CG 4.42Å; L44-L136 HydrophobicContact CD1-CD2 4.01Å; L44-L136 HydrophobicContact CD2-CD2 3.85Å; L44-F209 HydrophobicContact CD1-CE1 4.49Å; L44-F209 HydrophobicContact CD1-CZ 4.29Å
45	V	96.4	Very high	94.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.5	-37	179.2	72.3	0	0	0	0	111.8	V43 F48 K49 G308 T312 L313	V43-V45 PolarHBondContact O-N 3.18Å; V45-F48 PolarHBondContact O-N 3.29Å; V45-K49 PolarHBondContact O-N 2.96Å; V45-K49 VanDerWaalsContact O-N 3.09Å; V45-G308 WeakPolarHBondContact CG1-O 3.18Å; V45-T312 HydrophobicContact CG1-CG2 3.7Å; V45-L313 HydrophobicContact CG2-CD1 4.18Å; V45-L313 HydrophobicContact CG2-CD2 4.23Å; V45-L313 HydrophobicContact CG2-CG 4.14Å
46	L	95.3	Very high	94	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-72.2	-33.2	176.7	-62.3	-171.9	0	0	0	111.6	V43 L44 K49 Y50 Y205 T312 T316 D330	V43-L46 PolarHBondContact O-N 3.19Å; L44-L46 VanDerWaalsContact C-N 3.33Å; L44-L46 PolarHBondContact O-N 2.75Å; L46-K49 PolarHBondContact O-N 2.95Å; L46-Y50 HydrophobicContact CB-CD2 4.1Å; L46-Y50 HydrophobicContact CB-CE2 4.37Å; L46-Y50 HydrophobicContact CD2-CD2 4.39Å; L46-Y50 HydrophobicContact CD2-CE2 3.85Å; L46-Y50 HydrophobicContact CG-CE2 4.49Å; L46-Y50 WeakPolarHBondContact O-CB 3.4Å; L46-Y50 PolarHBondContact O-N 3.09Å; L46-Y205 PolarHBondContact O-OH 3.18Å; L46-T312 HydrophobicContact CD1-CG2 4.37Å; L46-T312 HydrophobicContact CD2-CG2 4.05Å; L46-T312 HydrophobicContact CG-CG2 4.07Å; L46-T316 HydrophobicContact CD2-CG2 3.82Å; L46-D330 HydrophobicContact CD1-CB 3.85Å
47	Y	95.6	Very high	93.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.116	C	C	.	.	I	π-helix	trans	-60	-45.1	170.8	171.9	-102.3	0	0	0	111.5	V43 L44 K49 F51 L52 M105 S108 A109 S132 Y205 F209	V43-Y47 PolarHBondContact O-N 3.38Å; L44-Y47 HydrophobicContact CD1-CD1 4.4Å; L44-Y47 WeakPolarHBondContact O-CB 3.1Å; L44-Y47 PolarHBondContact O-N 3.43Å; Y47-K49 PolarHBondContact O-N 3.44Å; Y47-F51 HydrophobicContact CD2-CB 3.55Å; Y47-F51 HydrophobicContact CD2-CD1 4.06Å; Y47-F51 HydrophobicContact CD2-CD2 4.32Å; Y47-F51 AromaticContact CD2-CG 3.75Å; Y47-F51 HydrophobicContact CD2-CG 3.75Å; Y47-F51 HydrophobicContact CE2-CB 3.67Å; Y47-F51 AromaticContact CE2-CD1 3.25Å; Y47-F51 HydrophobicContact CE2-CD1 3.25Å; Y47-F51 AromaticContact CE2-CD2 3.88Å; Y47-F51 HydrophobicContact CE2-CD2 3.88Å; Y47-F51 AromaticContact CE2-CE1 3.82Å; Y47-F51 HydrophobicContact CE2-CE1 3.82Å; Y47-F51 HydrophobicContact CE2-CE2 4.3Å; Y47-F51 AromaticContact CE2-CG 3.33Å; Y47-F51 HydrophobicContact CE2-CG 3.33Å; Y47-F51 HydrophobicContact CE2-CZ 4.32Å; Y47-F51 HydrophobicContact CG-CB 4.37Å; Y47-F51 AromaticContact CZ-CD1 3.6Å; Y47-F51 WeakPolarHBondContact O-CA 3.4Å; Y47-F51 VanDerWaalsContact O-CB 3.23Å; Y47-F51 WeakPolarHBondContact O-CB 3.31Å; Y47-F51 PolarHBondContact O-N 3.06Å; Y47-F51 WeakPolarHBondContact OH-CE1 3.37Å; Y47-L52 HydrophobicContact CD1-CD1 4.42Å; Y47-L52 HydrophobicContact CD1-CG 4.47Å; Y47-L52 HydrophobicContact CE1-CD1 3.75Å; Y47-L52 HydrophobicContact CE1-CD2 4.31Å; Y47-L52 HydrophobicContact CE1-CG 3.81Å; Y47-L52 PolarHBondContact O-N 2.9Å; Y47-L52 VanDerWaalsContact O-N 3.09Å; Y47-M105 HydrophobicContact CD1-CE 3.77Å; Y47-M105 HydrophobicContact CE1-CE 3.25Å; Y47-M105 HydrophobicContact CE2-CE 4.29Å; Y47-M105 HydrophobicContact CG-CE 4.5Å; Y47-S108 PolarHBondContact OH-O 3.36Å; Y47-A109 HydrophobicContact CE2-CB 3.93Å; Y47-S132 PolarHBondContact OH-OG 2.92Å; Y47-Y205 VanDerWaalsContact CA-CE1 3.45Å; Y47-Y205 AromaticContact CD2-CD1 3.68Å; Y47-Y205 HydrophobicContact CD2-CD1 3.68Å; Y47-Y205 HydrophobicContact CD2-CD2 4.44Å; Y47-Y205 HydrophobicContact CD2-CE1 4.18Å; Y47-Y205 AromaticContact CD2-CG 3.83Å; Y47-Y205 HydrophobicContact CD2-CG 3.83Å; Y47-Y205 HydrophobicContact CG-CD1 4.18Å; Y47-Y205 HydrophobicContact CG-CE1 4.39Å; Y47-F209 HydrophobicContact CD1-CE2 4.19Å; Y47-F209 HydrophobicContact CD1-CZ 4.17Å; Y47-F209 AromaticContact CD2-CE2 3.6Å; Y47-F209 HydrophobicContact CD2-CE2 3.6Å; Y47-F209 HydrophobicContact CD2-CZ 4.11Å; Y47-F209 AromaticContact CE2-CE2 3.96Å; Y47-F209 HydrophobicContact CE2-CE2 3.96Å; Y47-F209 AromaticContact CG-CE2 3.71Å; Y47-F209 HydrophobicContact CG-CE2 3.71Å; Y47-F209 AromaticContact CG-CZ 3.75Å; Y47-F209 HydrophobicContact CG-CZ 3.75Å
48	F	96	Very high	93.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.134	C	C	.	.	I	π-helix	trans	-61.8	-44.5	176.1	-61.3	-26	0	0	0	112.3	L44 V45 L52 K53 W54 S59 I62 M133 L136	L44-F48 HydrophobicContact CD1-CE1 3.69Å; L44-F48 HydrophobicContact CD1-CE2 4.25Å; L44-F48 HydrophobicContact CD1-CZ 3.52Å; L44-F48 HydrophobicContact CD2-CE2 4.1Å; L44-F48 HydrophobicContact CD2-CZ 3.84Å; L44-F48 HydrophobicContact CG-CD2 4.47Å; L44-F48 HydrophobicContact CG-CE1 4.07Å; L44-F48 HydrophobicContact CG-CE2 3.69Å; L44-F48 HydrophobicContact CG-CZ 3.44Å; L44-F48 VanDerWaalsContact CG-CZ 3.44Å; L44-F48 WeakPolarHBondContact O-CD2 3.35Å; L44-F48 WeakPolarHBondContact O-CG 3.21Å; L44-F48 PolarHBondContact O-N 2.84Å; L44-F48 VanDerWaalsContact O-N 3.1Å; V45-F48 PolarHBondContact O-N 3.29Å; F48-L52 HydrophobicContact CD1-CD1 3.85Å; F48-L52 HydrophobicContact CE1-CD1 4.43Å; F48-L52 CarbonylContact O-C 3.6Å; F48-L52 WeakPolarHBondContact O-CB 3.5Å; F48-K53 PolarHBondContact O-N 3.42Å; F48-W54 HydrophobicContact CB-CE3 3.81Å; F48-W54 HydrophobicContact CB-CZ3 4.39Å; F48-W54 HydrophobicContact CD1-CE3 4.15Å; F48-W54 AromaticContact CD1-CZ3 3.87Å; F48-W54 HydrophobicContact CD1-CZ3 3.87Å; F48-W54 HydrophobicContact CE1-CZ3 4.3Å; F48-W54 AromaticContact CG-CE3 3.97Å; F48-W54 HydrophobicContact CG-CE3 3.97Å; F48-W54 HydrophobicContact CG-CZ3 4.05Å; F48-W54 PolarHBondContact O-N 3.22Å; F48-W54 VanDerWaalsContact O-N 3.08Å; F48-S59 WeakPolarHBondContact CB-OG 3.46Å; F48-S59 WeakPolarHBondContact CD2-O 3.1Å; F48-I62 HydrophobicContact CD2-CB 4.46Å; F48-I62 HydrophobicContact CE1-CG2 4.4Å; F48-I62 HydrophobicContact CE2-CB 4.08Å; F48-I62 HydrophobicContact CE2-CG2 3.78Å; F48-I62 HydrophobicContact CZ-CB 4.49Å; F48-I62 HydrophobicContact CZ-CG2 3.71Å; F48-M133 HydrophobicContact CE1-CE 4.45Å; F48-L136 HydrophobicContact CE1-CD1 3.96Å; F48-L136 HydrophobicContact CZ-CD1 3.64Å
49	K	93.2	Very high	93.5	Very high	31 Å²	31	26.3 Å²	26.3	14%	0.135	12%	0.123	C	C	.	.	I	π-helix	trans	-66.6	-57.6	179.8	-176.4	173.5	-176.2	149.7	0	112.9	V45 L46 Y47 K53 W54 D56 L313	V45-K49 PolarHBondContact O-N 2.96Å; V45-K49 VanDerWaalsContact O-N 3.09Å; L46-K49 PolarHBondContact O-N 2.95Å; Y47-K49 PolarHBondContact O-N 3.44Å; K49-K53 VanDerWaalsContact O-CA 3.22Å; K49-K53 WeakPolarHBondContact O-CA 3.42Å; K49-K53 PolarHBondContact O-N 3.11Å; K49-W54 WeakPolarHBondContact CA-O 3.25Å; K49-D56 VanDerWaalsContact CD-OD1 3.28Å; K49-D56 WeakPolarHBondContact CD-OD1 3.31Å; K49-D56 WeakPolarHBondContact CE-OD1 3.16Å; K49-D56 IonicContact NZ-OD1 2.91Å; K49-D56 PolarHBondContact NZ-OD1 3.32Å; K49-D56 IonicContact NZ-OD2 3.59Å; K49-D56 PolarHBondContact NZ-OD2 3.5Å; K49-L313 HydrophobicContact CD-CD2 3.75Å
50	Y	90.9	Very high	93.5	Very high	17 Å²	17	26.3 Å²	26.3	7%	0.067	12%	0.123	C	C	.	.	I	π-helix	trans	-91.1	-32.6	-167.3	-61.7	-49.2	0	0	0	113.9	L46 K53 E485 E486	L46-Y50 HydrophobicContact CB-CD2 4.1Å; L46-Y50 HydrophobicContact CB-CE2 4.37Å; L46-Y50 HydrophobicContact CD2-CD2 4.39Å; L46-Y50 HydrophobicContact CD2-CE2 3.85Å; L46-Y50 HydrophobicContact CG-CE2 4.49Å; L46-Y50 WeakPolarHBondContact O-CB 3.4Å; L46-Y50 PolarHBondContact O-N 3.09Å; Y50-K53 VanDerWaalsContact O-CD 3.32Å; Y50-K53 WeakPolarHBondContact O-CD 3.44Å; Y50-K53 WeakPolarHBondContact O-CE 3.45Å; Y50-K53 PolarHBondContact O-NZ 3.38Å; Y50-E485 HydrophobicContact CD1-CB 4.29Å; Y50-E485 HydrophobicContact CD1-CG 4.5Å; Y50-E485 WeakPolarHBondContact CD1-OE2 3Å; Y50-E485 HydrophobicContact CE1-CB 3.78Å; Y50-E485 HydrophobicContact CE1-CG 4.04Å; Y50-E486 HydrophobicContact CD1-CG 4.05Å; Y50-E486 HydrophobicContact CD2-CG 3.86Å; Y50-E486 HydrophobicContact CE1-CG 3.86Å; Y50-E486 HydrophobicContact CE2-CG 3.61Å; Y50-E486 HydrophobicContact CG-CG 4.06Å
51	F	91.1	Very high	93.4	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.031	13%	0.129	C	C	.	.	I	π-helix	trans	-90.3	-53.2	179.4	-176.8	-75.6	0	0	0	111.6	Y47 K53 S108 A109 H111 P122 M125 H128 Y205	Y47-F51 HydrophobicContact CD2-CB 3.55Å; Y47-F51 HydrophobicContact CD2-CD1 4.06Å; Y47-F51 HydrophobicContact CD2-CD2 4.32Å; Y47-F51 AromaticContact CD2-CG 3.75Å; Y47-F51 HydrophobicContact CD2-CG 3.75Å; Y47-F51 HydrophobicContact CE2-CB 3.67Å; Y47-F51 AromaticContact CE2-CD1 3.25Å; Y47-F51 HydrophobicContact CE2-CD1 3.25Å; Y47-F51 AromaticContact CE2-CD2 3.88Å; Y47-F51 HydrophobicContact CE2-CD2 3.88Å; Y47-F51 AromaticContact CE2-CE1 3.82Å; Y47-F51 HydrophobicContact CE2-CE1 3.82Å; Y47-F51 HydrophobicContact CE2-CE2 4.3Å; Y47-F51 AromaticContact CE2-CG 3.33Å; Y47-F51 HydrophobicContact CE2-CG 3.33Å; Y47-F51 HydrophobicContact CE2-CZ 4.32Å; Y47-F51 HydrophobicContact CG-CB 4.37Å; Y47-F51 AromaticContact CZ-CD1 3.6Å; Y47-F51 WeakPolarHBondContact O-CA 3.4Å; Y47-F51 VanDerWaalsContact O-CB 3.23Å; Y47-F51 WeakPolarHBondContact O-CB 3.31Å; Y47-F51 PolarHBondContact O-N 3.06Å; Y47-F51 WeakPolarHBondContact OH-CE1 3.37Å; F51-K53 VanDerWaalsContact C-N 3.25Å; F51-K53 PolarHBondContact O-N 3.48Å; F51-S108 WeakPolarHBondContact CZ-O 3.46Å; F51-A109 WeakPolarHBondContact CE2-O 3.23Å; F51-H111 AromaticContact CD2-CD2 3.74Å; F51-H111 AromaticContact CD2-NE2 3.14Å; F51-H111 WeakPolarHBondContact CD2-NE2 3.5Å; F51-H111 AromaticContact CE2-CD2 3.14Å; F51-H111 WeakPolarHBondContact CE2-CD2 3.44Å; F51-H111 AromaticContact CE2-NE2 3.07Å; F51-H111 WeakPolarHBondContact CE2-NE2 3.33Å; F51-P122 HydrophobicContact CZ-CG 4.36Å; F51-M125 VanDerWaalsContact O-CE 3.3Å; F51-M125 WeakPolarHBondContact O-CE 3.23Å; F51-H128 HydrophobicContact CE1-CB 4.02Å; F51-H128 AromaticContact CE1-ND1 3.96Å; F51-H128 AromaticContact CZ-ND1 3.8Å; F51-Y205 HydrophobicContact CB-CD2 4.29Å; F51-Y205 HydrophobicContact CB-CE2 4.27Å; F51-Y205 HydrophobicContact CD2-CD2 4.19Å
52	L	92.3	Very high	93.5	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.021	13%	0.133	C	C	.	.	S	Bend	trans	-80.1	-7	179.6	-61.8	-177.5	0	0	0	113.4	Y47 F48 W54 M125 H128 V129	Y47-L52 HydrophobicContact CD1-CD1 4.42Å; Y47-L52 HydrophobicContact CD1-CG 4.47Å; Y47-L52 HydrophobicContact CE1-CD1 3.75Å; Y47-L52 HydrophobicContact CE1-CD2 4.31Å; Y47-L52 HydrophobicContact CE1-CG 3.81Å; Y47-L52 PolarHBondContact O-N 2.9Å; Y47-L52 VanDerWaalsContact O-N 3.09Å; F48-L52 HydrophobicContact CD1-CD1 3.85Å; F48-L52 HydrophobicContact CE1-CD1 4.43Å; F48-L52 CarbonylContact O-C 3.6Å; F48-L52 WeakPolarHBondContact O-CB 3.5Å; L52-W54 VanDerWaalsContact C-N 3.29Å; L52-W54 HydrophobicContact CB-CD2 4Å; L52-W54 HydrophobicContact CB-CG 4.22Å; L52-W54 HydrophobicContact CB-CZ2 4.43Å; L52-W54 HydrophobicContact CD1-CD2 4.26Å; L52-W54 HydrophobicContact CD1-CE3 4.16Å; L52-W54 HydrophobicContact CD1-CH2 3.61Å; L52-W54 HydrophobicContact CD1-CZ2 3.7Å; L52-W54 HydrophobicContact CD1-CZ3 3.83Å; L52-W54 PolarHBondContact O-N 3.25Å; L52-M125 HydrophobicContact CD2-SD 3.78Å; L52-H128 HydrophobicContact CD2-CB 4.19Å; L52-V129 HydrophobicContact CD1-CG2 4.47Å; L52-V129 HydrophobicContact CD2-CG2 3.94Å
53	K	91.7	Very high	93.5	Very high	130 Å²	130	27.9 Å²	27.9	57%	0.565	13%	0.133	S	C	*	.			trans	57.4	40.1	178.7	-59.7	-58.4	-170.3	-170.3	0	112.9	F48 K49 Y50 F51 E485	F48-K53 PolarHBondContact O-N 3.42Å; K49-K53 VanDerWaalsContact O-CA 3.22Å; K49-K53 WeakPolarHBondContact O-CA 3.42Å; K49-K53 PolarHBondContact O-N 3.11Å; Y50-K53 VanDerWaalsContact O-CD 3.32Å; Y50-K53 WeakPolarHBondContact O-CD 3.44Å; Y50-K53 WeakPolarHBondContact O-CE 3.45Å; Y50-K53 PolarHBondContact O-NZ 3.38Å; F51-K53 VanDerWaalsContact C-N 3.25Å; F51-K53 PolarHBondContact O-N 3.48Å; K53-E485 IonicContact NZ-OE2 2.75Å; K53-E485 PolarHBondContact NZ-OE2 3.24Å
54	W	93	Very high	93.6	Very high	42 Å²	42	27.9 Å²	27.9	16%	0.159	13%	0.133	C	C	.	.			trans	-89.9	151	172.9	-65.4	-12.8	0	0	0	111.3	F48 K49 L52 F58 I62 V129 M133	F48-W54 HydrophobicContact CB-CE3 3.81Å; F48-W54 HydrophobicContact CB-CZ3 4.39Å; F48-W54 HydrophobicContact CD1-CE3 4.15Å; F48-W54 AromaticContact CD1-CZ3 3.87Å; F48-W54 HydrophobicContact CD1-CZ3 3.87Å; F48-W54 HydrophobicContact CE1-CZ3 4.3Å; F48-W54 AromaticContact CG-CE3 3.97Å; F48-W54 HydrophobicContact CG-CE3 3.97Å; F48-W54 HydrophobicContact CG-CZ3 4.05Å; F48-W54 PolarHBondContact O-N 3.22Å; F48-W54 VanDerWaalsContact O-N 3.08Å; K49-W54 WeakPolarHBondContact CA-O 3.25Å; L52-W54 VanDerWaalsContact C-N 3.29Å; L52-W54 HydrophobicContact CB-CD2 4Å; L52-W54 HydrophobicContact CB-CG 4.22Å; L52-W54 HydrophobicContact CB-CZ2 4.43Å; L52-W54 HydrophobicContact CD1-CD2 4.26Å; L52-W54 HydrophobicContact CD1-CE3 4.16Å; L52-W54 HydrophobicContact CD1-CH2 3.61Å; L52-W54 HydrophobicContact CD1-CZ2 3.7Å; L52-W54 HydrophobicContact CD1-CZ3 3.83Å; L52-W54 PolarHBondContact O-N 3.25Å; W54-F58 HydrophobicContact CB-CD1 3.92Å; W54-F58 AromaticContact CD2-CD1 3.44Å; W54-F58 HydrophobicContact CD2-CD1 3.44Å; W54-F58 VanDerWaalsContact CD2-CD1 3.44Å; W54-F58 AromaticContact CD2-CE1 3.48Å; W54-F58 HydrophobicContact CD2-CE1 3.48Å; W54-F58 VanDerWaalsContact CD2-CE1 3.48Å; W54-F58 AromaticContact CE2-CD1 3.99Å; W54-F58 AromaticContact CE2-CE1 3.57Å; W54-F58 AromaticContact CE3-CD1 3.62Å; W54-F58 HydrophobicContact CE3-CD1 3.62Å; W54-F58 AromaticContact CE3-CE1 3.64Å; W54-F58 HydrophobicContact CE3-CE1 3.64Å; W54-F58 AromaticContact CG-CD1 3.58Å; W54-F58 HydrophobicContact CG-CD1 3.58Å; W54-F58 HydrophobicContact CG-CE1 4.02Å; W54-F58 AromaticContact CH2-CE1 3.94Å; W54-F58 HydrophobicContact CH2-CE1 3.94Å; W54-F58 AromaticContact CZ2-CE1 3.8Å; W54-F58 HydrophobicContact CZ2-CE1 3.8Å; W54-F58 HydrophobicContact CZ3-CD1 4.3Å; W54-F58 AromaticContact CZ3-CE1 3.89Å; W54-F58 HydrophobicContact CZ3-CE1 3.89Å; W54-I62 HydrophobicContact CE3-CG1 4.36Å; W54-I62 HydrophobicContact CH2-CG1 4.39Å; W54-I62 HydrophobicContact CZ3-CB 4.12Å; W54-I62 HydrophobicContact CZ3-CG1 3.77Å; W54-I62 HydrophobicContact CZ3-CG2 4.11Å; W54-V129 HydrophobicContact CH2-CG1 4.43Å; W54-V129 HydrophobicContact CZ2-CB 4.47Å; W54-V129 HydrophobicContact CZ2-CG1 3.85Å; W54-V129 HydrophobicContact CZ2-CG2 3.87Å; W54-M133 HydrophobicContact CH2-CE 3.63Å; W54-M133 HydrophobicContact CH2-SD 4.27Å; W54-M133 HydrophobicContact CZ3-CE 4.15Å
55	D	91.1	Very high	93.6	Very high	94 Å²	94	30.3 Å²	30.3	50%	0.503	15%	0.149	S	C	.	.			trans	-68.8	167.9	173.2	65.8	88.5	0	0	0	111.9	D57 F58 S59	D55-D57 VanDerWaalsContact C-N 3.3Å; D55-D57 PolarHBondContact O-N 3.13Å; D55-D57 WeakPolarHBondContact OD1-CA 3.43Å; D55-D57 WeakPolarHBondContact OD1-CB 3.48Å; D55-D57 PolarHBondContact OD1-N 3.39Å; D55-F58 PolarHBondContact OD1-N 3.02Å; D55-F58 VanDerWaalsContact OD2-CB 3.31Å; D55-F58 WeakPolarHBondContact OD2-CB 3.25Å; D55-S59 WeakPolarHBondContact O-CB 3.36Å; D55-S59 PolarHBondContact O-N 3.28Å; D55-S59 PolarHBondContact O-OG 2.96Å
56	D	89.9	Confident	93.6	Very high	38 Å²	38	30.6 Å²	30.6	20%	0.203	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-34.1	-175.5	-79.2	4.8	0	0	0	112.8	K49 T60 L313	K49-D56 VanDerWaalsContact CD-OD1 3.28Å; K49-D56 WeakPolarHBondContact CD-OD1 3.31Å; K49-D56 WeakPolarHBondContact CE-OD1 3.16Å; K49-D56 IonicContact NZ-OD1 2.91Å; K49-D56 PolarHBondContact NZ-OD1 3.32Å; K49-D56 IonicContact NZ-OD2 3.59Å; K49-D56 PolarHBondContact NZ-OD2 3.5Å; D56-T60 VanDerWaalsContact O-CB 3.3Å; D56-T60 WeakPolarHBondContact O-CB 3.18Å; D56-T60 PolarHBondContact O-N 3.15Å; D56-T60 VanDerWaalsContact O-N 3.11Å; D56-T60 PolarHBondContact O-OG1 3.14Å; D56-L313 HydrophobicContact CB-CD1 3.85Å
57	D	89.9	Confident	93.7	Very high	85 Å²	85	30.6 Å²	30.6	46%	0.455	15%	0.15	S	C	.	.	H	α-helix	trans	-76.5	-48.3	-178.3	-65.5	-22.4	0	0	0	110.5	D55 S59 T60 T61 R310	D55-D57 VanDerWaalsContact C-N 3.3Å; D55-D57 PolarHBondContact O-N 3.13Å; D55-D57 WeakPolarHBondContact OD1-CA 3.43Å; D55-D57 WeakPolarHBondContact OD1-CB 3.48Å; D55-D57 PolarHBondContact OD1-N 3.39Å; D57-S59 VanDerWaalsContact C-N 3.33Å; D57-S59 PolarHBondContact O-N 3.02Å; D57-T60 WeakPolarHBondContact O-CB 3.23Å; D57-T60 PolarHBondContact O-N 3.39Å; D57-T60 VanDerWaalsContact O-N 3.15Å; D57-T61 PolarHBondContact O-N 3.47Å; D57-T61 PolarHBondContact O-OG1 2.93Å; D57-R310 IonicContact OD1-CZ 2.89Å; D57-R310 IonicContact OD1-NH1 3.63Å; D57-R310 PolarHBondContact OD1-NH1 3.49Å; D57-R310 IonicContact OD1-NH2 3.67Å; D57-R310 PolarHBondContact OD1-NH2 2.96Å
58	F	92.1	Very high	93.7	Very high	85 Å²	85	30.9 Å²	30.9	37%	0.373	15%	0.152	S	C	.	.	H	α-helix	trans	-63.6	-40.3	177.4	-169.4	-115.8	0	0	0	111.9	W54 D55 T60 T61 I62	W54-F58 HydrophobicContact CB-CD1 3.92Å; W54-F58 AromaticContact CD2-CD1 3.44Å; W54-F58 HydrophobicContact CD2-CD1 3.44Å; W54-F58 VanDerWaalsContact CD2-CD1 3.44Å; W54-F58 AromaticContact CD2-CE1 3.48Å; W54-F58 HydrophobicContact CD2-CE1 3.48Å; W54-F58 VanDerWaalsContact CD2-CE1 3.48Å; W54-F58 AromaticContact CE2-CD1 3.99Å; W54-F58 AromaticContact CE2-CE1 3.57Å; W54-F58 AromaticContact CE3-CD1 3.62Å; W54-F58 HydrophobicContact CE3-CD1 3.62Å; W54-F58 AromaticContact CE3-CE1 3.64Å; W54-F58 HydrophobicContact CE3-CE1 3.64Å; W54-F58 AromaticContact CG-CD1 3.58Å; W54-F58 HydrophobicContact CG-CD1 3.58Å; W54-F58 HydrophobicContact CG-CE1 4.02Å; W54-F58 AromaticContact CH2-CE1 3.94Å; W54-F58 HydrophobicContact CH2-CE1 3.94Å; W54-F58 AromaticContact CZ2-CE1 3.8Å; W54-F58 HydrophobicContact CZ2-CE1 3.8Å; W54-F58 HydrophobicContact CZ3-CD1 4.3Å; W54-F58 AromaticContact CZ3-CE1 3.89Å; W54-F58 HydrophobicContact CZ3-CE1 3.89Å; D55-F58 PolarHBondContact OD1-N 3.02Å; D55-F58 VanDerWaalsContact OD2-CB 3.31Å; D55-F58 WeakPolarHBondContact OD2-CB 3.25Å; F58-T60 VanDerWaalsContact C-N 3.32Å; F58-T60 PolarHBondContact O-N 3.05Å; F58-T61 PolarHBondContact O-N 3.12Å; F58-I62 HydrophobicContact CD1-CG1 4.47Å; F58-I62 HydrophobicContact CE1-CG1 4.08Å; F58-I62 HydrophobicContact CE2-CD1 4.14Å; F58-I62 HydrophobicContact CE2-CG1 4.2Å; F58-I62 HydrophobicContact CZ-CD1 3.95Å; F58-I62 HydrophobicContact CZ-CG1 3.93Å; F58-I62 WeakPolarHBondContact O-CG1 3.44Å; F58-I62 PolarHBondContact O-N 2.69Å
59	S	94.1	Very high	93.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-43.3	173.1	-63.8	0	0	0	0	111.9	F48 D55 D57 Y63	F48-S59 WeakPolarHBondContact CB-OG 3.46Å; F48-S59 WeakPolarHBondContact CD2-O 3.1Å; D55-S59 WeakPolarHBondContact O-CB 3.36Å; D55-S59 PolarHBondContact O-N 3.28Å; D55-S59 PolarHBondContact O-OG 2.96Å; D57-S59 VanDerWaalsContact C-N 3.33Å; D57-S59 PolarHBondContact O-N 3.02Å; S59-Y63 VanDerWaalsContact O-CB 3.32Å; S59-Y63 WeakPolarHBondContact O-CB 3.37Å; S59-Y63 PolarHBondContact O-N 2.85Å
60	T	93.4	Very high	93.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-65	-43.3	176.8	-63.6	0	0	0	0	111.3	D56 D57 F58 Y63 H64 R310	D56-T60 VanDerWaalsContact O-CB 3.3Å; D56-T60 WeakPolarHBondContact O-CB 3.18Å; D56-T60 PolarHBondContact O-N 3.15Å; D56-T60 VanDerWaalsContact O-N 3.11Å; D56-T60 PolarHBondContact O-OG1 3.14Å; D57-T60 WeakPolarHBondContact O-CB 3.23Å; D57-T60 PolarHBondContact O-N 3.39Å; D57-T60 VanDerWaalsContact O-N 3.15Å; F58-T60 VanDerWaalsContact C-N 3.32Å; F58-T60 PolarHBondContact O-N 3.05Å; T60-Y63 PolarHBondContact O-N 3.02Å; T60-H64 PolarHBondContact O-CD2 3.15Å; T60-H64 PolarHBondContact O-N 3.15Å; T60-R310 HydrophobicContact CG2-CG 4.27Å
61	T	93.7	Very high	93.9	Very high	21 Å²	21	32.8 Å²	32.8	13%	0.129	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-47.8	177.8	-73.8	0	0	0	0	112.3	D57 F58 T65 L637	D57-T61 PolarHBondContact O-N 3.47Å; D57-T61 PolarHBondContact O-OG1 2.93Å; F58-T61 PolarHBondContact O-N 3.12Å; T61-T65 WeakPolarHBondContact O-CB 3.22Å; T61-T65 PolarHBondContact O-N 3.17Å; T61-T65 PolarHBondContact O-OG1 3.05Å; T61-L637 HydrophobicContact CG2-CD2 4.03Å; T61-L637 WeakPolarHBondContact O-CD2 3.28Å
62	I	95.6	Very high	94	Very high	29 Å²	29	36 Å²	36	15%	0.149	18%	0.18	C	C	.	.	H	α-helix	trans	-68.1	-39.9	178.8	-61.7	-59.8	0	0	0	111.2	F48 W54 F58 T65 F66 M133 L136	F48-I62 HydrophobicContact CD2-CB 4.46Å; F48-I62 HydrophobicContact CE1-CG2 4.4Å; F48-I62 HydrophobicContact CE2-CB 4.08Å; F48-I62 HydrophobicContact CE2-CG2 3.78Å; F48-I62 HydrophobicContact CZ-CB 4.49Å; F48-I62 HydrophobicContact CZ-CG2 3.71Å; W54-I62 HydrophobicContact CE3-CG1 4.36Å; W54-I62 HydrophobicContact CH2-CG1 4.39Å; W54-I62 HydrophobicContact CZ3-CB 4.12Å; W54-I62 HydrophobicContact CZ3-CG1 3.77Å; W54-I62 HydrophobicContact CZ3-CG2 4.11Å; F58-I62 HydrophobicContact CD1-CG1 4.47Å; F58-I62 HydrophobicContact CE1-CG1 4.08Å; F58-I62 HydrophobicContact CE2-CD1 4.14Å; F58-I62 HydrophobicContact CE2-CG1 4.2Å; F58-I62 HydrophobicContact CZ-CD1 3.95Å; F58-I62 HydrophobicContact CZ-CG1 3.93Å; F58-I62 WeakPolarHBondContact O-CG1 3.44Å; F58-I62 PolarHBondContact O-N 2.69Å; I62-T65 PolarHBondContact O-N 3.49Å; I62-F66 WeakPolarHBondContact O-CB 3.42Å; I62-F66 PolarHBondContact O-N 2.93Å; I62-M133 HydrophobicContact CG2-CE 4.12Å; I62-M133 HydrophobicContact CG2-SD 4.2Å; I62-L136 HydrophobicContact CG2-CD1 4.45Å
63	Y	96.7	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.5	-51.1	175.7	176.1	-89.9	0	0	0	112	R41 L44 S59 T60 T65 F66 V67 G308	R41-Y63 HydrophobicContact CG-CE2 3.78Å; R41-Y63 PolarHBondContact NE-OH 2.8Å; R41-Y63 PolarHBondContact NH2-OH 2.99Å; L44-Y63 HydrophobicContact CB-CD2 4.36Å; L44-Y63 HydrophobicContact CD2-CD2 4.19Å; S59-Y63 VanDerWaalsContact O-CB 3.32Å; S59-Y63 WeakPolarHBondContact O-CB 3.37Å; S59-Y63 PolarHBondContact O-N 2.85Å; T60-Y63 PolarHBondContact O-N 3.02Å; Y63-T65 VanDerWaalsContact C-N 3.34Å; Y63-T65 PolarHBondContact O-N 3.3Å; Y63-F66 WeakPolarHBondContact O-CB 3.42Å; Y63-F66 PolarHBondContact O-N 2.95Å; Y63-V67 HydrophobicContact CD1-CG2 4.36Å; Y63-V67 HydrophobicContact CE1-CG2 4.02Å; Y63-V67 WeakPolarHBondContact O-CG2 3.36Å; Y63-V67 PolarHBondContact O-N 2.94Å; Y63-G308 WeakPolarHBondContact OH-CA 3.31Å
64	H	96.7	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.6	-31.7	179.7	-75.8	-68.1	0	0	0	112.7	T60 V67 A68 S309 N633 L637	T60-H64 PolarHBondContact O-CD2 3.15Å; T60-H64 PolarHBondContact O-N 3.15Å; H64-V67 PolarHBondContact O-N 3.35Å; H64-A68 VanDerWaalsContact O-CB 3.29Å; H64-A68 WeakPolarHBondContact O-CB 3.21Å; H64-A68 PolarHBondContact O-N 3.04Å; H64-S309 PolarHBondContact NE2-OG 3.3Å; H64-N633 HydrophobicContact CB-CB 4.36Å; H64-N633 PolarHBondContact ND1-OD1 3.3Å; H64-L637 HydrophobicContact CB-CD2 3.74Å; H64-L637 HydrophobicContact CB-CG 4.34Å
65	T	96.5	Very high	93.7	Very high	52 Å²	52	30.4 Å²	30.4	32%	0.319	16%	0.159	S	C	.	.	H	α-helix	trans	-61	-46.4	171.6	-61.1	0	0	0	0	111.1	T61 I62 Y63 A68 L69 L637	T61-T65 WeakPolarHBondContact O-CB 3.22Å; T61-T65 PolarHBondContact O-N 3.17Å; T61-T65 PolarHBondContact O-OG1 3.05Å; I62-T65 PolarHBondContact O-N 3.49Å; Y63-T65 VanDerWaalsContact C-N 3.34Å; Y63-T65 PolarHBondContact O-N 3.3Å; T65-A68 PolarHBondContact O-N 3.44Å; T65-L69 HydrophobicContact CG2-CD1 4.4Å; T65-L69 WeakPolarHBondContact O-CG 3.47Å; T65-L69 PolarHBondContact O-N 2.88Å; T65-L637 WeakPolarHBondContact OG1-CD1 3.48Å
66	F	97.1	Very high	93.5	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.026	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-47.7	176	165.3	-105.4	0	0	0	111.9	M40 L44 I62 Y63 A68 L69 C70 L136 I139 A140	M40-F66 HydrophobicContact CE-CE1 3.94Å; M40-F66 HydrophobicContact CE-CE2 4.47Å; M40-F66 HydrophobicContact CE-CZ 3.58Å; L44-F66 HydrophobicContact CD2-CD1 3.87Å; L44-F66 HydrophobicContact CD2-CE1 4.25Å; L44-F66 HydrophobicContact CD2-CG 4.42Å; I62-F66 WeakPolarHBondContact O-CB 3.42Å; I62-F66 PolarHBondContact O-N 2.93Å; Y63-F66 WeakPolarHBondContact O-CB 3.42Å; Y63-F66 PolarHBondContact O-N 2.95Å; F66-A68 PolarHBondContact O-N 3.07Å; F66-L69 PolarHBondContact O-N 3.06Å; F66-C70 WeakPolarHBondContact CE2-SG 3.24Å; F66-C70 WeakPolarHBondContact CZ-SG 2.99Å; F66-C70 PolarHBondContact O-N 3.4Å; F66-C70 PolarHBondContact O-SG 3.29Å; F66-L136 HydrophobicContact CD2-CB 3.98Å; F66-L136 HydrophobicContact CD2-CD2 3.78Å; F66-L136 HydrophobicContact CD2-CG 4.43Å; F66-L136 HydrophobicContact CE2-CB 4.48Å; F66-L136 HydrophobicContact CE2-CD2 3.95Å; F66-L136 HydrophobicContact CG-CD2 4.09Å; F66-L136 HydrophobicContact CZ-CD2 4.43Å; F66-I139 HydrophobicContact CE2-CB 4.14Å; F66-I139 HydrophobicContact CE2-CG2 3.69Å; F66-I139 HydrophobicContact CZ-CG2 3.71Å; F66-A140 HydrophobicContact CD2-CB 4.16Å; F66-A140 HydrophobicContact CE2-CB 4.07Å
67	V	96.3	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-44.6	178.1	178.1	0	0	0	0	110.6	Y63 H64 L69 C70 Y71 N633	Y63-V67 HydrophobicContact CD1-CG2 4.36Å; Y63-V67 HydrophobicContact CE1-CG2 4.02Å; Y63-V67 WeakPolarHBondContact O-CG2 3.36Å; Y63-V67 PolarHBondContact O-N 2.94Å; H64-V67 PolarHBondContact O-N 3.35Å; V67-L69 VanDerWaalsContact C-N 3.31Å; V67-L69 PolarHBondContact O-N 2.96Å; V67-C70 WeakPolarHBondContact O-CB 3.16Å; V67-C70 PolarHBondContact O-N 3.4Å; V67-C70 VanDerWaalsContact O-N 3.1Å; V67-Y71 HydrophobicContact CG1-CD2 3.78Å; V67-Y71 HydrophobicContact CG1-CE2 3.83Å; V67-Y71 VanDerWaalsContact O-CD2 3.31Å; V67-Y71 WeakPolarHBondContact O-CD2 3.14Å; V67-Y71 PolarHBondContact O-N 2.94Å; V67-Y71 VanDerWaalsContact O-N 3.13Å; V67-N633 WeakPolarHBondContact CG1-ND2 3.45Å; V67-N633 WeakPolarHBondContact CG1-OD1 3.49Å
68	A	96.5	Very high	93.1	Very high	6 Å²	6	25.6 Å²	25.6	5%	0.05	14%	0.136	C	C	.	.	H	α-helix	trans	-55.9	-45.2	176.5	0	0	0	0	0	111.9	H64 T65 F66 Y71 L72 A630 N633 I634	H64-A68 VanDerWaalsContact O-CB 3.29Å; H64-A68 WeakPolarHBondContact O-CB 3.21Å; H64-A68 PolarHBondContact O-N 3.04Å; T65-A68 PolarHBondContact O-N 3.44Å; F66-A68 PolarHBondContact O-N 3.07Å; A68-Y71 PolarHBondContact O-N 3.03Å; A68-L72 VanDerWaalsContact O-CB 3.3Å; A68-L72 WeakPolarHBondContact O-CB 3.42Å; A68-L72 PolarHBondContact O-N 2.98Å; A68-A630 WeakPolarHBondContact O-CB 3.36Å; A68-N633 HydrophobicContact CB-CB 3.83Å; A68-I634 HydrophobicContact CB-CG1 4.03Å
69	L	95.8	Very high	92.7	Very high	58 Å²	58	24.1 Å²	24.1	30%	0.304	13%	0.132	S	C	.	.	H	α-helix	trans	-63.6	-40.7	176.2	-69.8	174.2	0	0	0	112.3	T65 F66 V67 Y71 L72 T73 L137 A140	T65-L69 HydrophobicContact CG2-CD1 4.4Å; T65-L69 WeakPolarHBondContact O-CG 3.47Å; T65-L69 PolarHBondContact O-N 2.88Å; F66-L69 PolarHBondContact O-N 3.06Å; V67-L69 VanDerWaalsContact C-N 3.31Å; V67-L69 PolarHBondContact O-N 2.96Å; L69-Y71 PolarHBondContact O-N 3.24Å; L69-L72 PolarHBondContact O-N 3.49Å; L69-T73 WeakPolarHBondContact O-CB 3.37Å; L69-T73 WeakPolarHBondContact O-CG2 3.38Å; L69-T73 PolarHBondContact O-N 3.37Å; L69-T73 PolarHBondContact O-OG1 3.2Å; L69-L137 HydrophobicContact CD1-CD1 4.43Å; L69-A140 HydrophobicContact CB-CB 3.8Å
70	C	95.1	Very high	92.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-28	176.5	-69.3	0	0	0	0	113.5	Y37 F66 V67 P74 T143 G144	Y37-C70 HydrophobicContact CE2-CB 4.42Å; F66-C70 WeakPolarHBondContact CE2-SG 3.24Å; F66-C70 WeakPolarHBondContact CZ-SG 2.99Å; F66-C70 PolarHBondContact O-N 3.4Å; F66-C70 PolarHBondContact O-SG 3.29Å; V67-C70 WeakPolarHBondContact O-CB 3.16Å; V67-C70 PolarHBondContact O-N 3.4Å; V67-C70 VanDerWaalsContact O-N 3.1Å; C70-P74 WeakPolarHBondContact O-CD 3.48Å; C70-T143 HydrophobicContact CB-CG2 4.11Å; C70-G144 VanDerWaalsContact O-CA 3.24Å; C70-G144 WeakPolarHBondContact O-CA 3.41Å
71	Y	93.9	Very high	91.9	Very high	30 Å²	30	26.9 Å²	26.9	12%	0.118	15%	0.146	C	C	.	.	H	α-helix	trans	-99.9	-11.9	179.2	-75.6	-82.3	0	0	0	113.8	V67 A68 L69 P74 L626 V629	V67-Y71 HydrophobicContact CG1-CD2 3.78Å; V67-Y71 HydrophobicContact CG1-CE2 3.83Å; V67-Y71 VanDerWaalsContact O-CD2 3.31Å; V67-Y71 WeakPolarHBondContact O-CD2 3.14Å; V67-Y71 PolarHBondContact O-N 2.94Å; V67-Y71 VanDerWaalsContact O-N 3.13Å; A68-Y71 PolarHBondContact O-N 3.03Å; L69-Y71 PolarHBondContact O-N 3.24Å; Y71-P74 WeakPolarHBondContact O-CD 3.17Å; Y71-L626 HydrophobicContact CD1-CB 4.49Å; Y71-L626 HydrophobicContact CD1-CD2 3.81Å; Y71-L626 HydrophobicContact CE1-CD2 3.98Å; Y71-V629 HydrophobicContact CD1-CB 3.84Å; Y71-V629 HydrophobicContact CD1-CG1 3.84Å; Y71-V629 HydrophobicContact CD1-CG2 4.18Å; Y71-V629 HydrophobicContact CD2-CB 4.37Å; Y71-V629 HydrophobicContact CD2-CG1 3.66Å; Y71-V629 HydrophobicContact CE1-CB 4.34Å; Y71-V629 HydrophobicContact CE1-CG1 4.01Å; Y71-V629 HydrophobicContact CE1-CG2 4.38Å; Y71-V629 HydrophobicContact CE2-CG1 3.86Å; Y71-V629 HydrophobicContact CG-CB 3.87Å; Y71-V629 HydrophobicContact CG-CG1 3.66Å
72	L	93.1	Very high	91.3	Very high	76 Å²	76	27.3 Å²	27.3	40%	0.398	15%	0.147	S	C	.	.	H	α-helix	trans	-87.6	-42.4	173.1	-176.9	66	0	0	0	112.9	A68 L69 I75 L627 A630	A68-L72 VanDerWaalsContact O-CB 3.3Å; A68-L72 WeakPolarHBondContact O-CB 3.42Å; A68-L72 PolarHBondContact O-N 2.98Å; L69-L72 PolarHBondContact O-N 3.49Å; L72-I75 PolarHBondContact O-N 3.4Å; L72-L627 HydrophobicContact CD1-CD1 3.75Å; L72-A630 HydrophobicContact CB-CB 4.22Å
73	T	92.6	Very high	90.6	Very high	11 Å²	11	29 Å²	29	7%	0.067	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.7	-179.8	53.6	0	0	0	0	116.5	L69 I75 L76 G77 A140 L141 G144	L69-T73 WeakPolarHBondContact O-CB 3.37Å; L69-T73 WeakPolarHBondContact O-CG2 3.38Å; L69-T73 PolarHBondContact O-N 3.37Å; L69-T73 PolarHBondContact O-OG1 3.2Å; T73-I75 PolarHBondContact O-N 3.35Å; T73-L76 HydrophobicContact CG2-CD1 4.45Å; T73-L76 WeakPolarHBondContact O-CB 3.32Å; T73-L76 PolarHBondContact O-N 2.9Å; T73-G77 PolarHBondContact O-N 3.21Å; T73-G77 VanDerWaalsContact O-N 3.1Å; T73-A140 PolarHBondContact OG1-O 3.35Å; T73-L141 HydrophobicContact CG2-CD2 3.82Å; T73-G144 WeakPolarHBondContact OG1-CA 3.42Å
74	P	90.3	Very high	89.9	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.019	20%	0.197	C	C	.	.	H	α-helix	trans	-52.1	-34.1	168.1	-28.7	35.4	0	0	0	114.4	C70 Y71 L76 G77 A78 G144 P148 L626	C70-P74 WeakPolarHBondContact O-CD 3.48Å; Y71-P74 WeakPolarHBondContact O-CD 3.17Å; P74-L76 VanDerWaalsContact C-N 3.29Å; P74-L76 PolarHBondContact O-N 2.93Å; P74-G77 PolarHBondContact O-N 3.23Å; P74-A78 WeakPolarHBondContact O-CB 3.36Å; P74-A78 PolarHBondContact O-N 2.95Å; P74-G144 WeakPolarHBondContact CA-O 3.31Å; P74-G144 WeakPolarHBondContact CB-O 3.38Å; P74-G144 VanDerWaalsContact CG-O 3.28Å; P74-G144 WeakPolarHBondContact CG-O 3.47Å; P74-P148 HydrophobicContact CB-CG 4.16Å; P74-L626 HydrophobicContact CB-CD1 3.89Å; P74-L626 HydrophobicContact CG-CD1 4.1Å
75	I	87.3	Confident	89.2	Confident	43 Å²	43	40.3 Å²	40.3	22%	0.221	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-42.9	176.6	-63.8	172.5	0	0	0	110.2	L72 T73 I79 M240 L627	L72-I75 PolarHBondContact O-N 3.4Å; T73-I75 PolarHBondContact O-N 3.35Å; I75-I79 HydrophobicContact CG2-CD1 3.88Å; I75-I79 WeakPolarHBondContact O-CD1 3.19Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 3.14Å; I75-I79 VanDerWaalsContact O-N 3.08Å; I75-M240 HydrophobicContact CG2-SD 3.9Å; I75-L627 HydrophobicContact CD1-CD1 4.28Å
76	L	87.4	Confident	88.7	Confident	95 Å²	95	38.2 Å²	38.2	50%	0.497	20%	0.196	S	C	.	.	H	α-helix	trans	-66.2	-45.3	177.5	-59.3	175.3	0	0	0	111	T73 P74 A78 I79 I80	T73-L76 HydrophobicContact CG2-CD1 4.45Å; T73-L76 WeakPolarHBondContact O-CB 3.32Å; T73-L76 PolarHBondContact O-N 2.9Å; P74-L76 VanDerWaalsContact C-N 3.29Å; P74-L76 PolarHBondContact O-N 2.93Å; L76-A78 PolarHBondContact O-N 3.24Å; L76-I79 PolarHBondContact O-N 2.91Å; L76-I80 VanDerWaalsContact O-CG1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.4Å; L76-I80 PolarHBondContact O-N 3.41Å
77	G	86.4	Confident	88.1	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-58.4	-46.4	177.8	0	0	0	0	0	112.9	T73 P74 I79 I80 A81 G145	T73-G77 PolarHBondContact O-N 3.21Å; T73-G77 VanDerWaalsContact O-N 3.1Å; P74-G77 PolarHBondContact O-N 3.23Å; G77-I79 PolarHBondContact O-N 3.35Å; G77-I80 PolarHBondContact O-N 3.14Å; G77-A81 WeakPolarHBondContact O-CB 3.19Å; G77-A81 PolarHBondContact O-N 3.35Å; G77-G145 WeakPolarHBondContact CA-O 3.3Å
78	A	83.9	Confident	87.9	Confident	19 Å²	19	41.4 Å²	41.4	16%	0.157	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-43.9	175.8	0	0	0	0	0	111.9	P74 L76 I80 A81 D82 P148	P74-A78 WeakPolarHBondContact O-CB 3.36Å; P74-A78 PolarHBondContact O-N 2.95Å; L76-A78 PolarHBondContact O-N 3.24Å; A78-I80 PolarHBondContact O-N 3.35Å; A78-A81 PolarHBondContact O-N 2.93Å; A78-D82 WeakPolarHBondContact O-CB 3.36Å; A78-D82 PolarHBondContact O-N 3.32Å; A78-P148 HydrophobicContact CB-CB 4.42Å; A78-P148 HydrophobicContact CB-CG 4.21Å
79	I	84.1	Confident	87.6	Confident	55 Å²	55	46.6 Å²	46.6	28%	0.282	23%	0.231	S	C	.	.	H	α-helix	trans	-61.5	-44.6	178	-67.8	163.1	0	0	0	111.5	I75 L76 G77 S83 N238	I75-I79 HydrophobicContact CG2-CD1 3.88Å; I75-I79 WeakPolarHBondContact O-CD1 3.19Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 3.14Å; I75-I79 VanDerWaalsContact O-N 3.08Å; L76-I79 PolarHBondContact O-N 2.91Å; G77-I79 PolarHBondContact O-N 3.35Å; I79-S83 WeakPolarHBondContact O-CB 3.32Å; I79-S83 PolarHBondContact O-N 3.02Å; I79-S83 PolarHBondContact O-OG 3.4Å; I79-N238 WeakPolarHBondContact CA-ND2 3.38Å; I79-N238 WeakPolarHBondContact CG1-ND2 3.23Å
80	I	85.9	Confident	87.4	Confident	57 Å²	57	43.8 Å²	43.8	29%	0.292	22%	0.217	S	C	.	.	H	α-helix	trans	-65.6	-44	-179.7	-67.5	166.3	0	0	0	110.8	L76 G77 A78 W84 L85 T90	L76-I80 VanDerWaalsContact O-CG1 3.25Å; L76-I80 WeakPolarHBondContact O-CG1 3.4Å; L76-I80 PolarHBondContact O-N 3.41Å; G77-I80 PolarHBondContact O-N 3.14Å; A78-I80 PolarHBondContact O-N 3.35Å; I80-W84 PolarHBondContact O-N 3.21Å; I80-W84 VanDerWaalsContact O-N 3.12Å; I80-L85 HydrophobicContact CG2-CB 4.2Å; I80-L85 HydrophobicContact CG2-CD1 3.47Å; I80-L85 VanDerWaalsContact CG2-CD1 3.47Å; I80-L85 HydrophobicContact CG2-CG 3.84Å; I80-L85 PolarHBondContact O-N 3.47Å; I80-T90 HydrophobicContact CG2-CG2 4.24Å
81	A	84.2	Confident	87.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	22%	0.217	C	C	.	.	I	π-helix	trans	-63.2	-48.3	178.1	0	0	0	0	0	112.8	G77 A78 G86 K87 T90	G77-A81 WeakPolarHBondContact O-CB 3.19Å; G77-A81 PolarHBondContact O-N 3.35Å; A78-A81 PolarHBondContact O-N 2.93Å; A81-G86 WeakPolarHBondContact O-CA 3.43Å; A81-G86 PolarHBondContact O-N 2.97Å; A81-K87 HydrophobicContact CB-CG 4.41Å; A81-T90 WeakPolarHBondContact CA-OG1 3.45Å; A81-T90 HydrophobicContact CB-CG2 4.08Å; A81-T90 PolarHBondContact N-OG1 3.44Å
82	D	82.5	Confident	87.4	Confident	31 Å²	31	43.4 Å²	43.4	17%	0.166	22%	0.217	C	C	.	.	I	π-helix	trans	-80.8	-26	-172.8	-69.9	-11	0	0	0	113.1	A78 P235 N238	A78-D82 WeakPolarHBondContact O-CB 3.36Å; A78-D82 PolarHBondContact O-N 3.32Å; D82-P235 WeakPolarHBondContact O-CB 3.14Å; D82-N238 HydrophobicContact CB-CB 4.24Å
83	S	81.1	Confident	87.5	Confident	63 Å²	63	46 Å²	46	44%	0.441	22%	0.222	S	C	.	.	I	π-helix	trans	-100.8	-33	-173.7	-38.8	0	0	0	0	114	I79 N238	I79-S83 WeakPolarHBondContact O-CB 3.32Å; I79-S83 PolarHBondContact O-N 3.02Å; I79-S83 PolarHBondContact O-OG 3.4Å; S83-N238 VanDerWaalsContact OG-CB 3.31Å; S83-N238 WeakPolarHBondContact OG-CB 3.31Å; S83-N238 PolarHBondContact OG-ND2 2.85Å
84	W	80.3	Confident	87.6	Confident	197 Å²	197	46.8 Å²	46.8	75%	0.746	23%	0.226	S	C	*	.	I	π-helix	trans	-130	-61.7	-164.4	-173.5	31.4	0	0	0	114.3	I80	I80-W84 PolarHBondContact O-N 3.21Å; I80-W84 VanDerWaalsContact O-N 3.12Å
85	L	82.8	Confident	87.9	Confident	42 Å²	42	46.6 Å²	46.6	22%	0.22	23%	0.225	C	C	.	.	I	π-helix	trans	-93.2	-24.6	-166.6	-66.2	-179.1	0	0	0	113.7	I80 K89 Y93	I80-L85 HydrophobicContact CG2-CB 4.2Å; I80-L85 HydrophobicContact CG2-CD1 3.47Å; I80-L85 VanDerWaalsContact CG2-CD1 3.47Å; I80-L85 HydrophobicContact CG2-CG 3.84Å; I80-L85 PolarHBondContact O-N 3.47Å; L85-K89 HydrophobicContact CB-CB 4.08Å; L85-K89 WeakPolarHBondContact O-CB 3.28Å; L85-K89 WeakPolarHBondContact O-CD 3.27Å; L85-Y93 HydrophobicContact CD1-CD2 4.06Å
86	G	85.3	Confident	88.3	Confident	8 Å²	8	48 Å²	48	8%	0.082	23%	0.233	C	C	.	.			trans	79	151	-166.5	0	0	0	0	0	112.1	A81 F88 K89 T90	A81-G86 WeakPolarHBondContact O-CA 3.43Å; A81-G86 PolarHBondContact O-N 2.97Å; G86-F88 PolarHBondContact O-N 2.96Å; G86-K89 PolarHBondContact O-N 2.85Å; G86-T90 PolarHBondContact O-N 3.34Å; G86-T90 PolarHBondContact O-OG1 3.46Å; G86-T90 VanDerWaalsContact O-OG1 3.13Å
87	K	86.2	Confident	88.8	Confident	38 Å²	38	45.8 Å²	45.8	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-50.7	-48.8	-173.9	-62.6	177.8	-173.8	169.9	0	113.2	A81 K89 T90 I91 A152 F153 D156	A81-K87 HydrophobicContact CB-CG 4.41Å; K87-K89 PolarHBondContact O-N 3.04Å; K87-T90 PolarHBondContact O-N 2.96Å; K87-I91 WeakPolarHBondContact O-CD1 3.48Å; K87-I91 VanDerWaalsContact O-CG1 3.24Å; K87-I91 WeakPolarHBondContact O-CG1 3.47Å; K87-I91 PolarHBondContact O-N 2.92Å; K87-A152 HydrophobicContact CD-CB 4.31Å; K87-F153 HydrophobicContact CB-CB 4.39Å; K87-F153 HydrophobicContact CB-CD2 4.05Å; K87-F153 HydrophobicContact CD-CB 4.46Å; K87-D156 IonicContact NZ-OD1 3.21Å; K87-D156 PolarHBondContact NZ-OD1 2.89Å; K87-D156 IonicContact NZ-OD2 3.6Å; K87-D156 PolarHBondContact NZ-OD2 3.36Å
88	F	90.8	Very high	89.3	Confident	34 Å²	34	45.7 Å²	45.7	15%	0.149	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-48.8	-177.5	176.4	-101	0	0	0	113	G86 I91 V92 F153 F223 S227 Y230 K232	G86-F88 PolarHBondContact O-N 2.96Å; F88-I91 PolarHBondContact O-N 2.68Å; F88-V92 HydrophobicContact CE1-CG2 4.19Å; F88-V92 HydrophobicContact CE2-CG2 4.14Å; F88-V92 HydrophobicContact CZ-CG2 3.88Å; F88-V92 WeakPolarHBondContact O-CG2 3.41Å; F88-V92 PolarHBondContact O-N 3.34Å; F88-V92 VanDerWaalsContact O-N 3.11Å; F88-F153 HydrophobicContact CB-CE2 3.83Å; F88-F153 HydrophobicContact CB-CZ 4Å; F88-F153 HydrophobicContact CD2-CE1 4.24Å; F88-F153 HydrophobicContact CD2-CE2 4.42Å; F88-F153 AromaticContact CD2-CZ 3.72Å; F88-F153 HydrophobicContact CD2-CZ 3.72Å; F88-F153 HydrophobicContact CG-CZ 4.3Å; F88-F223 AromaticContact CD2-CE1 3.65Å; F88-F223 HydrophobicContact CD2-CE1 3.65Å; F88-F223 HydrophobicContact CD2-CZ 4Å; F88-F223 HydrophobicContact CE2-CD1 4.15Å; F88-F223 AromaticContact CE2-CE1 3.59Å; F88-F223 HydrophobicContact CE2-CE1 3.59Å; F88-F223 HydrophobicContact CE2-CZ 4.26Å; F88-S227 VanDerWaalsContact CZ-CB 3.42Å; F88-Y230 AromaticContact CD2-CD2 3.76Å; F88-Y230 HydrophobicContact CD2-CD2 3.76Å; F88-Y230 HydrophobicContact CD2-CE2 4.23Å; F88-Y230 AromaticContact CE2-CD2 3.59Å; F88-Y230 HydrophobicContact CE2-CD2 3.59Å; F88-Y230 AromaticContact CE2-CE2 3.8Å; F88-Y230 HydrophobicContact CE2-CE2 3.8Å; F88-K232 HydrophobicContact CB-CG 4.3Å; F88-K232 HydrophobicContact CD1-CD 4.13Å; F88-K232 HydrophobicContact CG-CD 4.26Å; F88-K232 HydrophobicContact CG-CG 4.4Å
89	K	91.7	Very high	89.9	Confident	115 Å²	115	45.1 Å²	45.1	50%	0.5	22%	0.217	S	C	.	.	H	α-helix	trans	-69	-38.7	-179	-68.6	-174.1	-176.4	175.5	0	111.2	L85 G86 K87 I91 V92 Y93	L85-K89 HydrophobicContact CB-CB 4.08Å; L85-K89 WeakPolarHBondContact O-CB 3.28Å; L85-K89 WeakPolarHBondContact O-CD 3.27Å; G86-K89 PolarHBondContact O-N 2.85Å; K87-K89 PolarHBondContact O-N 3.04Å; K89-I91 VanDerWaalsContact C-N 3.34Å; K89-I91 PolarHBondContact O-N 3.47Å; K89-V92 PolarHBondContact O-N 2.94Å; K89-Y93 HydrophobicContact CB-CD2 4.22Å; K89-Y93 HydrophobicContact CB-CE2 4.09Å; K89-Y93 WeakPolarHBondContact O-CD2 3.26Å; K89-Y93 PolarHBondContact O-N 3.4Å
90	T	91.6	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-45.7	175.1	-59.6	0	0	0	0	111.5	I80 A81 G86 K87 L94	I80-T90 HydrophobicContact CG2-CG2 4.24Å; A81-T90 WeakPolarHBondContact CA-OG1 3.45Å; A81-T90 HydrophobicContact CB-CG2 4.08Å; A81-T90 PolarHBondContact N-OG1 3.44Å; G86-T90 PolarHBondContact O-N 3.34Å; G86-T90 PolarHBondContact O-OG1 3.46Å; G86-T90 VanDerWaalsContact O-OG1 3.13Å; K87-T90 PolarHBondContact O-N 2.96Å; T90-L94 HydrophobicContact CG2-CD1 3.6Å; T90-L94 HydrophobicContact CG2-CG 4.31Å; T90-L94 VanDerWaalsContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CB 3.37Å; T90-L94 WeakPolarHBondContact O-CG 3.25Å; T90-L94 PolarHBondContact O-N 3.1Å
91	I	92.5	Very high	91.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-52.3	175.9	-66.1	162.2	0	0	0	109.9	K87 F88 K89 Y93 S95 C149 V150 F153 F223	K87-I91 WeakPolarHBondContact O-CD1 3.48Å; K87-I91 VanDerWaalsContact O-CG1 3.24Å; K87-I91 WeakPolarHBondContact O-CG1 3.47Å; K87-I91 PolarHBondContact O-N 2.92Å; F88-I91 PolarHBondContact O-N 2.68Å; K89-I91 VanDerWaalsContact C-N 3.34Å; K89-I91 PolarHBondContact O-N 3.47Å; I91-Y93 PolarHBondContact O-N 3.29Å; I91-S95 WeakPolarHBondContact O-CB 3.44Å; I91-S95 PolarHBondContact O-N 3.08Å; I91-S95 PolarHBondContact O-OG 3.48Å; I91-C149 HydrophobicContact CD1-CB 3.98Å; I91-C149 HydrophobicContact CG1-CB 3.59Å; I91-V150 HydrophobicContact CD1-CG2 4.04Å; I91-V150 HydrophobicContact CG1-CG2 4.02Å; I91-V150 HydrophobicContact CG2-CG2 4.18Å; I91-F153 HydrophobicContact CD1-CB 3.84Å; I91-F153 HydrophobicContact CD1-CD1 4.15Å; I91-F153 HydrophobicContact CD1-CG 4.01Å; I91-F223 HydrophobicContact CB-CE1 3.99Å; I91-F223 HydrophobicContact CB-CZ 4.13Å; I91-F223 HydrophobicContact CD1-CZ 3.86Å; I91-F223 HydrophobicContact CG2-CD1 4.03Å; I91-F223 HydrophobicContact CG2-CE1 3.52Å; I91-F223 HydrophobicContact CG2-CE2 4.3Å; I91-F223 HydrophobicContact CG2-CZ 3.68Å
92	V	95.3	Very high	91.7	Very high	21 Å²	21	43.1 Å²	43.1	13%	0.127	21%	0.21	C	C	.	.	H	α-helix	trans	-59.4	-51.5	-178	172.3	0	0	0	0	112.5	F88 K89 S95 I96 L220 F223 I224	F88-V92 HydrophobicContact CE1-CG2 4.19Å; F88-V92 HydrophobicContact CE2-CG2 4.14Å; F88-V92 HydrophobicContact CZ-CG2 3.88Å; F88-V92 WeakPolarHBondContact O-CG2 3.41Å; F88-V92 PolarHBondContact O-N 3.34Å; F88-V92 VanDerWaalsContact O-N 3.11Å; K89-V92 PolarHBondContact O-N 2.94Å; V92-S95 PolarHBondContact O-N 3.4Å; V92-I96 HydrophobicContact CG1-CD1 4.15Å; V92-I96 WeakPolarHBondContact O-CG1 3.37Å; V92-I96 PolarHBondContact O-N 2.86Å; V92-L220 HydrophobicContact CG1-CD1 4.44Å; V92-F223 HydrophobicContact CG2-CD1 4.04Å; V92-F223 HydrophobicContact CG2-CE1 4.04Å; V92-I224 HydrophobicContact CG1-CD1 4.2Å; V92-I224 HydrophobicContact CG1-CG1 4.36Å; V92-I224 HydrophobicContact CG2-CG1 4.19Å
93	Y	95.4	Very high	92.4	Very high	130 Å²	130	45 Å²	45	51%	0.51	22%	0.222	S	C	.	.	H	α-helix	trans	-66.2	-41.7	-176.4	-71.3	-58	0	0	0	112.6	L85 K89 I91 I96 V97	L85-Y93 HydrophobicContact CD1-CD2 4.06Å; K89-Y93 HydrophobicContact CB-CD2 4.22Å; K89-Y93 HydrophobicContact CB-CE2 4.09Å; K89-Y93 WeakPolarHBondContact O-CD2 3.26Å; K89-Y93 PolarHBondContact O-N 3.4Å; I91-Y93 PolarHBondContact O-N 3.29Å; Y93-I96 PolarHBondContact O-N 2.85Å; Y93-V97 WeakPolarHBondContact O-CG2 2.77Å; Y93-V97 PolarHBondContact O-N 3.27Å; Y93-V97 VanDerWaalsContact O-N 3.14Å
94	L	95.1	Very high	93.2	Very high	28 Å²	28	43.9 Å²	43.9	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-73.8	-30.4	178.8	-66.1	179	0	0	0	112.3	T90 I96 V97 Y98 G142 I146	T90-L94 HydrophobicContact CG2-CD1 3.6Å; T90-L94 HydrophobicContact CG2-CG 4.31Å; T90-L94 VanDerWaalsContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CB 3.37Å; T90-L94 WeakPolarHBondContact O-CG 3.25Å; T90-L94 PolarHBondContact O-N 3.1Å; L94-I96 VanDerWaalsContact C-N 3.34Å; L94-V97 PolarHBondContact O-N 2.89Å; L94-Y98 WeakPolarHBondContact O-CB 3.31Å; L94-Y98 PolarHBondContact O-N 3.22Å; L94-G142 WeakPolarHBondContact O-CA 3.27Å; L94-I146 HydrophobicContact CB-CG2 3.62Å
95	S	95.6	Very high	93.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.9	-32.4	170	-70.7	0	0	0	0	112.6	I91 V92 Y98 A99	I91-S95 WeakPolarHBondContact O-CB 3.44Å; I91-S95 PolarHBondContact O-N 3.08Å; I91-S95 PolarHBondContact O-OG 3.48Å; V92-S95 PolarHBondContact O-N 3.4Å; S95-Y98 PolarHBondContact O-N 3.03Å; S95-A99 WeakPolarHBondContact O-CB 3.32Å; S95-A99 PolarHBondContact O-N 3.12Å
96	I	97	Very high	94.5	Very high	73 Å²	73	33.1 Å²	33.1	37%	0.374	17%	0.17	S	C	.	.	H	α-helix	trans	-64.4	-48.8	170.6	-69.1	163.1	0	0	0	110.1	V92 Y93 L94 Y98 A99 V100 L220	V92-I96 HydrophobicContact CG1-CD1 4.15Å; V92-I96 WeakPolarHBondContact O-CG1 3.37Å; V92-I96 PolarHBondContact O-N 2.86Å; Y93-I96 PolarHBondContact O-N 2.85Å; L94-I96 VanDerWaalsContact C-N 3.34Å; I96-Y98 PolarHBondContact O-N 3.14Å; I96-A99 PolarHBondContact O-N 2.91Å; I96-V100 HydrophobicContact CG2-CG2 4.44Å; I96-V100 WeakPolarHBondContact O-CG2 3.4Å; I96-V100 PolarHBondContact O-N 3.44Å; I96-L220 HydrophobicContact CB-CD2 4.49Å; I96-L220 HydrophobicContact CG1-CD1 4.38Å; I96-L220 HydrophobicContact CG1-CD2 3.6Å
97	V	97.2	Very high	94.9	Very high	47 Å²	47	35.4 Å²	35.4	29%	0.285	18%	0.182	S	C	.	.	H	α-helix	trans	-57.1	-42.3	176.1	173	0	0	0	0	110.7	Y93 L94 V100 G101 L138	Y93-V97 WeakPolarHBondContact O-CG2 2.77Å; Y93-V97 PolarHBondContact O-N 3.27Å; Y93-V97 VanDerWaalsContact O-N 3.14Å; L94-V97 PolarHBondContact O-N 2.89Å; V97-V100 PolarHBondContact O-N 3.2Å; V97-G101 PolarHBondContact O-N 2.95Å; V97-L138 HydrophobicContact CG1-CB 4.18Å; V97-L138 HydrophobicContact CG1-CD2 3.91Å
98	Y	96.6	Very high	95.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.9	-50.5	176.2	-166.5	179.2	0	0	0	111.7	E33 S36 Y37 L94 S95 I96 V100 G101 Q102 I139 I146 M216	E33-Y98 HydrophobicContact CG-CE1 3.92Å; S36-Y98 PolarHBondContact OG-OH 3.31Å; Y37-Y98 WeakPolarHBondContact CA-OH 3.22Å; Y37-Y98 PolarHBondContact N-OH 3.32Å; L94-Y98 WeakPolarHBondContact O-CB 3.31Å; L94-Y98 PolarHBondContact O-N 3.22Å; S95-Y98 PolarHBondContact O-N 3.03Å; I96-Y98 PolarHBondContact O-N 3.14Å; Y98-V100 VanDerWaalsContact C-N 3.33Å; Y98-V100 PolarHBondContact O-N 3.47Å; Y98-G101 PolarHBondContact O-N 3.06Å; Y98-G101 VanDerWaalsContact O-N 3.13Å; Y98-Q102 HydrophobicContact CD2-CG 3.85Å; Y98-Q102 HydrophobicContact CE2-CG 3.56Å; Y98-Q102 PolarHBondContact O-N 2.9Å; Y98-I139 HydrophobicContact CD2-CB 4.17Å; Y98-I139 HydrophobicContact CD2-CG1 3.98Å; Y98-I139 HydrophobicContact CD2-CG2 3.97Å; Y98-I139 HydrophobicContact CE2-CB 4.13Å; Y98-I139 HydrophobicContact CE2-CG1 4Å; Y98-I139 HydrophobicContact CE2-CG2 3.48Å; Y98-I139 VanDerWaalsContact CE2-CG2 3.48Å; Y98-I146 HydrophobicContact CD1-CD1 3.98Å; Y98-I146 HydrophobicContact CE1-CD1 4.37Å; Y98-M216 HydrophobicContact CD1-CE 3.55Å; Y98-M216 HydrophobicContact CD1-CG 4.33Å; Y98-M216 HydrophobicContact CD1-SD 3.74Å; Y98-M216 HydrophobicContact CE1-CE 4.23Å; Y98-M216 HydrophobicContact CE1-SD 3.87Å; Y98-M216 HydrophobicContact CG-CE 4.08Å; Y98-M216 HydrophobicContact CG-CG 4.33Å; Y98-M216 HydrophobicContact CG-SD 4.32Å
99	A	96.9	Very high	95.2	Very high	7 Å²	7	32 Å²	32	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-43	179.4	0	0	0	0	0	112	S95 I96 G101 Q102 V103 M216 V217	S95-A99 WeakPolarHBondContact O-CB 3.32Å; S95-A99 PolarHBondContact O-N 3.12Å; I96-A99 PolarHBondContact O-N 2.91Å; A99-G101 PolarHBondContact O-N 2.91Å; A99-Q102 PolarHBondContact O-N 3.45Å; A99-V103 WeakPolarHBondContact O-CG2 3.35Å; A99-V103 PolarHBondContact O-N 2.88Å; A99-M216 HydrophobicContact CB-CG 4.31Å; A99-V217 HydrophobicContact CB-CG2 4.02Å
100	V	97.8	Very high	95.2	Very high	72 Å²	72	29.2 Å²	29.2	44%	0.436	16%	0.157	S	C	.	.	H	α-helix	trans	-61.2	-44.3	174.6	172.5	0	0	0	0	111.1	I96 V97 Y98 Q102 V103 I104 L138	I96-V100 HydrophobicContact CG2-CG2 4.44Å; I96-V100 WeakPolarHBondContact O-CG2 3.4Å; I96-V100 PolarHBondContact O-N 3.44Å; V97-V100 PolarHBondContact O-N 3.2Å; Y98-V100 VanDerWaalsContact C-N 3.33Å; Y98-V100 PolarHBondContact O-N 3.47Å; V100-Q102 PolarHBondContact O-N 3.4Å; V100-V103 PolarHBondContact O-N 3.28Å; V100-I104 HydrophobicContact CG1-CD1 3.79Å; V100-I104 HydrophobicContact CG1-CG1 4.42Å; V100-I104 WeakPolarHBondContact O-CG1 3.29Å; V100-I104 PolarHBondContact O-N 3.21Å; V100-L138 HydrophobicContact CG1-CD1 4.31Å
101	G	97.8	Very high	94.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-44.7	176.3	0	0	0	0	0	113.2	V97 Y98 A99 I104 M105	V97-G101 PolarHBondContact O-N 2.95Å; Y98-G101 PolarHBondContact O-N 3.06Å; Y98-G101 VanDerWaalsContact O-N 3.13Å; A99-G101 PolarHBondContact O-N 2.91Å; G101-I104 PolarHBondContact O-N 3.24Å; G101-M105 WeakPolarHBondContact O-CB 3.34Å; G101-M105 PolarHBondContact O-N 3.34Å
102	Q	96.6	Very high	94.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-38.4	176.5	-72.6	-73.5	22.4	0	0	112.6	S36 Y98 A99 V100 M105 A106 I139 A213	S36-Q102 PolarHBondContact OG-NE2 3.41Å; Y98-Q102 HydrophobicContact CD2-CG 3.85Å; Y98-Q102 HydrophobicContact CE2-CG 3.56Å; Y98-Q102 PolarHBondContact O-N 2.9Å; A99-Q102 PolarHBondContact O-N 3.45Å; V100-Q102 PolarHBondContact O-N 3.4Å; Q102-M105 PolarHBondContact O-N 3Å; Q102-A106 PolarHBondContact O-N 2.85Å; Q102-I139 HydrophobicContact CG-CD1 4.15Å; Q102-I139 HydrophobicContact CG-CG1 4.08Å; Q102-A213 HydrophobicContact CB-CB 3.67Å
103	V	97.1	Very high	93.6	Very high	69 Å²	69	35.5 Å²	35.5	42%	0.418	19%	0.188	S	C	.	.	H	α-helix	trans	-65	-44.1	175.6	170.5	0	0	0	0	110.7	A99 V100 M105 A106 V107 A213	A99-V103 WeakPolarHBondContact O-CG2 3.35Å; A99-V103 PolarHBondContact O-N 2.88Å; V100-V103 PolarHBondContact O-N 3.28Å; V103-M105 VanDerWaalsContact C-N 3.29Å; V103-M105 PolarHBondContact O-N 3.49Å; V103-A106 PolarHBondContact O-N 3.05Å; V103-V107 HydrophobicContact CG1-CG2 4.49Å; V103-V107 VanDerWaalsContact O-CG2 3.31Å; V103-V107 WeakPolarHBondContact O-CG2 3.44Å; V103-V107 PolarHBondContact O-N 2.9Å; V103-A213 HydrophobicContact CG2-CB 4.3Å
104	I	96.9	Very high	93	Very high	40 Å²	40	30.4 Å²	30.4	21%	0.205	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-42	175.3	-69.3	168.1	0	0	0	110.5	V100 G101 V107 S108 L131 V134 L138	V100-I104 HydrophobicContact CG1-CD1 3.79Å; V100-I104 HydrophobicContact CG1-CG1 4.42Å; V100-I104 WeakPolarHBondContact O-CG1 3.29Å; V100-I104 PolarHBondContact O-N 3.21Å; G101-I104 PolarHBondContact O-N 3.24Å; I104-V107 PolarHBondContact O-N 3.25Å; I104-S108 WeakPolarHBondContact O-CB 3.5Å; I104-S108 PolarHBondContact O-N 3.48Å; I104-L131 HydrophobicContact CG2-CB 4.19Å; I104-L131 HydrophobicContact CG2-CD2 4.28Å; I104-L131 VanDerWaalsContact CG2-O 3.23Å; I104-L131 WeakPolarHBondContact CG2-O 3.26Å; I104-V134 HydrophobicContact CD1-CG1 4.37Å; I104-L138 HydrophobicContact CD1-CD1 3.74Å
105	M	95.3	Very high	92.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-37.7	176.8	-167.8	65.5	-127.4	0	0	112.8	Y47 G101 Q102 V103 S108 A109 S132 L136 I139 F209	Y47-M105 HydrophobicContact CD1-CE 3.77Å; Y47-M105 HydrophobicContact CE1-CE 3.25Å; Y47-M105 HydrophobicContact CE2-CE 4.29Å; Y47-M105 HydrophobicContact CG-CE 4.5Å; G101-M105 WeakPolarHBondContact O-CB 3.34Å; G101-M105 PolarHBondContact O-N 3.34Å; Q102-M105 PolarHBondContact O-N 3Å; V103-M105 VanDerWaalsContact C-N 3.29Å; V103-M105 PolarHBondContact O-N 3.49Å; M105-S108 WeakPolarHBondContact CE-OG 3.4Å; M105-S108 PolarHBondContact O-OG 2.95Å; M105-A109 PolarHBondContact O-N 3.01Å; M105-S132 WeakPolarHBondContact CE-OG 3.42Å; M105-L136 HydrophobicContact SD-CD2 4.4Å; M105-L136 HydrophobicContact SD-CG 4.24Å; M105-I139 HydrophobicContact CB-CD1 4.16Å; M105-I139 HydrophobicContact CG-CD1 4.47Å; M105-F209 HydrophobicContact CE-CD2 4.05Å; M105-F209 HydrophobicContact CE-CE2 3.59Å; M105-F209 HydrophobicContact CE-CZ 3.98Å; M105-F209 HydrophobicContact CG-CD1 4.35Å; M105-F209 HydrophobicContact CG-CD2 4.19Å; M105-F209 HydrophobicContact CG-CE2 4.44Å; M105-F209 HydrophobicContact CG-CG 4.14Å
106	A	95.3	Very high	91.4	Very high	13 Å²	13	32.6 Å²	32.6	11%	0.107	20%	0.198	C	C	.	.	H	α-helix	trans	-68	-40.2	175	0	0	0	0	0	111.9	Q102 V103 A109 F209	Q102-A106 PolarHBondContact O-N 2.85Å; V103-A106 PolarHBondContact O-N 3.05Å; A106-A109 PolarHBondContact O-N 3.36Å; A106-F209 HydrophobicContact CB-CB 4.01Å
107	V	93.6	Very high	90.6	Very high	57 Å²	57	33.1 Å²	33.1	35%	0.345	20%	0.202	S	C	.	.	H	α-helix	trans	-67.1	-39.2	176.1	172.2	0	0	0	0	111.1	V103 I104 A109 I110 I113	V103-V107 HydrophobicContact CG1-CG2 4.49Å; V103-V107 VanDerWaalsContact O-CG2 3.31Å; V103-V107 WeakPolarHBondContact O-CG2 3.44Å; V103-V107 PolarHBondContact O-N 2.9Å; I104-V107 PolarHBondContact O-N 3.25Å; V107-A109 PolarHBondContact O-N 2.92Å; V107-A109 VanDerWaalsContact O-N 3.14Å; V107-I110 PolarHBondContact O-N 3.32Å; V107-I110 VanDerWaalsContact O-N 3.14Å; V107-I113 HydrophobicContact CG1-CD1 3.58Å; V107-I113 WeakPolarHBondContact O-CD1 3.45Å
108	S	93.3	Very high	89.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-14.3	179	75	0	0	0	0	113.6	Y47 F51 I104 M105 H128 S132	Y47-S108 PolarHBondContact OH-O 3.36Å; F51-S108 WeakPolarHBondContact CZ-O 3.46Å; I104-S108 WeakPolarHBondContact O-CB 3.5Å; I104-S108 PolarHBondContact O-N 3.48Å; M105-S108 WeakPolarHBondContact CE-OG 3.4Å; M105-S108 PolarHBondContact O-OG 2.95Å; S108-H128 PolarHBondContact O-ND1 3.37Å; S108-S132 VanDerWaalsContact CB-OG 3.27Å; S108-S132 WeakPolarHBondContact CB-OG 3.32Å; S108-S132 PolarHBondContact OG-OG 3.45Å
109	A	91.5	Very high	88.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	0.6	176.4	0	0	0	0	0	114.3	Y47 F51 M105 A106 V107 H111 P206 F209	Y47-A109 HydrophobicContact CE2-CB 3.93Å; F51-A109 WeakPolarHBondContact CE2-O 3.23Å; M105-A109 PolarHBondContact O-N 3.01Å; A106-A109 PolarHBondContact O-N 3.36Å; V107-A109 PolarHBondContact O-N 2.92Å; V107-A109 VanDerWaalsContact O-N 3.14Å; A109-H111 PolarHBondContact O-N 3.21Å; A109-P206 HydrophobicContact CB-CG 4.18Å; A109-P206 VanDerWaalsContact O-CD 3.3Å; A109-P206 WeakPolarHBondContact O-CD 3.44Å; A109-P206 WeakPolarHBondContact O-CG 3.4Å; A109-F209 HydrophobicContact CB-CD2 3.76Å; A109-F209 HydrophobicContact CB-CE2 4.13Å
110	I	89.9	Confident	87.4	Confident	56 Å²	56	40.3 Å²	40.3	29%	0.287	23%	0.232	S	C	.	.			trans	-88.5	107.3	-177.8	-58	171.8	0	0	0	110.1	V107 D112 I113 H128 P206	V107-I110 PolarHBondContact O-N 3.32Å; V107-I110 VanDerWaalsContact O-N 3.14Å; I110-D112 VanDerWaalsContact C-N 3.33Å; I110-D112 HydrophobicContact CG2-CB 4.17Å; I110-D112 PolarHBondContact O-N 2.96Å; I110-I113 HydrophobicContact CB-CD1 3.76Å; I110-I113 HydrophobicContact CB-CG1 3.89Å; I110-I113 HydrophobicContact CD1-CD1 4.2Å; I110-I113 HydrophobicContact CG1-CD1 4.46Å; I110-I113 HydrophobicContact CG2-CD1 4.22Å; I110-I113 HydrophobicContact CG2-CG1 3.81Å; I110-I113 PolarHBondContact O-N 3.5Å; I110-H128 PolarHBondContact O-CE1 2.98Å; I110-H128 VanDerWaalsContact O-CE1 3.23Å; I110-P206 HydrophobicContact CB-CG 4.37Å; I110-P206 HydrophobicContact CG1-CB 3.9Å; I110-P206 HydrophobicContact CG1-CG 3.78Å
111	H	82.8	Confident	86.4	Confident	31 Å²	31	40.6 Å²	40.6	14%	0.144	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-55	-47.1	177.5	-75.8	-120.1	0	0	0	112.2	F51 A109 I113 T114 D115 G120	F51-H111 AromaticContact CD2-CD2 3.74Å; F51-H111 AromaticContact CD2-NE2 3.14Å; F51-H111 WeakPolarHBondContact CD2-NE2 3.5Å; F51-H111 AromaticContact CE2-CD2 3.14Å; F51-H111 WeakPolarHBondContact CE2-CD2 3.44Å; F51-H111 AromaticContact CE2-NE2 3.07Å; F51-H111 WeakPolarHBondContact CE2-NE2 3.33Å; A109-H111 PolarHBondContact O-N 3.21Å; H111-I113 PolarHBondContact O-N 2.84Å; H111-T114 PolarHBondContact O-N 3.42Å; H111-T114 VanDerWaalsContact O-N 3.12Å; H111-D115 WeakPolarHBondContact O-CB 3.31Å; H111-D115 PolarHBondContact O-N 2.92Å; H111-D115 VanDerWaalsContact O-N 3.09Å; H111-G120 PolarHBondContact CE1-O 3.27Å; H111-G120 PolarHBondContact ND1-O 3.34Å
112	D	80.9	Confident	85.6	Confident	41 Å²	41	41.3 Å²	41.3	22%	0.219	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-58.2	-12.6	-174.5	-64.6	-27.7	0	0	0	114.7	I110 I198	I110-D112 VanDerWaalsContact C-N 3.33Å; I110-D112 HydrophobicContact CG2-CB 4.17Å; I110-D112 PolarHBondContact O-N 2.96Å; D112-I198 VanDerWaalsContact OD2-CB 3.27Å; D112-I198 WeakPolarHBondContact OD2-CB 3.3Å; D112-I198 WeakPolarHBondContact OD2-CG1 3.46Å; D112-I198 PolarHBondContact OD2-N 3.37Å
113	I	83.8	Confident	85	Confident	81 Å²	81	45.7 Å²	45.7	42%	0.415	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-69.4	-36.4	177.4	-66.7	177.4	0	0	0	111.5	V107 I110 H111	V107-I113 HydrophobicContact CG1-CD1 3.58Å; V107-I113 WeakPolarHBondContact O-CD1 3.45Å; I110-I113 HydrophobicContact CB-CD1 3.76Å; I110-I113 HydrophobicContact CB-CG1 3.89Å; I110-I113 HydrophobicContact CD1-CD1 4.2Å; I110-I113 HydrophobicContact CG1-CD1 4.46Å; I110-I113 HydrophobicContact CG2-CD1 4.22Å; I110-I113 HydrophobicContact CG2-CG1 3.81Å; I110-I113 PolarHBondContact O-N 3.5Å; H111-I113 PolarHBondContact O-N 2.84Å
114	T	81.8	Confident	84.5	Confident	23 Å²	23	46.1 Å²	46.1	14%	0.141	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-1.8	-177.8	70.7	0	0	0	0	113.8	H111 G116 P122 D123 N124 L127 H128	H111-T114 PolarHBondContact O-N 3.42Å; H111-T114 VanDerWaalsContact O-N 3.12Å; T114-G116 PolarHBondContact O-N 3.33Å; T114-G116 VanDerWaalsContact O-N 3.09Å; T114-P122 VanDerWaalsContact OG1-CB 3.23Å; T114-P122 WeakPolarHBondContact OG1-CB 3.4Å; T114-D123 WeakPolarHBondContact O-CB 3.39Å; T114-D123 PolarHBondContact O-N 3.33Å; T114-D123 VanDerWaalsContact O-OD2 3.07Å; T114-N124 HydrophobicContact CG2-CB 4.15Å; T114-N124 PolarHBondContact OG1-N 3.09Å; T114-L127 HydrophobicContact CG2-CD2 3.65Å; T114-H128 PolarHBondContact OG1-CD2 3.04Å; T114-H128 PolarHBondContact OG1-NE2 3.09Å
115	D	79.6	Confident	84.2	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.053	27%	0.265	C	S	.	.			trans	-78.8	82.8	172.6	-177.1	4.7	0	0	0	110.9	H111 N117 K118 D119 G120	H111-D115 WeakPolarHBondContact O-CB 3.31Å; H111-D115 PolarHBondContact O-N 2.92Å; H111-D115 VanDerWaalsContact O-N 3.09Å; D115-N117 PolarHBondContact OD1-OD1 2.81Å; D115-K118 WeakPolarHBondContact OD1-CA 3.46Å; D115-K118 PolarHBondContact OD1-N 3Å; D115-D119 PolarHBondContact OD1-N 2.74Å; D115-G120 VanDerWaalsContact OD2-CA 3.23Å; D115-G120 WeakPolarHBondContact OD2-CA 3.33Å; D115-G120 PolarHBondContact OD2-N 2.97Å
116	G	77.4	Confident	84	Confident	65 Å²	65	51.9 Å²	51.9	67%	0.67	30%	0.296	S	S	*	.	S	Bend	trans	-79.3	-26.5	178	0	0	0	0	0	113.1	T114 D123	T114-G116 PolarHBondContact O-N 3.33Å; T114-G116 VanDerWaalsContact O-N 3.09Å; G116-D123 WeakPolarHBondContact CA-OD2 3.4Å; G116-D123 PolarHBondContact N-OD2 3.42Å
117	N	79.6	Confident	83.8	Confident	84 Å²	84	54.6 Å²	54.6	45%	0.449	31%	0.308	S	S	.	.	S	Bend	trans	-87.8	-12.2	-177.2	73.5	18.8	0	0	0	113.2	D115 D119 D123	D115-N117 PolarHBondContact OD1-OD1 2.81Å; N117-D119 VanDerWaalsContact C-N 3.31Å; N117-D119 VanDerWaalsContact CG-CG 3.5Å; N117-D119 PolarHBondContact ND2-OD2 3.35Å; N117-D119 VanDerWaalsContact OD1-CB 3.29Å; N117-D119 WeakPolarHBondContact OD1-CB 3.39Å; N117-D119 PolarHBondContact OD1-N 3.46Å; N117-D119 PolarHBondContact OD1-OD1 2.94Å; N117-D119 VanDerWaalsContact OD1-OD1 3.11Å; N117-D119 PolarHBondContact OD1-OD2 3.37Å; N117-D123 PolarHBondContact ND2-OD1 2.95Å
118	K	79.4	Confident	83.9	Confident	118 Å²	118	51.9 Å²	51.9	51%	0.513	29%	0.292	S	S	.	.			trans	62.8	30.8	179.5	-55.7	179	-179.7	178.3	0	113.9	D115 G120 H199 T200	D115-K118 WeakPolarHBondContact OD1-CA 3.46Å; D115-K118 PolarHBondContact OD1-N 3Å; K118-G120 VanDerWaalsContact C-N 3.31Å; K118-H199 HydrophobicContact CD-CB 4.36Å; K118-H199 HydrophobicContact CG-CB 4.37Å; K118-T200 VanDerWaalsContact O-CG2 3.31Å; K118-T200 WeakPolarHBondContact O-CG2 3.33Å
119	D	73.1	Confident	83.9	Confident	85 Å²	85	53.7 Å²	53.7	46%	0.455	30%	0.303	S	S	.	.	S	Bend	trans	-86	-5.1	176.1	71.9	15.3	0	0	0	112.9	D115 N117 T121	D115-D119 PolarHBondContact OD1-N 2.74Å; N117-D119 VanDerWaalsContact C-N 3.31Å; N117-D119 VanDerWaalsContact CG-CG 3.5Å; N117-D119 PolarHBondContact ND2-OD2 3.35Å; N117-D119 VanDerWaalsContact OD1-CB 3.29Å; N117-D119 WeakPolarHBondContact OD1-CB 3.39Å; N117-D119 PolarHBondContact OD1-N 3.46Å; N117-D119 PolarHBondContact OD1-OD1 2.94Å; N117-D119 VanDerWaalsContact OD1-OD1 3.11Å; N117-D119 PolarHBondContact OD1-OD2 3.37Å; D119-T121 WeakPolarHBondContact OD1-CA 3.22Å; D119-T121 WeakPolarHBondContact OD1-CB 3.42Å; D119-T121 PolarHBondContact OD1-N 2.94Å; D119-T121 PolarHBondContact OD1-OG1 3.4Å; D119-T121 PolarHBondContact OD2-OG1 2.92Å
120	G	71.3	Confident	84.1	Confident	1 Å²	1	56 Å²	56	1%	0.01	32%	0.322	C	S	.	.	S	Bend	trans	86.2	5.9	-179.5	0	0	0	0	0	114	H111 D115 K118 T200	H111-G120 PolarHBondContact CE1-O 3.27Å; H111-G120 PolarHBondContact ND1-O 3.34Å; D115-G120 VanDerWaalsContact OD2-CA 3.23Å; D115-G120 WeakPolarHBondContact OD2-CA 3.33Å; D115-G120 PolarHBondContact OD2-N 2.97Å; K118-G120 VanDerWaalsContact C-N 3.31Å; G120-T200 VanDerWaalsContact CA-OG1 3.23Å; G120-T200 WeakPolarHBondContact CA-OG1 3.4Å
121	T	77.4	Confident	84.4	Confident	78 Å²	78	55.7 Å²	55.7	48%	0.479	32%	0.321	S	S	.	.	S	Bend	trans	-113.8	141.6	172.6	69.3	0	0	0	0	110.9	D119 D123	D119-T121 WeakPolarHBondContact OD1-CA 3.22Å; D119-T121 WeakPolarHBondContact OD1-CB 3.42Å; D119-T121 PolarHBondContact OD1-N 2.94Å; D119-T121 PolarHBondContact OD1-OG1 3.4Å; D119-T121 PolarHBondContact OD2-OG1 2.92Å; T121-D123 PolarHBondContact O-N 3.29Å
122	P	81.1	Confident	85.1	Confident	15 Å²	15	54.2 Å²	54.2	10%	0.097	31%	0.314	C	S	.	.			trans	-71.3	122.6	179.5	-13.4	28	0	0	0	111.5	F51 T114 N124 M125 H128	F51-P122 HydrophobicContact CZ-CG 4.36Å; T114-P122 VanDerWaalsContact OG1-CB 3.23Å; T114-P122 WeakPolarHBondContact OG1-CB 3.4Å; P122-N124 PolarHBondContact O-N 3.04Å; P122-M125 HydrophobicContact CG-CE 4.16Å; P122-H128 WeakPolarHBondContact CB-NE2 3.44Å
123	D	83.6	Confident	85.8	Confident	93 Å²	93	55 Å²	55	50%	0.497	32%	0.317	S	S	.	.	S	Bend	trans	-64.6	-26.3	179.2	-65.8	-52.7	0	0	0	112	T114 G116 N117 T121	T114-D123 WeakPolarHBondContact O-CB 3.39Å; T114-D123 PolarHBondContact O-N 3.33Å; T114-D123 VanDerWaalsContact O-OD2 3.07Å; G116-D123 WeakPolarHBondContact CA-OD2 3.4Å; G116-D123 PolarHBondContact N-OD2 3.42Å; N117-D123 PolarHBondContact ND2-OD1 2.95Å; T121-D123 PolarHBondContact O-N 3.29Å
124	N	87.1	Confident	86.5	Confident	78 Å²	78	54.7 Å²	54.7	42%	0.417	32%	0.319	S	S	.	.			trans	-122	77.5	179.7	-170.3	-15.6	0	0	0	112.3	T114 P122 T126 L127 H128	T114-N124 HydrophobicContact CG2-CB 4.15Å; T114-N124 PolarHBondContact OG1-N 3.09Å; P122-N124 PolarHBondContact O-N 3.04Å; N124-T126 PolarHBondContact O-N 3.41Å; N124-T126 WeakPolarHBondContact OD1-CB 3.33Å; N124-T126 PolarHBondContact OD1-N 3.47Å; N124-L127 PolarHBondContact O-N 3.35Å; N124-L127 PolarHBondContact OD1-N 2.83Å; N124-L127 VanDerWaalsContact OD1-N 3.15Å; N124-H128 PolarHBondContact O-CD2 3.17Å
125	M	89.7	Confident	87.2	Confident	54 Å²	54	53.6 Å²	53.6	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-57.2	-31.3	176.1	-171.7	54.4	70.4	0	0	113.2	F51 L52 P122 L127 H128 V129	F51-M125 VanDerWaalsContact O-CE 3.3Å; F51-M125 WeakPolarHBondContact O-CE 3.23Å; L52-M125 HydrophobicContact CD2-SD 3.78Å; P122-M125 HydrophobicContact CG-CE 4.16Å; M125-L127 VanDerWaalsContact C-N 3.3Å; M125-L127 PolarHBondContact O-N 2.93Å; M125-H128 PolarHBondContact O-N 3.29Å; M125-H128 HydrophobicContact SD-CB 4.24Å; M125-V129 HydrophobicContact CG-CG2 4.28Å; M125-V129 WeakPolarHBondContact O-CG2 3.35Å; M125-V129 PolarHBondContact O-N 3.34Å
126	T	91.3	Very high	88.1	Confident	107 Å²	107	53.5 Å²	53.5	66%	0.656	31%	0.312	S	S	*	.	H	α-helix	trans	-61.9	-37.4	179.7	-51.6	0	0	0	0	112.4	N124 A130	N124-T126 PolarHBondContact O-N 3.41Å; N124-T126 WeakPolarHBondContact OD1-CB 3.33Å; N124-T126 PolarHBondContact OD1-N 3.47Å; T126-A130 WeakPolarHBondContact O-CB 3.29Å; T126-A130 PolarHBondContact O-N 2.91Å
127	L	92.6	Very high	89.1	Confident	69 Å²	69	54.8 Å²	54.8	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-45.8	175.6	-179	66.1	0	0	0	111.1	T114 N124 M125 A130 L131	T114-L127 HydrophobicContact CG2-CD2 3.65Å; N124-L127 PolarHBondContact O-N 3.35Å; N124-L127 PolarHBondContact OD1-N 2.83Å; N124-L127 VanDerWaalsContact OD1-N 3.15Å; M125-L127 VanDerWaalsContact C-N 3.3Å; M125-L127 PolarHBondContact O-N 2.93Å; L127-A130 PolarHBondContact O-N 3.3Å; L127-L131 HydrophobicContact CD1-CD1 4.23Å; L127-L131 HydrophobicContact CD1-CG 4.26Å; L127-L131 HydrophobicContact CG-CD1 4.03Å; L127-L131 HydrophobicContact CG-CG 4.43Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.34Å
128	H	93.7	Very high	89.9	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-46.2	178.2	-70.5	-76.3	0	0	0	111.5	F51 L52 S108 I110 T114 P122 N124 M125 A130 L131 S132	F51-H128 HydrophobicContact CE1-CB 4.02Å; F51-H128 AromaticContact CE1-ND1 3.96Å; F51-H128 AromaticContact CZ-ND1 3.8Å; L52-H128 HydrophobicContact CD2-CB 4.19Å; S108-H128 PolarHBondContact O-ND1 3.37Å; I110-H128 PolarHBondContact O-CE1 2.98Å; I110-H128 VanDerWaalsContact O-CE1 3.23Å; T114-H128 PolarHBondContact OG1-CD2 3.04Å; T114-H128 PolarHBondContact OG1-NE2 3.09Å; P122-H128 WeakPolarHBondContact CB-NE2 3.44Å; N124-H128 PolarHBondContact O-CD2 3.17Å; M125-H128 PolarHBondContact O-N 3.29Å; M125-H128 HydrophobicContact SD-CB 4.24Å; H128-A130 PolarHBondContact O-N 3.42Å; H128-L131 PolarHBondContact O-N 3.11Å; H128-S132 VanDerWaalsContact O-CB 3.31Å; H128-S132 WeakPolarHBondContact O-CB 3.28Å; H128-S132 PolarHBondContact O-N 3.36Å; H128-S132 PolarHBondContact O-OG 3.43Å
129	V	94.9	Very high	90.8	Very high	37 Å²	37	47.2 Å²	47.2	22%	0.224	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-49.4	174.3	171.8	0	0	0	0	111.1	L52 W54 M125 L131 S132 M133	L52-V129 HydrophobicContact CD1-CG2 4.47Å; L52-V129 HydrophobicContact CD2-CG2 3.94Å; W54-V129 HydrophobicContact CH2-CG1 4.43Å; W54-V129 HydrophobicContact CZ2-CB 4.47Å; W54-V129 HydrophobicContact CZ2-CG1 3.85Å; W54-V129 HydrophobicContact CZ2-CG2 3.87Å; M125-V129 HydrophobicContact CG-CG2 4.28Å; M125-V129 WeakPolarHBondContact O-CG2 3.35Å; M125-V129 PolarHBondContact O-N 3.34Å; V129-L131 PolarHBondContact O-N 3.02Å; V129-S132 PolarHBondContact O-N 3Å; V129-M133 HydrophobicContact CG1-CG 4.34Å; V129-M133 WeakPolarHBondContact O-CG 3.44Å; V129-M133 PolarHBondContact O-N 3.08Å
130	A	95.5	Very high	91.9	Very high	49 Å²	49	43.1 Å²	43.1	41%	0.405	25%	0.246	S	C	.	.	H	α-helix	trans	-61.8	-46.2	-177.9	0	0	0	0	0	112.3	T126 L127 H128 M133 V134	T126-A130 WeakPolarHBondContact O-CB 3.29Å; T126-A130 PolarHBondContact O-N 2.91Å; L127-A130 PolarHBondContact O-N 3.3Å; H128-A130 PolarHBondContact O-N 3.42Å; A130-M133 PolarHBondContact O-N 3.43Å; A130-V134 WeakPolarHBondContact O-CG2 3.49Å; A130-V134 PolarHBondContact O-N 2.95Å
131	L	96.1	Very high	93.1	Very high	49 Å²	49	46.3 Å²	46.3	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-62.5	-44	176.9	-68.9	174.2	0	0	0	111.2	I104 L127 H128 V129 M133 V134 G135	I104-L131 HydrophobicContact CG2-CB 4.19Å; I104-L131 HydrophobicContact CG2-CD2 4.28Å; I104-L131 VanDerWaalsContact CG2-O 3.23Å; I104-L131 WeakPolarHBondContact CG2-O 3.26Å; L127-L131 HydrophobicContact CD1-CD1 4.23Å; L127-L131 HydrophobicContact CD1-CG 4.26Å; L127-L131 HydrophobicContact CG-CD1 4.03Å; L127-L131 HydrophobicContact CG-CG 4.43Å; L127-L131 WeakPolarHBondContact O-CG 3.5Å; L127-L131 PolarHBondContact O-N 3.34Å; H128-L131 PolarHBondContact O-N 3.11Å; V129-L131 PolarHBondContact O-N 3.02Å; L131-M133 PolarHBondContact O-N 3.13Å; L131-V134 PolarHBondContact O-N 3.09Å; L131-G135 PolarHBondContact O-N 2.86Å
132	S	96.3	Very high	93.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-43.8	177.6	-66.8	0	0	0	0	112.3	Y47 M105 S108 H128 V129 G135 L136	Y47-S132 PolarHBondContact OH-OG 2.92Å; M105-S132 WeakPolarHBondContact CE-OG 3.42Å; S108-S132 VanDerWaalsContact CB-OG 3.27Å; S108-S132 WeakPolarHBondContact CB-OG 3.32Å; S108-S132 PolarHBondContact OG-OG 3.45Å; H128-S132 VanDerWaalsContact O-CB 3.31Å; H128-S132 WeakPolarHBondContact O-CB 3.28Å; H128-S132 PolarHBondContact O-N 3.36Å; H128-S132 PolarHBondContact O-OG 3.43Å; V129-S132 PolarHBondContact O-N 3Å; S132-G135 PolarHBondContact O-N 2.84Å; S132-L136 WeakPolarHBondContact O-CB 3.33Å; S132-L136 VanDerWaalsContact O-CG 3.3Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.03Å
133	M	97	Very high	94.5	Very high	59 Å²	59	41.9 Å²	41.9	29%	0.291	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-40.3	178.3	-66.6	-52.6	97.3	0	0	112.3	F48 W54 I62 V129 A130 L131 L136 L137	F48-M133 HydrophobicContact CE1-CE 4.45Å; W54-M133 HydrophobicContact CH2-CE 3.63Å; W54-M133 HydrophobicContact CH2-SD 4.27Å; W54-M133 HydrophobicContact CZ3-CE 4.15Å; I62-M133 HydrophobicContact CG2-CE 4.12Å; I62-M133 HydrophobicContact CG2-SD 4.2Å; V129-M133 HydrophobicContact CG1-CG 4.34Å; V129-M133 WeakPolarHBondContact O-CG 3.44Å; V129-M133 PolarHBondContact O-N 3.08Å; A130-M133 PolarHBondContact O-N 3.43Å; L131-M133 PolarHBondContact O-N 3.13Å; M133-L136 HydrophobicContact CE-CD1 3.74Å; M133-L137 WeakPolarHBondContact O-CB 3.13Å; M133-L137 PolarHBondContact O-N 3.37Å
134	V	97.6	Very high	94.8	Very high	74 Å²	74	37.4 Å²	37.4	45%	0.448	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-44.7	173.9	171.7	0	0	0	0	110.6	I104 A130 L131 L137 L138	I104-V134 HydrophobicContact CD1-CG1 4.37Å; A130-V134 WeakPolarHBondContact O-CG2 3.49Å; A130-V134 PolarHBondContact O-N 2.95Å; L131-V134 PolarHBondContact O-N 3.09Å; V134-L137 PolarHBondContact O-N 3.36Å; V134-L138 HydrophobicContact CG1-CD1 3.94Å; V134-L138 HydrophobicContact CG1-CG 4.43Å; V134-L138 VanDerWaalsContact O-CG 3.28Å; V134-L138 WeakPolarHBondContact O-CG 3.28Å; V134-L138 PolarHBondContact O-N 3.43Å
135	G	97.6	Very high	94.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-52.3	176.5	0	0	0	0	0	112	L131 S132 L137 L138 I139	L131-G135 PolarHBondContact O-N 2.86Å; S132-G135 PolarHBondContact O-N 2.84Å; G135-L137 PolarHBondContact O-N 3.29Å; G135-L138 PolarHBondContact O-N 3.38Å; G135-I139 WeakPolarHBondContact O-CB 3.36Å; G135-I139 WeakPolarHBondContact O-CD1 3.38Å; G135-I139 WeakPolarHBondContact O-CG1 3.43Å; G135-I139 PolarHBondContact O-N 3.28Å
136	L	97.8	Very high	95	Very high	8 Å²	8	31.2 Å²	31.2	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-40.4	178.8	-71.1	172.7	0	0	0	113	M40 L44 F48 I62 F66 M105 S132 M133 I139 A140	M40-L136 HydrophobicContact SD-CD2 4.43Å; L44-L136 HydrophobicContact CD1-CD2 4.01Å; L44-L136 HydrophobicContact CD2-CD2 3.85Å; F48-L136 HydrophobicContact CE1-CD1 3.96Å; F48-L136 HydrophobicContact CZ-CD1 3.64Å; I62-L136 HydrophobicContact CG2-CD1 4.45Å; F66-L136 HydrophobicContact CD2-CB 3.98Å; F66-L136 HydrophobicContact CD2-CD2 3.78Å; F66-L136 HydrophobicContact CD2-CG 4.43Å; F66-L136 HydrophobicContact CE2-CB 4.48Å; F66-L136 HydrophobicContact CE2-CD2 3.95Å; F66-L136 HydrophobicContact CG-CD2 4.09Å; F66-L136 HydrophobicContact CZ-CD2 4.43Å; M105-L136 HydrophobicContact SD-CD2 4.4Å; M105-L136 HydrophobicContact SD-CG 4.24Å; S132-L136 WeakPolarHBondContact O-CB 3.33Å; S132-L136 VanDerWaalsContact O-CG 3.3Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.03Å; M133-L136 HydrophobicContact CE-CD1 3.74Å; L136-I139 PolarHBondContact O-N 2.97Å; L136-A140 WeakPolarHBondContact O-CB 3.41Å; L136-A140 PolarHBondContact O-N 2.93Å
137	L	97.8	Very high	94.7	Very high	91 Å²	91	27.5 Å²	27.5	48%	0.476	15%	0.153	S	C	.	.	H	α-helix	trans	-63.2	-45.9	176.7	-179.7	63.7	0	0	0	111.6	L69 M133 V134 G135 A140 L141	L69-L137 HydrophobicContact CD1-CD1 4.43Å; M133-L137 WeakPolarHBondContact O-CB 3.13Å; M133-L137 PolarHBondContact O-N 3.37Å; V134-L137 PolarHBondContact O-N 3.36Å; G135-L137 PolarHBondContact O-N 3.29Å; L137-A140 PolarHBondContact O-N 3.23Å; L137-L141 HydrophobicContact CG-CD1 4.32Å; L137-L141 VanDerWaalsContact O-CG 3.32Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 2.94Å
138	L	97.8	Very high	94.1	Very high	43 Å²	43	26.3 Å²	26.3	23%	0.225	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-41.3	177.6	-66.7	172.7	0	0	0	111.5	V97 V100 I104 V134 G135 L141 G142	V97-L138 HydrophobicContact CG1-CB 4.18Å; V97-L138 HydrophobicContact CG1-CD2 3.91Å; V100-L138 HydrophobicContact CG1-CD1 4.31Å; I104-L138 HydrophobicContact CD1-CD1 3.74Å; V134-L138 HydrophobicContact CG1-CD1 3.94Å; V134-L138 HydrophobicContact CG1-CG 4.43Å; V134-L138 VanDerWaalsContact O-CG 3.28Å; V134-L138 WeakPolarHBondContact O-CG 3.28Å; V134-L138 PolarHBondContact O-N 3.43Å; G135-L138 PolarHBondContact O-N 3.38Å; L138-L141 PolarHBondContact O-N 2.96Å; L138-G142 PolarHBondContact O-N 3.38Å
139	I	97.6	Very high	93.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-49.1	173.8	-70.7	164.3	0	0	0	110.1	M40 F66 Y98 Q102 M105 G135 L136 L141 G142 T143	M40-I139 HydrophobicContact CE-CD1 4.2Å; M40-I139 HydrophobicContact CE-CG2 3.9Å; F66-I139 HydrophobicContact CE2-CB 4.14Å; F66-I139 HydrophobicContact CE2-CG2 3.69Å; F66-I139 HydrophobicContact CZ-CG2 3.71Å; Y98-I139 HydrophobicContact CD2-CB 4.17Å; Y98-I139 HydrophobicContact CD2-CG1 3.98Å; Y98-I139 HydrophobicContact CD2-CG2 3.97Å; Y98-I139 HydrophobicContact CE2-CB 4.13Å; Y98-I139 HydrophobicContact CE2-CG1 4Å; Y98-I139 HydrophobicContact CE2-CG2 3.48Å; Y98-I139 VanDerWaalsContact CE2-CG2 3.48Å; Q102-I139 HydrophobicContact CG-CD1 4.15Å; Q102-I139 HydrophobicContact CG-CG1 4.08Å; M105-I139 HydrophobicContact CB-CD1 4.16Å; M105-I139 HydrophobicContact CG-CD1 4.47Å; G135-I139 WeakPolarHBondContact O-CB 3.36Å; G135-I139 WeakPolarHBondContact O-CD1 3.38Å; G135-I139 WeakPolarHBondContact O-CG1 3.43Å; G135-I139 PolarHBondContact O-N 3.28Å; L136-I139 PolarHBondContact O-N 2.97Å; I139-L141 PolarHBondContact O-N 3.47Å; I139-G142 PolarHBondContact O-N 3.48Å; I139-G142 VanDerWaalsContact O-N 3.12Å; I139-T143 HydrophobicContact CG2-CG2 4.5Å; I139-T143 VanDerWaalsContact O-CG2 3.31Å; I139-T143 WeakPolarHBondContact O-CG2 3.44Å; I139-T143 PolarHBondContact O-N 3.13Å
140	A	96.8	Very high	93.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-44.7	-178.5	0	0	0	0	0	112	F66 L69 T73 L136 L137 G142 G144	F66-A140 HydrophobicContact CD2-CB 4.16Å; F66-A140 HydrophobicContact CE2-CB 4.07Å; L69-A140 HydrophobicContact CB-CB 3.8Å; T73-A140 PolarHBondContact OG1-O 3.35Å; L136-A140 WeakPolarHBondContact O-CB 3.41Å; L136-A140 PolarHBondContact O-N 2.93Å; L137-A140 PolarHBondContact O-N 3.23Å; A140-G142 VanDerWaalsContact C-N 3.34Å; A140-G144 PolarHBondContact O-N 2.88Å; A140-G144 VanDerWaalsContact O-N 3.08Å
141	L	95.6	Very high	92.7	Very high	67 Å²	67	23.9 Å²	23.9	35%	0.351	13%	0.134	S	C	.	.	H	α-helix	trans	-61.9	-41.8	174.1	-69.8	169.8	0	0	0	112.1	T73 L137 L138 I139 G145	T73-L141 HydrophobicContact CG2-CD2 3.82Å; L137-L141 HydrophobicContact CG-CD1 4.32Å; L137-L141 VanDerWaalsContact O-CG 3.32Å; L137-L141 WeakPolarHBondContact O-CG 3.44Å; L137-L141 PolarHBondContact O-N 2.94Å; L138-L141 PolarHBondContact O-N 2.96Å; I139-L141 PolarHBondContact O-N 3.47Å; L141-G145 PolarHBondContact O-N 3.44Å
142	G	95.2	Very high	92	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.5	-67.3	179.9	0	0	0	0	0	112.9	L94 L138 I139 A140 G144 G145 I146	L94-G142 WeakPolarHBondContact O-CA 3.27Å; L138-G142 PolarHBondContact O-N 3.38Å; I139-G142 PolarHBondContact O-N 3.48Å; I139-G142 VanDerWaalsContact O-N 3.12Å; A140-G142 VanDerWaalsContact C-N 3.34Å; G142-G144 VanDerWaalsContact C-N 3.35Å; G142-G144 PolarHBondContact O-N 3.5Å; G142-G145 PolarHBondContact O-N 3.21Å; G142-I146 WeakPolarHBondContact O-CG1 3.35Å; G142-I146 WeakPolarHBondContact O-CG2 3.28Å; G142-I146 PolarHBondContact O-N 3.42Å; G142-I146 VanDerWaalsContact O-N 3.15Å
143	T	93.1	Very high	91.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-44.1	-178	-173	0	0	0	0	111.7	E33 Y37 C70 I139 G145 I146 K147	E33-T143 PolarHBondContact OE1-OG1 2.85Å; Y37-T143 HydrophobicContact CD2-CG2 3.99Å; Y37-T143 HydrophobicContact CE2-CG2 3.97Å; C70-T143 HydrophobicContact CB-CG2 4.11Å; I139-T143 HydrophobicContact CG2-CG2 4.5Å; I139-T143 VanDerWaalsContact O-CG2 3.31Å; I139-T143 WeakPolarHBondContact O-CG2 3.44Å; I139-T143 PolarHBondContact O-N 3.13Å; T143-G145 PolarHBondContact O-N 2.83Å; T143-I146 VanDerWaalsContact O-CG1 3.22Å; T143-I146 WeakPolarHBondContact O-CG1 3.44Å; T143-I146 PolarHBondContact O-N 3.1Å; T143-K147 VanDerWaalsContact O-CG 3.29Å; T143-K147 WeakPolarHBondContact O-CG 3.21Å; T143-K147 PolarHBondContact O-N 2.95Å; T143-K147 VanDerWaalsContact O-N 3.15Å
144	G	89.5	Confident	91	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.4	-45.2	-178.2	0	0	0	0	0	111.8	C70 T73 P74 A140 G142 I146 K147 P148	C70-G144 VanDerWaalsContact O-CA 3.24Å; C70-G144 WeakPolarHBondContact O-CA 3.41Å; T73-G144 WeakPolarHBondContact OG1-CA 3.42Å; P74-G144 WeakPolarHBondContact CA-O 3.31Å; P74-G144 WeakPolarHBondContact CB-O 3.38Å; P74-G144 VanDerWaalsContact CG-O 3.28Å; P74-G144 WeakPolarHBondContact CG-O 3.47Å; A140-G144 PolarHBondContact O-N 2.88Å; A140-G144 VanDerWaalsContact O-N 3.08Å; G142-G144 VanDerWaalsContact C-N 3.35Å; G142-G144 PolarHBondContact O-N 3.5Å; G144-I146 PolarHBondContact O-N 2.86Å; G144-K147 PolarHBondContact O-N 2.95Å; G144-P148 VanDerWaalsContact O-CD 3.29Å; G144-P148 WeakPolarHBondContact O-CD 3.35Å
145	G	89.4	Confident	90.2	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-74.2	-21.6	-177.8	0	0	0	0	0	115.1	G77 L141 G142 T143 C149	G77-G145 WeakPolarHBondContact CA-O 3.3Å; L141-G145 PolarHBondContact O-N 3.44Å; G142-G145 PolarHBondContact O-N 3.21Å; T143-G145 PolarHBondContact O-N 2.83Å; G145-C149 PolarHBondContact O-SG 3.12Å
146	I	90.9	Very high	89.5	Confident	1 Å²	1	19.7 Å²	19.7	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-81.1	-32.4	172.9	65.3	179.2	0	0	0	113.4	E33 L94 Y98 G142 T143 G144 C149 V150	E33-I146 HydrophobicContact CG-CD1 3.7Å; L94-I146 HydrophobicContact CB-CG2 3.62Å; Y98-I146 HydrophobicContact CD1-CD1 3.98Å; Y98-I146 HydrophobicContact CE1-CD1 4.37Å; G142-I146 WeakPolarHBondContact O-CG1 3.35Å; G142-I146 WeakPolarHBondContact O-CG2 3.28Å; G142-I146 PolarHBondContact O-N 3.42Å; G142-I146 VanDerWaalsContact O-N 3.15Å; T143-I146 VanDerWaalsContact O-CG1 3.22Å; T143-I146 WeakPolarHBondContact O-CG1 3.44Å; T143-I146 PolarHBondContact O-N 3.1Å; G144-I146 PolarHBondContact O-N 2.86Å; I146-C149 WeakPolarHBondContact O-CA 3.47Å; I146-C149 WeakPolarHBondContact O-CB 3.47Å; I146-C149 PolarHBondContact O-N 3.42Å; I146-V150 HydrophobicContact CB-CG2 4.23Å; I146-V150 PolarHBondContact O-N 3.45Å; I146-V150 VanDerWaalsContact O-N 3.1Å
147	K	85.5	Confident	89	Confident	28 Å²	28	20 Å²	20	12%	0.122	12%	0.119	C	C	.	.	H	α-helix	trans	-44.7	-52.8	-176.8	-86.6	173.5	-175	-175.2	0	114.7	T143 G144 C149	T143-K147 VanDerWaalsContact O-CG 3.29Å; T143-K147 WeakPolarHBondContact O-CG 3.21Å; T143-K147 PolarHBondContact O-N 2.95Å; T143-K147 VanDerWaalsContact O-N 3.15Å; G144-K147 PolarHBondContact O-N 2.95Å; K147-C149 VanDerWaalsContact C-N 3.25Å; K147-C149 PolarHBondContact O-N 2.89Å
148	P	80.4	Confident	88.3	Confident	45 Å²	45	16.3 Å²	16.3	29%	0.292	10%	0.099	S	C	.	.	H	α-helix	trans	-73.5	-19.4	-178.4	29.6	-34.5	0	0	0	112.9	P74 A78 G144	P74-P148 HydrophobicContact CB-CG 4.16Å; A78-P148 HydrophobicContact CB-CB 4.42Å; A78-P148 HydrophobicContact CB-CG 4.21Å; G144-P148 VanDerWaalsContact O-CD 3.29Å; G144-P148 WeakPolarHBondContact O-CD 3.35Å
149	C	83.9	Confident	87.5	Confident	3 Å²	3	18.2 Å²	18.2	2%	0.02	11%	0.11	C	C	.	.	H	α-helix	trans	-87.2	-40.7	-172.5	-59	0	0	0	0	112.5	I91 G145 I146 K147 F153	I91-C149 HydrophobicContact CD1-CB 3.98Å; I91-C149 HydrophobicContact CG1-CB 3.59Å; G145-C149 PolarHBondContact O-SG 3.12Å; I146-C149 WeakPolarHBondContact O-CA 3.47Å; I146-C149 WeakPolarHBondContact O-CB 3.47Å; I146-C149 PolarHBondContact O-N 3.42Å; K147-C149 VanDerWaalsContact C-N 3.25Å; K147-C149 PolarHBondContact O-N 2.89Å; C149-F153 WeakPolarHBondContact O-CB 3.49Å; C149-F153 PolarHBondContact O-N 3.43Å
150	V	88.4	Confident	86.4	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-67.5	-49.8	-170.5	178.3	0	0	0	0	112.1	I26 E30 I91 I146 A152 F153 G154 F173	I26-V150 HydrophobicContact CG2-CG1 4.19Å; E30-V150 WeakPolarHBondContact OE2-CG1 3.44Å; I91-V150 HydrophobicContact CD1-CG2 4.04Å; I91-V150 HydrophobicContact CG1-CG2 4.02Å; I91-V150 HydrophobicContact CG2-CG2 4.18Å; I146-V150 HydrophobicContact CB-CG2 4.23Å; I146-V150 PolarHBondContact O-N 3.45Å; I146-V150 VanDerWaalsContact O-N 3.1Å; V150-A152 VanDerWaalsContact C-N 3.33Å; V150-A152 PolarHBondContact O-N 3.15Å; V150-F153 PolarHBondContact O-N 3.43Å; V150-G154 PolarHBondContact O-N 3.46Å; V150-F173 HydrophobicContact CG1-CE2 4.19Å; V150-F173 HydrophobicContact CG1-CZ 4.32Å
151	A	82.9	Confident	85.6	Confident	31 Å²	31	33 Å²	33	26%	0.256	18%	0.183	S	C	.	.	H	α-helix	trans	-61.6	-42.6	178.7	0	0	0	0	0	111.7	G154 G155 F173	A151-G154 PolarHBondContact O-N 3.17Å; A151-G155 PolarHBondContact O-N 2.83Å; A151-G155 VanDerWaalsContact O-N 3.09Å; A151-F173 HydrophobicContact CB-CE1 4.02Å; A151-F173 HydrophobicContact CB-CZ 4.01Å
152	A	81.8	Confident	84.8	Confident	38 Å²	38	31.8 Å²	31.8	31%	0.314	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-39.6	176.4	0	0	0	0	0	112	K87 V150 G155 D156	K87-A152 HydrophobicContact CD-CB 4.31Å; V150-A152 VanDerWaalsContact C-N 3.33Å; V150-A152 PolarHBondContact O-N 3.15Å; A152-G155 PolarHBondContact O-N 3.41Å; A152-D156 VanDerWaalsContact O-CG 3.26Å; A152-D156 PolarHBondContact O-N 3.46Å; A152-D156 VanDerWaalsContact O-N 3.13Å
153	F	85.8	Confident	83.8	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-67.8	-36.6	178.1	-176.2	-109.1	0	0	0	112.7	I26 K87 F88 I91 C149 V150 D156 Q157 F223 Y230	I26-F153 HydrophobicContact CD1-CD1 3.94Å; I26-F153 HydrophobicContact CD1-CE1 4.12Å; K87-F153 HydrophobicContact CB-CB 4.39Å; K87-F153 HydrophobicContact CB-CD2 4.05Å; K87-F153 HydrophobicContact CD-CB 4.46Å; F88-F153 HydrophobicContact CB-CE2 3.83Å; F88-F153 HydrophobicContact CB-CZ 4Å; F88-F153 HydrophobicContact CD2-CE1 4.24Å; F88-F153 HydrophobicContact CD2-CE2 4.42Å; F88-F153 AromaticContact CD2-CZ 3.72Å; F88-F153 HydrophobicContact CD2-CZ 3.72Å; F88-F153 HydrophobicContact CG-CZ 4.3Å; I91-F153 HydrophobicContact CD1-CB 3.84Å; I91-F153 HydrophobicContact CD1-CD1 4.15Å; I91-F153 HydrophobicContact CD1-CG 4.01Å; C149-F153 WeakPolarHBondContact O-CB 3.49Å; C149-F153 PolarHBondContact O-N 3.43Å; V150-F153 PolarHBondContact O-N 3.43Å; F153-D156 PolarHBondContact O-N 3.37Å; F153-Q157 WeakPolarHBondContact O-CG 3.12Å; F153-Q157 PolarHBondContact O-NE2 3.31Å; F153-F223 AromaticContact CD1-CE2 3.97Å; F153-F223 HydrophobicContact CD1-CE2 3.97Å; F153-F223 AromaticContact CD1-CZ 3.77Å; F153-F223 HydrophobicContact CD1-CZ 3.77Å; F153-F223 AromaticContact CE1-CE2 3.86Å; F153-F223 HydrophobicContact CE1-CE2 3.86Å; F153-F223 AromaticContact CE1-CZ 3.54Å; F153-F223 HydrophobicContact CE1-CZ 3.54Å; F153-F223 HydrophobicContact CZ-CZ 4.39Å; F153-Y230 AromaticContact CE1-CD1 3.99Å; F153-Y230 HydrophobicContact CE1-CD1 3.99Å; F153-Y230 AromaticContact CE1-CD2 3.76Å; F153-Y230 HydrophobicContact CE1-CD2 3.76Å; F153-Y230 HydrophobicContact CE1-CE1 4.35Å; F153-Y230 HydrophobicContact CE1-CE2 4.11Å; F153-Y230 AromaticContact CE1-CG 3.72Å; F153-Y230 HydrophobicContact CE1-CG 3.72Å; F153-Y230 HydrophobicContact CZ-CD1 4.25Å; F153-Y230 AromaticContact CZ-CD2 3.69Å; F153-Y230 HydrophobicContact CZ-CD2 3.69Å; F153-Y230 HydrophobicContact CZ-CE2 4.46Å; F153-Y230 AromaticContact CZ-CG 3.59Å; F153-Y230 HydrophobicContact CZ-CG 3.59Å
154	G	85.4	Confident	83.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-41.6	172.1	0	0	0	0	0	112.8	V150 A151 D156 Q157	V150-G154 PolarHBondContact O-N 3.46Å; A151-G154 PolarHBondContact O-N 3.17Å; G154-D156 VanDerWaalsContact C-N 3.32Å; G154-D156 PolarHBondContact O-N 3.15Å; G154-Q157 WeakPolarHBondContact O-CB 3.46Å; G154-Q157 PolarHBondContact O-N 3.42Å
155	G	80.9	Confident	82.7	Confident	11 Å²	11	47.8 Å²	47.8	11%	0.113	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-38.2	173.9	0	0	0	0	0	113.5	A151 A152 Q157 F158	A151-G155 PolarHBondContact O-N 2.83Å; A151-G155 VanDerWaalsContact O-N 3.09Å; A152-G155 PolarHBondContact O-N 3.41Å; G155-Q157 PolarHBondContact O-N 3.05Å; G155-Q157 VanDerWaalsContact O-N 3.14Å; G155-F158 PolarHBondContact O-N 2.81Å
156	D	83.1	Confident	82	Confident	44 Å²	44	50.8 Å²	50.8	24%	0.235	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-7.1	179.3	-68.8	-2.4	0	0	0	114	K87 A152 F153 G154 F158 N231 T233	K87-D156 IonicContact NZ-OD1 3.21Å; K87-D156 PolarHBondContact NZ-OD1 2.89Å; K87-D156 IonicContact NZ-OD2 3.6Å; K87-D156 PolarHBondContact NZ-OD2 3.36Å; A152-D156 VanDerWaalsContact O-CG 3.26Å; A152-D156 PolarHBondContact O-N 3.46Å; A152-D156 VanDerWaalsContact O-N 3.13Å; F153-D156 PolarHBondContact O-N 3.37Å; G154-D156 VanDerWaalsContact C-N 3.32Å; G154-D156 PolarHBondContact O-N 3.15Å; D156-F158 VanDerWaalsContact C-N 3.28Å; D156-N231 PolarHBondContact O-ND2 3.22Å; D156-T233 HydrophobicContact CB-CG2 4.46Å; D156-T233 PolarHBondContact OD2-OG1 3.13Å
157	Q	87.2	Confident	81.3	Confident	15 Å²	15	54.3 Å²	54.3	7%	0.07	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.4	177.8	-57.1	-47.3	-64	0	0	113.6	I23 I26 F153 G154 G155 N231	I23-Q157 HydrophobicContact CG1-CB 4.38Å; I26-Q157 HydrophobicContact CD1-CG 3.71Å; F153-Q157 WeakPolarHBondContact O-CG 3.12Å; F153-Q157 PolarHBondContact O-NE2 3.31Å; G154-Q157 WeakPolarHBondContact O-CB 3.46Å; G154-Q157 PolarHBondContact O-N 3.42Å; G155-Q157 PolarHBondContact O-N 3.05Å; G155-Q157 VanDerWaalsContact O-N 3.14Å; Q157-N231 PolarHBondContact NE2-O 2.86Å
158	F	83.8	Confident	81.1	Confident	13 Å²	13	55.4 Å²	55.4	6%	0.057	30%	0.295	C	S	.	.	S	Bend	trans	-104	141.8	179.9	-62.2	-85.9	0	0	0	110.7	Y19 I23 G155 D156 Q162 Q165 R166 F169	Y19-F158 HydrophobicContact CD1-CE1 4.11Å; Y19-F158 HydrophobicContact CD1-CZ 4.31Å; Y19-F158 HydrophobicContact CE1-CE1 4.48Å; I23-F158 HydrophobicContact CD1-CE1 3.57Å; I23-F158 HydrophobicContact CD1-CE2 3.92Å; I23-F158 HydrophobicContact CD1-CZ 3.18Å; I23-F158 HydrophobicContact CG1-CE2 4.27Å; I23-F158 HydrophobicContact CG1-CZ 3.98Å; G155-F158 PolarHBondContact O-N 2.81Å; D156-F158 VanDerWaalsContact C-N 3.28Å; F158-Q162 HydrophobicContact CB-CB 4.25Å; F158-Q162 HydrophobicContact CD1-CB 4.23Å; F158-Q165 HydrophobicContact CD1-CB 3.99Å; F158-Q165 HydrophobicContact CE1-CB 3.74Å; F158-R166 HydrophobicContact CB-CB 4.22Å; F158-R166 HydrophobicContact CB-CG 4.24Å; F158-R166 HydrophobicContact CD1-CB 4.46Å; F158-R166 HydrophobicContact CD2-CB 4.06Å; F158-R166 HydrophobicContact CD2-CG 3.79Å; F158-R166 HydrophobicContact CE2-CG 4.4Å; F158-R166 HydrophobicContact CG-CB 3.99Å; F158-R166 HydrophobicContact CG-CG 4.11Å; F158-F169 HydrophobicContact CE2-CB 3.62Å; F158-F169 AromaticContact CE2-CD1 3.91Å; F158-F169 HydrophobicContact CE2-CD1 3.91Å; F158-F169 HydrophobicContact CE2-CD2 4.32Å; F158-F169 AromaticContact CE2-CG 3.67Å; F158-F169 HydrophobicContact CE2-CG 3.67Å; F158-F169 HydrophobicContact CZ-CB 3.51Å; F158-F169 AromaticContact CZ-CG 3.99Å; F158-F169 HydrophobicContact CZ-CG 3.99Å
159	N	80.9	Confident	81.3	Confident	83 Å²	83	53.3 Å²	53.3	44%	0.444	28%	0.282	S	S	.	.			trans	-76.2	167.5	169.6	-61.1	-36.4	0	0	0	110.8	D161 Q162 R166	N159-D161 WeakPolarHBondContact CB-OD1 3.36Å; N159-D161 PolarHBondContact O-N 3.35Å; N159-Q162 HydrophobicContact CB-CG 4.44Å; N159-Q162 PolarHBondContact O-N 3.04Å; N159-Q162 VanDerWaalsContact O-N 3.11Å; N159-R166 PolarHBondContact O-NH2 2.97Å
160	E	74.4	Confident	81.1	Confident	176 Å²	176	57.4 Å²	57.4	82%	0.822	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.3	-179.6	-66.8	-175.8	172.5	0	0	113.2	Q162	E160-Q162 PolarHBondContact O-N 3.37Å
161	D	79.5	Confident	80.8	Confident	135 Å²	135	60.9 Å²	60.9	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-8.3	177.7	58.4	-56.5	0	0	0	114.1	N159	N159-D161 WeakPolarHBondContact CB-OD1 3.36Å; N159-D161 PolarHBondContact O-N 3.35Å
162	Q	78.9	Confident	81	Confident	40 Å²	40	62.7 Å²	62.7	19%	0.187	33%	0.328	C	S	.	.			trans	-104.9	34.7	-171.4	-62.1	-178.5	-63.9	0	0	113.9	F158 N159 E160 K164 Q165 R166	F158-Q162 HydrophobicContact CB-CB 4.25Å; F158-Q162 HydrophobicContact CD1-CB 4.23Å; N159-Q162 HydrophobicContact CB-CG 4.44Å; N159-Q162 PolarHBondContact O-N 3.04Å; N159-Q162 VanDerWaalsContact O-N 3.11Å; E160-Q162 PolarHBondContact O-N 3.37Å; Q162-K164 PolarHBondContact O-N 3.03Å; Q162-Q165 HydrophobicContact CB-CB 4.43Å; Q162-Q165 VanDerWaalsContact CD-OE1 3.29Å; Q162-Q165 PolarHBondContact O-N 3.18Å; Q162-R166 PolarHBondContact O-N 2.99Å
163	D	74.3	Confident	81.2	Confident	100 Å²	100	61.6 Å²	61.6	54%	0.535	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-39.9	-174.2	-72	-25.2	0	0	0	113.8	Q165 R166 S167	D163-Q165 VanDerWaalsContact C-N 3.34Å; D163-Q165 PolarHBondContact O-N 3.3Å; D163-R166 PolarHBondContact O-N 3.39Å; D163-R166 IonicContact OD1-CZ 2.68Å; D163-R166 IonicContact OD1-NH1 3.18Å; D163-R166 IonicContact OD1-NH2 3.34Å; D163-R166 PolarHBondContact OD1-NH2 3.24Å; D163-S167 PolarHBondContact O-N 3.36Å
164	K	77.6	Confident	81.1	Confident	181 Å²	181	66.5 Å²	66.5	79%	0.787	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-42.6	177.3	-171.6	175.5	-178.7	178.6	0	111.8	Q162 S167 T168	Q162-K164 PolarHBondContact O-N 3.03Å; K164-S167 PolarHBondContact O-N 3.34Å; K164-T168 PolarHBondContact O-N 2.96Å; K164-T168 PolarHBondContact O-OG1 2.77Å; K164-T168 VanDerWaalsContact O-OG1 3.13Å
165	Q	80.8	Confident	81.1	Confident	55 Å²	55	71.6 Å²	71.6	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-68.8	-38.5	179.5	-63.7	174.8	-27.9	0	0	111.1	G18 Y19 F158 Q162 D163 T168 F169	G18-Q165 PolarHBondContact O-NE2 3.33Å; Y19-Q165 HydrophobicContact CD1-CB 4.44Å; Y19-Q165 HydrophobicContact CE1-CB 3.93Å; Y19-Q165 HydrophobicContact CE1-CG 4.41Å; F158-Q165 HydrophobicContact CD1-CB 3.99Å; F158-Q165 HydrophobicContact CE1-CB 3.74Å; Q162-Q165 HydrophobicContact CB-CB 4.43Å; Q162-Q165 VanDerWaalsContact CD-OE1 3.29Å; Q162-Q165 PolarHBondContact O-N 3.18Å; D163-Q165 VanDerWaalsContact C-N 3.34Å; D163-Q165 PolarHBondContact O-N 3.3Å; Q165-T168 PolarHBondContact O-N 3.41Å; Q165-F169 PolarHBondContact O-N 3.17Å
166	R	76.8	Confident	81.6	Confident	65 Å²	65	71.8 Å²	71.8	25%	0.245	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-41.7	175.8	-161.9	-177.1	-46.6	154.3	20.5	112.1	F158 N159 Q162 D163 F169 F170	F158-R166 HydrophobicContact CB-CB 4.22Å; F158-R166 HydrophobicContact CB-CG 4.24Å; F158-R166 HydrophobicContact CD1-CB 4.46Å; F158-R166 HydrophobicContact CD2-CB 4.06Å; F158-R166 HydrophobicContact CD2-CG 3.79Å; F158-R166 HydrophobicContact CE2-CG 4.4Å; F158-R166 HydrophobicContact CG-CB 3.99Å; F158-R166 HydrophobicContact CG-CG 4.11Å; N159-R166 PolarHBondContact O-NH2 2.97Å; Q162-R166 PolarHBondContact O-N 2.99Å; D163-R166 PolarHBondContact O-N 3.39Å; D163-R166 IonicContact OD1-CZ 2.68Å; D163-R166 IonicContact OD1-NH1 3.18Å; D163-R166 IonicContact OD1-NH2 3.34Å; D163-R166 PolarHBondContact OD1-NH2 3.24Å; R166-F169 WeakPolarHBondContact O-CB 3.34Å; R166-F169 PolarHBondContact O-N 2.96Å; R166-F170 HydrophobicContact CG-CD2 4.4Å; R166-F170 HydrophobicContact CG-CE2 3.95Å; R166-F170 WeakPolarHBondContact O-CD2 3.35Å; R166-F170 PolarHBondContact O-N 3Å
167	S	75.6	Confident	81.8	Confident	74 Å²	74	71.4 Å²	71.4	52%	0.517	36%	0.36	S	S	.	.	H	α-helix	trans	-61.8	-47.8	174.8	175.3	0	0	0	0	111.9	D163 K164 F169 F170 S171	D163-S167 PolarHBondContact O-N 3.36Å; K164-S167 PolarHBondContact O-N 3.34Å; S167-F169 VanDerWaalsContact C-N 3.29Å; S167-F169 PolarHBondContact O-N 3.14Å; S167-F170 PolarHBondContact O-N 2.92Å; S167-F170 VanDerWaalsContact O-N 3.14Å; S167-S171 PolarHBondContact O-N 3.02Å; S167-S171 VanDerWaalsContact O-N 3.15Å; S167-S171 PolarHBondContact O-OG 2.86Å
168	T	80.4	Confident	81.8	Confident	51 Å²	51	71.2 Å²	71.2	31%	0.313	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-36.3	176.6	-48.7	0	0	0	0	112.4	Y19 K164 Q165 F170 S171 I172	Y19-T168 VanDerWaalsContact OH-CB 3.23Å; Y19-T168 WeakPolarHBondContact OH-CB 3.42Å; Y19-T168 VanDerWaalsContact OH-CG2 3.22Å; Y19-T168 WeakPolarHBondContact OH-CG2 3.31Å; K164-T168 PolarHBondContact O-N 2.96Å; K164-T168 PolarHBondContact O-OG1 2.77Å; K164-T168 VanDerWaalsContact O-OG1 3.13Å; Q165-T168 PolarHBondContact O-N 3.41Å; T168-F170 VanDerWaalsContact C-N 3.35Å; T168-F170 PolarHBondContact O-N 2.98Å; T168-S171 WeakPolarHBondContact O-CB 3.37Å; T168-S171 PolarHBondContact O-N 3.15Å; T168-I172 HydrophobicContact CG2-CD1 4.17Å; T168-I172 WeakPolarHBondContact O-CG1 3.23Å; T168-I172 PolarHBondContact O-N 3.2Å
169	F	84.8	Confident	82.2	Confident	2 Å²	2	72 Å²	72	1%	0.009	37%	0.369	C	S	.	.	H	α-helix	trans	-57.4	-46.9	173	160	-99.9	0	0	0	111.9	I23 V27 F158 Q165 R166 S167 S171 I172 F173	I23-F169 HydrophobicContact CG2-CD2 3.45Å; I23-F169 VanDerWaalsContact CG2-CD2 3.45Å; I23-F169 HydrophobicContact CG2-CE2 3.83Å; V27-F169 HydrophobicContact CG2-CD2 4.29Å; V27-F169 HydrophobicContact CG2-CE2 3.99Å; F158-F169 HydrophobicContact CE2-CB 3.62Å; F158-F169 AromaticContact CE2-CD1 3.91Å; F158-F169 HydrophobicContact CE2-CD1 3.91Å; F158-F169 HydrophobicContact CE2-CD2 4.32Å; F158-F169 AromaticContact CE2-CG 3.67Å; F158-F169 HydrophobicContact CE2-CG 3.67Å; F158-F169 HydrophobicContact CZ-CB 3.51Å; F158-F169 AromaticContact CZ-CG 3.99Å; F158-F169 HydrophobicContact CZ-CG 3.99Å; Q165-F169 PolarHBondContact O-N 3.17Å; R166-F169 WeakPolarHBondContact O-CB 3.34Å; R166-F169 PolarHBondContact O-N 2.96Å; S167-F169 VanDerWaalsContact C-N 3.29Å; S167-F169 PolarHBondContact O-N 3.14Å; F169-S171 VanDerWaalsContact C-N 3.27Å; F169-S171 PolarHBondContact O-N 3.36Å; F169-I172 PolarHBondContact O-N 3.25Å; F169-F173 HydrophobicContact CE2-CD2 4.23Å; F169-F173 HydrophobicContact CZ-CB 4.45Å; F169-F173 AromaticContact CZ-CD2 3.85Å; F169-F173 HydrophobicContact CZ-CD2 3.85Å; F169-F173 HydrophobicContact CZ-CE2 4.49Å; F169-F173 HydrophobicContact CZ-CG 4.4Å; F169-F173 VanDerWaalsContact O-CB 3.28Å; F169-F173 WeakPolarHBondContact O-CB 3.45Å; F169-F173 PolarHBondContact O-N 3.27Å
170	F	80.1	Confident	82.8	Confident	89 Å²	89	68.1 Å²	68.1	39%	0.39	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-33.1	177.4	-75.5	-64	0	0	0	112.6	R166 S167 T168 F173 Y174	R166-F170 HydrophobicContact CG-CD2 4.4Å; R166-F170 HydrophobicContact CG-CE2 3.95Å; R166-F170 WeakPolarHBondContact O-CD2 3.35Å; R166-F170 PolarHBondContact O-N 3Å; S167-F170 PolarHBondContact O-N 2.92Å; S167-F170 VanDerWaalsContact O-N 3.14Å; T168-F170 VanDerWaalsContact C-N 3.35Å; T168-F170 PolarHBondContact O-N 2.98Å; F170-F173 PolarHBondContact O-N 3.19Å; F170-Y174 WeakPolarHBondContact O-CB 3.38Å; F170-Y174 PolarHBondContact O-N 2.93Å
171	S	82.4	Confident	83.6	Confident	74 Å²	74	60.4 Å²	60.4	52%	0.517	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-44.5	171.7	-53.6	0	0	0	0	112.4	S167 T168 F169 F173 Y174 L175	S167-S171 PolarHBondContact O-N 3.02Å; S167-S171 VanDerWaalsContact O-N 3.15Å; S167-S171 PolarHBondContact O-OG 2.86Å; T168-S171 WeakPolarHBondContact O-CB 3.37Å; T168-S171 PolarHBondContact O-N 3.15Å; F169-S171 VanDerWaalsContact C-N 3.27Å; F169-S171 PolarHBondContact O-N 3.36Å; S171-F173 VanDerWaalsContact C-N 3.33Å; S171-Y174 PolarHBondContact O-N 3.34Å; S171-L175 PolarHBondContact O-N 3.13Å
172	I	86.5	Confident	84.3	Confident	69 Å²	69	56 Å²	56	35%	0.354	29%	0.289	S	S	.	.	H	α-helix	trans	-65.2	-39.1	176.2	-66.6	168.2	0	0	0	110.8	V27 T168 F169 L175 S176	V27-I172 HydrophobicContact CG1-CG2 3.91Å; V27-I172 HydrophobicContact CG2-CG2 4.21Å; T168-I172 HydrophobicContact CG2-CD1 4.17Å; T168-I172 WeakPolarHBondContact O-CG1 3.23Å; T168-I172 PolarHBondContact O-N 3.2Å; F169-I172 PolarHBondContact O-N 3.25Å; I172-L175 PolarHBondContact O-N 3.38Å; I172-S176 WeakPolarHBondContact O-CB 3.22Å; I172-S176 PolarHBondContact O-N 3.14Å; I172-S176 PolarHBondContact O-OG 3.38Å
173	F	85.6	Confident	85.1	Confident	16 Å²	16	57.8 Å²	57.8	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-46.8	175.7	-169	-95	0	0	0	110.8	E30 V150 A151 F169 F170 S171 L175 S176 I177	E30-F173 HydrophobicContact CB-CD2 4.16Å; E30-F173 HydrophobicContact CB-CE2 3.64Å; E30-F173 HydrophobicContact CB-CZ 4.19Å; E30-F173 HydrophobicContact CG-CD2 3.97Å; E30-F173 HydrophobicContact CG-CE1 4.08Å; E30-F173 HydrophobicContact CG-CE2 3.39Å; E30-F173 HydrophobicContact CG-CZ 3.46Å; E30-F173 VanDerWaalsContact CG-CZ 3.46Å; E30-F173 VanDerWaalsContact OE2-CZ 3.26Å; E30-F173 WeakPolarHBondContact OE2-CZ 3.46Å; V150-F173 HydrophobicContact CG1-CE2 4.19Å; V150-F173 HydrophobicContact CG1-CZ 4.32Å; A151-F173 HydrophobicContact CB-CE1 4.02Å; A151-F173 HydrophobicContact CB-CZ 4.01Å; F169-F173 HydrophobicContact CE2-CD2 4.23Å; F169-F173 HydrophobicContact CZ-CB 4.45Å; F169-F173 AromaticContact CZ-CD2 3.85Å; F169-F173 HydrophobicContact CZ-CD2 3.85Å; F169-F173 HydrophobicContact CZ-CE2 4.49Å; F169-F173 HydrophobicContact CZ-CG 4.4Å; F169-F173 VanDerWaalsContact O-CB 3.28Å; F169-F173 WeakPolarHBondContact O-CB 3.45Å; F169-F173 PolarHBondContact O-N 3.27Å; F170-F173 PolarHBondContact O-N 3.19Å; S171-F173 VanDerWaalsContact C-N 3.33Å; F173-L175 PolarHBondContact O-N 3.42Å; F173-S176 WeakPolarHBondContact O-CB 3.25Å; F173-S176 PolarHBondContact O-N 3.46Å; F173-I177 HydrophobicContact CD1-CD1 3.76Å; F173-I177 HydrophobicContact CE1-CD1 3.67Å; F173-I177 HydrophobicContact CE1-CG1 4.48Å; F173-I177 WeakPolarHBondContact O-CG1 3.25Å; F173-I177 PolarHBondContact O-N 3.19Å
174	Y	84.1	Confident	86.1	Confident	103 Å²	103	53 Å²	53	40%	0.404	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-41.1	175	-176.7	-99.8	0	0	0	112.9	F170 S171 S176 I177 N178	F170-Y174 WeakPolarHBondContact O-CB 3.38Å; F170-Y174 PolarHBondContact O-N 2.93Å; S171-Y174 PolarHBondContact O-N 3.34Å; Y174-S176 VanDerWaalsContact C-N 3.29Å; Y174-S176 PolarHBondContact O-N 3.27Å; Y174-I177 PolarHBondContact O-N 3.04Å; Y174-N178 WeakPolarHBondContact CD1-ND2 3.43Å; Y174-N178 WeakPolarHBondContact CE1-ND2 3.44Å; Y174-N178 PolarHBondContact O-N 3.2Å; Y174-N178 PolarHBondContact O-ND2 3.42Å
175	L	86.3	Confident	86.9	Confident	107 Å²	107	44.6 Å²	44.6	56%	0.56	24%	0.238	S	C	*	.	H	α-helix	trans	-60.3	-41.7	173.7	-179.1	66	0	0	0	111.3	S171 I172 F173 I177 N178 A179	S171-L175 PolarHBondContact O-N 3.13Å; I172-L175 PolarHBondContact O-N 3.38Å; F173-L175 PolarHBondContact O-N 3.42Å; L175-I177 PolarHBondContact O-N 3.1Å; L175-N178 PolarHBondContact O-N 2.63Å; L175-A179 VanDerWaalsContact O-CB 3.28Å; L175-A179 WeakPolarHBondContact O-CB 3.35Å; L175-A179 PolarHBondContact O-N 3.02Å
176	S	90.3	Very high	87.5	Confident	15 Å²	15	44.5 Å²	44.5	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-36.6	-180	-56.9	0	0	0	0	112.4	V27 I172 F173 Y174 G180	V27-S176 VanDerWaalsContact CG1-OG 3.25Å; V27-S176 WeakPolarHBondContact CG1-OG 3.37Å; I172-S176 WeakPolarHBondContact O-CB 3.22Å; I172-S176 PolarHBondContact O-N 3.14Å; I172-S176 PolarHBondContact O-OG 3.38Å; F173-S176 WeakPolarHBondContact O-CB 3.25Å; F173-S176 PolarHBondContact O-N 3.46Å; Y174-S176 VanDerWaalsContact C-N 3.29Å; Y174-S176 PolarHBondContact O-N 3.27Å; S176-G180 PolarHBondContact O-N 2.97Å
177	I	88.1	Confident	88.4	Confident	36 Å²	36	44.6 Å²	44.6	19%	0.185	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-52.1	173.3	-71.2	166.3	0	0	0	110.9	E30 R34 F173 Y174 L175 G180 S181	E30-I177 HydrophobicContact CG-CG1 4.07Å; R34-I177 HydrophobicContact CG-CB 4.35Å; R34-I177 HydrophobicContact CG-CG1 3.93Å; R34-I177 HydrophobicContact CG-CG2 4.48Å; F173-I177 HydrophobicContact CD1-CD1 3.76Å; F173-I177 HydrophobicContact CE1-CD1 3.67Å; F173-I177 HydrophobicContact CE1-CG1 4.48Å; F173-I177 WeakPolarHBondContact O-CG1 3.25Å; F173-I177 PolarHBondContact O-N 3.19Å; Y174-I177 PolarHBondContact O-N 3.04Å; L175-I177 PolarHBondContact O-N 3.1Å; I177-G180 PolarHBondContact O-N 3.13Å; I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.15Å
178	N	87.1	Confident	89.3	Confident	11 Å²	11	41.1 Å²	41.1	6%	0.059	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-39.7	-177.9	-73.1	-70.8	0	0	0	111.8	Y174 L175 S181 L182 L341	Y174-N178 WeakPolarHBondContact CD1-ND2 3.43Å; Y174-N178 WeakPolarHBondContact CE1-ND2 3.44Å; Y174-N178 PolarHBondContact O-N 3.2Å; Y174-N178 PolarHBondContact O-ND2 3.42Å; L175-N178 PolarHBondContact O-N 2.63Å; N178-S181 PolarHBondContact O-N 3.09Å; N178-L182 VanDerWaalsContact O-CB 3.24Å; N178-L182 WeakPolarHBondContact O-CB 3.43Å; N178-L182 PolarHBondContact O-N 3.39Å; N178-L341 HydrophobicContact CB-CD2 3.9Å; N178-L341 HydrophobicContact CB-CG 4.43Å
179	A	92	Very high	90	Very high	31 Å²	31	38.7 Å²	38.7	26%	0.256	21%	0.206	S	C	.	.	H	α-helix	trans	-63.1	-44.3	175.3	0	0	0	0	0	111.9	F31 L175 L183	F31-A179 HydrophobicContact CD2-CB 4.39Å; F31-A179 HydrophobicContact CE2-CB 4.14Å; L175-A179 VanDerWaalsContact O-CB 3.28Å; L175-A179 WeakPolarHBondContact O-CB 3.35Å; L175-A179 PolarHBondContact O-N 3.02Å; A179-L183 WeakPolarHBondContact O-CB 3.15Å; A179-L183 VanDerWaalsContact O-CG 3.32Å; A179-L183 WeakPolarHBondContact O-CG 3.36Å; A179-L183 PolarHBondContact O-N 3.08Å
180	G	92.9	Very high	90.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-46.9	176.5	0	0	0	0	0	111.9	S176 I177 S184	S176-G180 PolarHBondContact O-N 2.97Å; I177-G180 PolarHBondContact O-N 3.13Å; G180-S184 WeakPolarHBondContact O-CB 3.19Å; G180-S184 PolarHBondContact O-N 3.24Å; G180-S184 PolarHBondContact O-OG 3.4Å
181	S	91.9	Very high	91	Very high	14 Å²	14	39.6 Å²	39.6	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-57.6	-56.3	175.2	-177.2	0	0	0	0	111.4	I177 N178 L183 S184 T185	I177-S181 WeakPolarHBondContact O-CB 3.45Å; I177-S181 PolarHBondContact O-N 3.15Å; N178-S181 PolarHBondContact O-N 3.09Å; S181-L183 PolarHBondContact O-N 3.39Å; S181-S184 PolarHBondContact O-N 3.19Å; S181-S184 VanDerWaalsContact O-N 3.15Å; S181-S184 PolarHBondContact O-OG 2.97Å; S181-T185 WeakPolarHBondContact O-CG2 3.33Å; S181-T185 PolarHBondContact O-N 2.93Å; S181-T185 PolarHBondContact O-OG1 3.46Å
182	L	93.9	Very high	91.5	Very high	43 Å²	43	36.2 Å²	36.2	23%	0.225	19%	0.19	C	C	.	.	H	α-helix	trans	-54.9	-49.8	-179.1	179	67.9	0	0	0	112.7	N178 S184 T185 V186 T334 P337 I338 L341	N178-L182 VanDerWaalsContact O-CB 3.24Å; N178-L182 WeakPolarHBondContact O-CB 3.43Å; N178-L182 PolarHBondContact O-N 3.39Å; L182-S184 VanDerWaalsContact C-N 3.33Å; L182-S184 PolarHBondContact O-N 3.01Å; L182-T185 PolarHBondContact O-OG1 2.95Å; L182-V186 WeakPolarHBondContact O-CG2 3.26Å; L182-V186 PolarHBondContact O-N 3.25Å; L182-T334 HydrophobicContact CD1-CG2 3.82Å; L182-P337 HydrophobicContact CB-CB 4.22Å; L182-P337 HydrophobicContact CB-CG 4.41Å; L182-P337 HydrophobicContact CD1-CB 4.36Å; L182-P337 HydrophobicContact CD1-CG 4.11Å; L182-I338 HydrophobicContact CD1-CD1 4.14Å; L182-I338 HydrophobicContact CD1-CG1 3.4Å; L182-I338 VanDerWaalsContact CD1-CG1 3.4Å; L182-L341 HydrophobicContact CD2-CD1 4.25Å
183	L	95.5	Very high	91.6	Very high	77 Å²	77	34.7 Å²	34.7	40%	0.403	19%	0.188	S	C	.	.	H	α-helix	trans	-67.4	-37.8	-178.7	-70.5	174.4	0	0	0	111.4	F31 F35 A179 S181 V186 I187	F31-L183 HydrophobicContact CE2-CD1 3.99Å; F31-L183 HydrophobicContact CZ-CD1 3.79Å; F35-L183 HydrophobicContact CD2-CB 4.15Å; F35-L183 HydrophobicContact CE2-CB 4.07Å; A179-L183 WeakPolarHBondContact O-CB 3.15Å; A179-L183 VanDerWaalsContact O-CG 3.32Å; A179-L183 WeakPolarHBondContact O-CG 3.36Å; A179-L183 PolarHBondContact O-N 3.08Å; S181-L183 PolarHBondContact O-N 3.39Å; L183-V186 PolarHBondContact O-N 2.96Å; L183-I187 HydrophobicContact CB-CD1 4.37Å; L183-I187 VanDerWaalsContact O-CB 3.3Å; L183-I187 WeakPolarHBondContact O-CB 3.23Å; L183-I187 VanDerWaalsContact O-CG1 3.29Å; L183-I187 WeakPolarHBondContact O-CG1 3.18Å; L183-I187 PolarHBondContact O-N 3.42Å
184	S	95.4	Very high	91.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-38	-178.5	70.2	0	0	0	0	113.5	F35 Y38 G39 G180 S181 L182 V186 T188	F35-S184 WeakPolarHBondContact O-CB 3.48Å; Y38-S184 WeakPolarHBondContact CB-OG 3.47Å; G39-S184 PolarHBondContact N-OG 3.49Å; G180-S184 WeakPolarHBondContact O-CB 3.19Å; G180-S184 PolarHBondContact O-N 3.24Å; G180-S184 PolarHBondContact O-OG 3.4Å; S181-S184 PolarHBondContact O-N 3.19Å; S181-S184 VanDerWaalsContact O-N 3.15Å; S181-S184 PolarHBondContact O-OG 2.97Å; L182-S184 VanDerWaalsContact C-N 3.33Å; L182-S184 PolarHBondContact O-N 3.01Å; S184-V186 VanDerWaalsContact C-N 3.26Å; S184-V186 PolarHBondContact O-N 3.37Å; S184-T188 WeakPolarHBondContact O-CB 3.49Å; S184-T188 PolarHBondContact O-N 3.34Å; S184-T188 PolarHBondContact O-OG1 3Å
185	T	93.8	Very high	91.6	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-74	-17.7	177.5	59.4	0	0	0	0	112.6	A42 S181 L182 P189 T334	A42-T185 HydrophobicContact CB-CG2 4.41Å; S181-T185 WeakPolarHBondContact O-CG2 3.33Å; S181-T185 PolarHBondContact O-N 2.93Å; S181-T185 PolarHBondContact O-OG1 3.46Å; L182-T185 PolarHBondContact O-OG1 2.95Å; T185-P189 WeakPolarHBondContact O-CD 3.44Å; T185-P189 VanDerWaalsContact O-CG 3.31Å; T185-P189 WeakPolarHBondContact O-CG 3.33Å; T185-T334 VanDerWaalsContact C-OG1 3.27Å; T185-T334 WeakPolarHBondContact CB-OG1 3.22Å; T185-T334 PolarHBondContact O-OG1 3.45Å; T185-T334 VanDerWaalsContact O-OG1 3.1Å; T185-T334 WeakPolarHBondContact OG1-CA 3.42Å; T185-T334 PolarHBondContact OG1-OG1 2.8Å
186	V	94.1	Very high	91.3	Very high	53 Å²	53	38.1 Å²	38.1	32%	0.321	21%	0.206	S	C	.	.	H	α-helix	trans	-85.9	-55.4	170.4	173.7	0	0	0	0	110.8	L182 L183 S184 I190 T334	L182-V186 WeakPolarHBondContact O-CG2 3.26Å; L182-V186 PolarHBondContact O-N 3.25Å; L183-V186 PolarHBondContact O-N 2.96Å; S184-V186 VanDerWaalsContact C-N 3.26Å; S184-V186 PolarHBondContact O-N 3.37Å; V186-I190 HydrophobicContact CG1-CD1 3.93Å; V186-I190 VanDerWaalsContact O-CD1 3.28Å; V186-I190 WeakPolarHBondContact O-CD1 3.45Å; V186-I190 WeakPolarHBondContact O-CG1 3.21Å; V186-T334 HydrophobicContact CG2-CG2 3.41Å; V186-T334 VanDerWaalsContact CG2-CG2 3.41Å
187	I	95.2	Very high	90.3	Very high	67 Å²	67	38.9 Å²	38.9	34%	0.344	22%	0.217	S	C	.	.	H	α-helix	trans	-73.3	-43.7	-168.4	-66.4	170.9	0	0	0	111.3	F35 L183 I190 L191	F35-I187 HydrophobicContact CE2-CD1 4.18Å; F35-I187 HydrophobicContact CZ-CB 4.24Å; F35-I187 HydrophobicContact CZ-CG2 4.27Å; L183-I187 HydrophobicContact CB-CD1 4.37Å; L183-I187 VanDerWaalsContact O-CB 3.3Å; L183-I187 WeakPolarHBondContact O-CB 3.23Å; L183-I187 VanDerWaalsContact O-CG1 3.29Å; L183-I187 WeakPolarHBondContact O-CG1 3.18Å; L183-I187 PolarHBondContact O-N 3.42Å; I187-I190 WeakPolarHBondContact O-CB 3.49Å; I187-I190 PolarHBondContact O-N 3.34Å; I187-I190 VanDerWaalsContact O-N 3.13Å; I187-L191 HydrophobicContact CG2-CD1 3.84Å; I187-L191 HydrophobicContact CG2-CG 4.1Å; I187-L191 WeakPolarHBondContact O-CG 3.29Å; I187-L191 PolarHBondContact O-N 3.36Å
188	T	95.4	Very high	89.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-44.5	-171.6	-45.6	0	0	0	0	112.7	G39 V43 S184 I190 L191 R192 A208 P212	G39-T188 VanDerWaalsContact CA-OG1 3.3Å; G39-T188 WeakPolarHBondContact CA-OG1 3.42Å; G39-T188 WeakPolarHBondContact O-CG2 3.27Å; V43-T188 HydrophobicContact CG1-CG2 3.95Å; V43-T188 HydrophobicContact CG2-CG2 4.41Å; S184-T188 WeakPolarHBondContact O-CB 3.49Å; S184-T188 PolarHBondContact O-N 3.34Å; S184-T188 PolarHBondContact O-OG1 3Å; T188-I190 VanDerWaalsContact C-N 3.32Å; T188-I190 PolarHBondContact O-N 2.95Å; T188-L191 WeakPolarHBondContact O-CB 3.31Å; T188-L191 PolarHBondContact O-N 3.31Å; T188-R192 PolarHBondContact O-N 3.17Å; T188-A208 HydrophobicContact CG2-CB 4Å; T188-A208 WeakPolarHBondContact CG2-O 3.45Å; T188-P212 HydrophobicContact CG2-CG 4.37Å
189	P	94.2	Very high	88.6	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-35.7	170.5	-31.2	41.4	0	0	0	114.5	V43 T185 L191 R192 A193 D330 Q331	V43-P189 HydrophobicContact CG1-CG 4.15Å; T185-P189 WeakPolarHBondContact O-CD 3.44Å; T185-P189 VanDerWaalsContact O-CG 3.31Å; T185-P189 WeakPolarHBondContact O-CG 3.33Å; P189-L191 VanDerWaalsContact C-N 3.31Å; P189-L191 PolarHBondContact O-N 3.36Å; P189-R192 WeakPolarHBondContact O-CB 3.4Å; P189-R192 PolarHBondContact O-N 3.13Å; P189-A193 WeakPolarHBondContact O-CB 3.44Å; P189-A193 PolarHBondContact O-N 3.32Å; P189-D330 VanDerWaalsContact CB-OD2 3.31Å; P189-D330 WeakPolarHBondContact CB-OD2 3.23Å; P189-D330 HydrophobicContact CG-CB 4.28Å; P189-Q331 HydrophobicContact CB-CG 3.41Å; P189-Q331 VanDerWaalsContact CB-CG 3.41Å; P189-Q331 HydrophobicContact CG-CG 3.93Å
190	I	92.9	Very high	87.3	Confident	75 Å²	75	48.4 Å²	48.4	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-42.3	175.3	-66.8	168	0	0	0	110	V186 I187 T188 A193 Q194	V186-I190 HydrophobicContact CG1-CD1 3.93Å; V186-I190 VanDerWaalsContact O-CD1 3.28Å; V186-I190 WeakPolarHBondContact O-CD1 3.45Å; V186-I190 WeakPolarHBondContact O-CG1 3.21Å; I187-I190 WeakPolarHBondContact O-CB 3.49Å; I187-I190 PolarHBondContact O-N 3.34Å; I187-I190 VanDerWaalsContact O-N 3.13Å; T188-I190 VanDerWaalsContact C-N 3.32Å; T188-I190 PolarHBondContact O-N 2.95Å; I190-A193 PolarHBondContact O-N 3.29Å; I190-Q194 WeakPolarHBondContact O-CG 3.33Å; I190-Q194 PolarHBondContact O-N 2.87Å
191	L	93.4	Very high	86.2	Confident	36 Å²	36	53.8 Å²	53.8	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-40.2	176.4	-64.5	173.4	0	0	0	111.8	I187 T188 P189 Q194 L207 V211	I187-L191 HydrophobicContact CG2-CD1 3.84Å; I187-L191 HydrophobicContact CG2-CG 4.1Å; I187-L191 WeakPolarHBondContact O-CG 3.29Å; I187-L191 PolarHBondContact O-N 3.36Å; T188-L191 WeakPolarHBondContact O-CB 3.31Å; T188-L191 PolarHBondContact O-N 3.31Å; P189-L191 VanDerWaalsContact C-N 3.31Å; P189-L191 PolarHBondContact O-N 3.36Å; L191-Q194 WeakPolarHBondContact O-CB 3.38Å; L191-Q194 PolarHBondContact O-N 3.44Å; L191-L207 HydrophobicContact CB-CD2 4.12Å; L191-L207 HydrophobicContact CB-CG 4.13Å; L191-L207 HydrophobicContact CD2-CD2 3.78Å; L191-L207 HydrophobicContact CD2-CG 4.15Å; L191-L207 HydrophobicContact CG-CD2 4.48Å; L191-V211 HydrophobicContact CD1-CB 3.95Å; L191-V211 HydrophobicContact CD1-CG1 4.16Å; L191-V211 HydrophobicContact CD1-CG2 3.77Å
192	R	93.6	Very high	85.4	Confident	3 Å²	3	56.7 Å²	56.7	1%	0.011	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-45.3	174.1	179.9	-163	60.1	75.6	-1	111.5	V43 T188 P189 Q194 C204 Y205 A208 D330	V43-R192 HydrophobicContact CG1-CB 4.35Å; T188-R192 PolarHBondContact O-N 3.17Å; P189-R192 WeakPolarHBondContact O-CB 3.4Å; P189-R192 PolarHBondContact O-N 3.13Å; R192-Q194 PolarHBondContact O-N 3.25Å; R192-C204 PolarHBondContact O-N 3.45Å; R192-Y205 HydrophobicContact CG-CD1 4.04Å; R192-Y205 HydrophobicContact CG-CE1 3.76Å; R192-Y205 HydrophobicContact CG-CE2 4.49Å; R192-A208 HydrophobicContact CB-CB 3.86Å; R192-D330 IonicContact CZ-OD1 3.2Å; R192-D330 IonicContact CZ-OD2 3.61Å; R192-D330 IonicContact NE-OD1 3.22Å; R192-D330 IonicContact NE-OD2 2.83Å; R192-D330 PolarHBondContact NE-OD2 3.19Å; R192-D330 IonicContact NH2-OD1 3.96Å; R192-D330 PolarHBondContact NH2-OD1 3.45Å; R192-D330 IonicContact NH2-OD2 2.63Å
193	A	87.5	Confident	84.9	Confident	36 Å²	36	56.5 Å²	56.5	30%	0.298	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.6	-176.3	0	0	0	0	0	114	P189 I190 Q328	P189-A193 WeakPolarHBondContact O-CB 3.44Å; P189-A193 PolarHBondContact O-N 3.32Å; I190-A193 PolarHBondContact O-N 3.29Å; A193-Q328 HydrophobicContact CB-CG 4.11Å
194	Q	88.3	Confident	84.5	Confident	108 Å²	108	53.1 Å²	53.1	51%	0.505	28%	0.277	S	S	.	.	S	Bend	trans	-68	150.4	170.7	-62.9	-71.7	-52.8	0	0	110.5	I190 L191 R192 C204	I190-Q194 WeakPolarHBondContact O-CG 3.33Å; I190-Q194 PolarHBondContact O-N 2.87Å; L191-Q194 WeakPolarHBondContact O-CB 3.38Å; L191-Q194 PolarHBondContact O-N 3.44Å; R192-Q194 PolarHBondContact O-N 3.25Å; Q194-C204 HydrophobicContact CB-CB 4.42Å; Q194-C204 WeakPolarHBondContact O-CB 3.39Å; Q194-C204 PolarHBondContact O-N 2.9Å
195	K	82.8	Confident	84.3	Confident	154 Å²	154	53.4 Å²	53.4	67%	0.67	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.6	168.1	-65.7	-172	178.5	-170.5	0	110	Q201 Q202	K195-Q201 HydrophobicContact CB-CB 4.35Å; K195-Q201 HydrophobicContact CD-CB 4.46Å; K195-Q202 CarbonylContact C-O 3.54Å; K195-Q202 VanDerWaalsContact CA-O 3.26Å; K195-Q202 WeakPolarHBondContact CA-O 3.24Å
196	C	79.1	Confident	84.3	Confident	37 Å²	37	54.6 Å²	54.6	25%	0.25	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	162.6	173.1	80.4	0	0	0	0	111.5	Q202 C204	C196-Q202 PolarHBondContact N-O 2.94Å; C196-Q202 PolarHBondContact O-N 2.91Å; C196-Q202 VanDerWaalsContact O-O 3.06Å; C196-C204 HydrophobicContact CB-CB 3.69Å; C196-C204 WeakPolarHBondContact CB-SG 3.5Å; C196-C204 WeakPolarHBondContact SG-CA 3.35Å; C196-C204 WeakPolarHBondContact SG-CB 3.37Å; C196-C204 CovalentContact SG-SG 2.01Å; C196-C204 PolarHBondContact SG-SG 2.9Å
197	G	69.2	Low	84.2	Confident	31 Å²	31	55.3 Å²	55.3	32%	0.32	29%	0.288	S	S	.	.			trans	145.8	152.4	179.8	0	0	0	0	0	110.1	T200 Q201	G197-T200 WeakPolarHBondContact CA-O 3.31Å; G197-Q201 PolarHBondContact O-NE2 3.04Å
198	I	70.7	Confident	84.2	Confident	139 Å²	139	52.1 Å²	52.1	71%	0.713	27%	0.271	S	S	*	.	S	Bend	trans	-82.2	-41	-175.9	-59.2	172	0	0	0	110	D112	D112-I198 VanDerWaalsContact OD2-CB 3.27Å; D112-I198 WeakPolarHBondContact OD2-CB 3.3Å; D112-I198 WeakPolarHBondContact OD2-CG1 3.46Å; D112-I198 PolarHBondContact OD2-N 3.37Å
199	H	68.9	Low	84.2	Confident	111 Å²	111	52.1 Å²	52.1	51%	0.514	27%	0.271	S	S	.	.	S	Bend	trans	-108	-38.7	-176.8	-66.5	-46.2	0	0	0	113.1	K118	K118-H199 HydrophobicContact CD-CB 4.36Å; K118-H199 HydrophobicContact CG-CB 4.37Å
200	T	65.3	Low	84.3	Confident	28 Å²	28	53.2 Å²	53.2	17%	0.172	28%	0.283	C	S	.	.	S	Bend	trans	-127.5	137.5	-179.7	46.9	0	0	0	0	110	K118 G120 G197 Q202	K118-T200 VanDerWaalsContact O-CG2 3.31Å; K118-T200 WeakPolarHBondContact O-CG2 3.33Å; G120-T200 VanDerWaalsContact CA-OG1 3.23Å; G120-T200 WeakPolarHBondContact CA-OG1 3.4Å; G197-T200 WeakPolarHBondContact CA-O 3.31Å; T200-Q202 PolarHBondContact O-N 3.27Å
201	Q	69.6	Low	84.4	Confident	113 Å²	113	51.7 Å²	51.7	53%	0.528	28%	0.277	S	S	.	.			trans	-85.6	104.3	-178.2	-68.9	-62.5	-43.5	0	0	110	K195 G197	K195-Q201 HydrophobicContact CB-CB 4.35Å; K195-Q201 HydrophobicContact CD-CB 4.46Å; G197-Q201 PolarHBondContact O-NE2 3.04Å
202	Q	75.4	Confident	84.5	Confident	74 Å²	74	50 Å²	50	35%	0.346	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	169.8	-178.9	-67	-63.1	-19.4	0	0	111.5	K195 C196 T200 C204	K195-Q202 CarbonylContact C-O 3.54Å; K195-Q202 VanDerWaalsContact CA-O 3.26Å; K195-Q202 WeakPolarHBondContact CA-O 3.24Å; C196-Q202 PolarHBondContact N-O 2.94Å; C196-Q202 PolarHBondContact O-N 2.91Å; C196-Q202 VanDerWaalsContact O-O 3.06Å; T200-Q202 PolarHBondContact O-N 3.27Å; Q202-C204 PolarHBondContact O-N 3.39Å
203	Q	81.6	Confident	84.6	Confident	40 Å²	40	50.1 Å²	50.1	19%	0.187	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	138	173.2	-75.2	-160.8	-11.8	0	0	112.3	Y205 E486	Q203-Y205 HydrophobicContact CB-CD2 4.43Å; Q203-Y205 HydrophobicContact CB-CE2 4.22Å; Q203-Y205 PolarHBondContact O-N 2.99Å; Q203-E486 PolarHBondContact NE2-OE2 2.94Å; Q203-E486 PolarHBondContact OE1-OE2 3.44Å
204	C	88.2	Confident	85	Confident	5 Å²	5	51 Å²	51	3%	0.034	28%	0.277	C	S	.	.			trans	-90.1	62.9	-165.2	-152.1	0	0	0	0	114.7	R192 Q194 C196 Q202 P206 L207 A208	R192-C204 PolarHBondContact O-N 3.45Å; Q194-C204 HydrophobicContact CB-CB 4.42Å; Q194-C204 WeakPolarHBondContact O-CB 3.39Å; Q194-C204 PolarHBondContact O-N 2.9Å; C196-C204 HydrophobicContact CB-CB 3.69Å; C196-C204 WeakPolarHBondContact CB-SG 3.5Å; C196-C204 WeakPolarHBondContact SG-CA 3.35Å; C196-C204 WeakPolarHBondContact SG-CB 3.37Å; C196-C204 CovalentContact SG-SG 2.01Å; C196-C204 PolarHBondContact SG-SG 2.9Å; Q202-C204 PolarHBondContact O-N 3.39Å; C204-P206 VanDerWaalsContact C-CD 3.43Å; C204-P206 VanDerWaalsContact C-N 3.34Å; C204-L207 HydrophobicContact CB-CB 4.1Å; C204-L207 PolarHBondContact O-N 2.83Å; C204-L207 WeakPolarHBondContact SG-CB 3.35Å; C204-A208 PolarHBondContact O-N 3.4Å; C204-A208 VanDerWaalsContact O-N 3.09Å
205	Y	92	Very high	85.3	Confident	6 Å²	6	48.3 Å²	48.3	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-37.6	168.8	-70.9	-79.8	0	0	0	114.1	L46 Y47 F51 R192 Q203 L207 A208 F209	L46-Y205 PolarHBondContact O-OH 3.18Å; Y47-Y205 VanDerWaalsContact CA-CE1 3.45Å; Y47-Y205 AromaticContact CD2-CD1 3.68Å; Y47-Y205 HydrophobicContact CD2-CD1 3.68Å; Y47-Y205 HydrophobicContact CD2-CD2 4.44Å; Y47-Y205 HydrophobicContact CD2-CE1 4.18Å; Y47-Y205 AromaticContact CD2-CG 3.83Å; Y47-Y205 HydrophobicContact CD2-CG 3.83Å; Y47-Y205 HydrophobicContact CG-CD1 4.18Å; Y47-Y205 HydrophobicContact CG-CE1 4.39Å; F51-Y205 HydrophobicContact CB-CD2 4.29Å; F51-Y205 HydrophobicContact CB-CE2 4.27Å; F51-Y205 HydrophobicContact CD2-CD2 4.19Å; R192-Y205 HydrophobicContact CG-CD1 4.04Å; R192-Y205 HydrophobicContact CG-CE1 3.76Å; R192-Y205 HydrophobicContact CG-CE2 4.49Å; Q203-Y205 HydrophobicContact CB-CD2 4.43Å; Q203-Y205 HydrophobicContact CB-CE2 4.22Å; Q203-Y205 PolarHBondContact O-N 2.99Å; Y205-L207 VanDerWaalsContact C-N 3.27Å; Y205-L207 PolarHBondContact O-N 3.09Å; Y205-A208 PolarHBondContact O-N 3.23Å; Y205-F209 HydrophobicContact CD1-CE2 4.26Å; Y205-F209 HydrophobicContact CD1-CZ 4.46Å; Y205-F209 WeakPolarHBondContact O-CD2 3.49Å; Y205-F209 PolarHBondContact O-N 2.84Å
206	P	92.4	Very high	85.9	Confident	30 Å²	30	41 Å²	41	20%	0.195	23%	0.234	C	C	.	.	H	α-helix	trans	-55.9	-39.8	174.1	-29.3	36.3	0	0	0	113.8	A109 I110 C204 G210	A109-P206 HydrophobicContact CB-CG 4.18Å; A109-P206 VanDerWaalsContact O-CD 3.3Å; A109-P206 WeakPolarHBondContact O-CD 3.44Å; A109-P206 WeakPolarHBondContact O-CG 3.4Å; I110-P206 HydrophobicContact CB-CG 4.37Å; I110-P206 HydrophobicContact CG1-CB 3.9Å; I110-P206 HydrophobicContact CG1-CG 3.78Å; C204-P206 VanDerWaalsContact C-CD 3.43Å; C204-P206 VanDerWaalsContact C-N 3.34Å; P206-G210 VanDerWaalsContact O-CA 3.25Å; P206-G210 WeakPolarHBondContact O-CA 3.38Å; P206-G210 PolarHBondContact O-N 3.14Å
207	L	92.8	Very high	86.7	Confident	69 Å²	69	42.2 Å²	42.2	36%	0.361	24%	0.24	S	C	.	.	H	α-helix	trans	-74	-41.2	178.5	-175.7	66.6	0	0	0	110.9	L191 C204 Y205 F209 G210 V211	L191-L207 HydrophobicContact CB-CD2 4.12Å; L191-L207 HydrophobicContact CB-CG 4.13Å; L191-L207 HydrophobicContact CD2-CD2 3.78Å; L191-L207 HydrophobicContact CD2-CG 4.15Å; L191-L207 HydrophobicContact CG-CD2 4.48Å; C204-L207 HydrophobicContact CB-CB 4.1Å; C204-L207 PolarHBondContact O-N 2.83Å; C204-L207 WeakPolarHBondContact SG-CB 3.35Å; Y205-L207 VanDerWaalsContact C-N 3.27Å; Y205-L207 PolarHBondContact O-N 3.09Å; L207-F209 VanDerWaalsContact C-N 3.3Å; L207-F209 PolarHBondContact O-N 2.89Å; L207-G210 PolarHBondContact O-N 3.14Å; L207-V211 HydrophobicContact CD1-CG2 3.88Å; L207-V211 HydrophobicContact CG-CG2 4.39Å; L207-V211 PolarHBondContact O-N 3.38Å
208	A	94.8	Very high	87.9	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-35.8	177.2	0	0	0	0	0	112.6	V43 T188 R192 C204 Y205 P212	V43-A208 HydrophobicContact CG2-CB 4.42Å; T188-A208 HydrophobicContact CG2-CB 4Å; T188-A208 WeakPolarHBondContact CG2-O 3.45Å; R192-A208 HydrophobicContact CB-CB 3.86Å; C204-A208 PolarHBondContact O-N 3.4Å; C204-A208 VanDerWaalsContact O-N 3.09Å; Y205-A208 PolarHBondContact O-N 3.23Å; A208-P212 WeakPolarHBondContact O-CD 3.43Å; A208-P212 WeakPolarHBondContact O-CG 3.45Å
209	F	96.3	Very high	88.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-89.4	-31.3	173.5	-63.3	-43.9	0	0	0	113.5	M40 V43 L44 Y47 M105 A106 A109 Y205 L207 P212 A213	M40-F209 HydrophobicContact CB-CD1 4.31Å; M40-F209 HydrophobicContact CG-CD1 3.65Å; M40-F209 HydrophobicContact CG-CE1 3.75Å; V43-F209 HydrophobicContact CG2-CD1 4.14Å; V43-F209 HydrophobicContact CG2-CE1 3.46Å; V43-F209 VanDerWaalsContact CG2-CE1 3.46Å; V43-F209 HydrophobicContact CG2-CZ 4.02Å; L44-F209 HydrophobicContact CD1-CE1 4.49Å; L44-F209 HydrophobicContact CD1-CZ 4.29Å; Y47-F209 HydrophobicContact CD1-CE2 4.19Å; Y47-F209 HydrophobicContact CD1-CZ 4.17Å; Y47-F209 AromaticContact CD2-CE2 3.6Å; Y47-F209 HydrophobicContact CD2-CE2 3.6Å; Y47-F209 HydrophobicContact CD2-CZ 4.11Å; Y47-F209 AromaticContact CE2-CE2 3.96Å; Y47-F209 HydrophobicContact CE2-CE2 3.96Å; Y47-F209 AromaticContact CG-CE2 3.71Å; Y47-F209 HydrophobicContact CG-CE2 3.71Å; Y47-F209 AromaticContact CG-CZ 3.75Å; Y47-F209 HydrophobicContact CG-CZ 3.75Å; M105-F209 HydrophobicContact CE-CD2 4.05Å; M105-F209 HydrophobicContact CE-CE2 3.59Å; M105-F209 HydrophobicContact CE-CZ 3.98Å; M105-F209 HydrophobicContact CG-CD1 4.35Å; M105-F209 HydrophobicContact CG-CD2 4.19Å; M105-F209 HydrophobicContact CG-CE2 4.44Å; M105-F209 HydrophobicContact CG-CG 4.14Å; A106-F209 HydrophobicContact CB-CB 4.01Å; A109-F209 HydrophobicContact CB-CD2 3.76Å; A109-F209 HydrophobicContact CB-CE2 4.13Å; Y205-F209 HydrophobicContact CD1-CE2 4.26Å; Y205-F209 HydrophobicContact CD1-CZ 4.46Å; Y205-F209 WeakPolarHBondContact O-CD2 3.49Å; Y205-F209 PolarHBondContact O-N 2.84Å; L207-F209 VanDerWaalsContact C-N 3.3Å; L207-F209 PolarHBondContact O-N 2.89Å; F209-P212 WeakPolarHBondContact O-CD 3.42Å; F209-A213 WeakPolarHBondContact O-CB 3.38Å; F209-A213 PolarHBondContact O-N 3.37Å
210	G	95.4	Very high	90.2	Very high	23 Å²	23	33 Å²	33	24%	0.237	19%	0.191	C	C	.	.	H	α-helix	trans	-68.9	-38.4	-177.3	0	0	0	0	0	113.7	P206 L207 A213 A214	P206-G210 VanDerWaalsContact O-CA 3.25Å; P206-G210 WeakPolarHBondContact O-CA 3.38Å; P206-G210 PolarHBondContact O-N 3.14Å; L207-G210 PolarHBondContact O-N 3.14Å; G210-A213 WeakPolarHBondContact O-CB 3.38Å; G210-A213 PolarHBondContact O-N 2.9Å; G210-A214 WeakPolarHBondContact O-CB 3.38Å; G210-A214 PolarHBondContact O-N 3.33Å
211	V	95.8	Very high	91.6	Very high	43 Å²	43	35.6 Å²	35.6	26%	0.261	21%	0.206	S	C	.	.	H	α-helix	trans	-64.9	-50.4	176.3	171.2	0	0	0	0	111.7	F35 L191 L207 A213 A214 L215	F35-V211 HydrophobicContact CE1-CG1 4.33Å; L191-V211 HydrophobicContact CD1-CB 3.95Å; L191-V211 HydrophobicContact CD1-CG1 4.16Å; L191-V211 HydrophobicContact CD1-CG2 3.77Å; L207-V211 HydrophobicContact CD1-CG2 3.88Å; L207-V211 HydrophobicContact CG-CG2 4.39Å; L207-V211 PolarHBondContact O-N 3.38Å; V211-A213 VanDerWaalsContact C-N 3.3Å; V211-A213 PolarHBondContact O-N 3.47Å; V211-A214 PolarHBondContact O-N 2.99Å; V211-L215 HydrophobicContact CG1-CD1 4.17Å; V211-L215 WeakPolarHBondContact O-CG 3.36Å; V211-L215 PolarHBondContact O-N 2.85Å
212	P	95.1	Very high	92.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-49.2	-45.7	166.2	-34.6	40.4	0	0	0	114.2	T188 A208 F209 L215 M216	T188-P212 HydrophobicContact CG2-CG 4.37Å; A208-P212 WeakPolarHBondContact O-CD 3.43Å; A208-P212 WeakPolarHBondContact O-CG 3.45Å; F209-P212 WeakPolarHBondContact O-CD 3.42Å; P212-L215 PolarHBondContact O-N 2.83Å; P212-M216 WeakPolarHBondContact O-CB 3.3Å; P212-M216 PolarHBondContact O-N 3.32Å
213	A	96.3	Very high	93.6	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.041	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-47.2	179.1	0	0	0	0	0	112.1	Q102 V103 F209 G210 V211 M216 V217	Q102-A213 HydrophobicContact CB-CB 3.67Å; V103-A213 HydrophobicContact CG2-CB 4.3Å; F209-A213 WeakPolarHBondContact O-CB 3.38Å; F209-A213 PolarHBondContact O-N 3.37Å; G210-A213 WeakPolarHBondContact O-CB 3.38Å; G210-A213 PolarHBondContact O-N 2.9Å; V211-A213 VanDerWaalsContact C-N 3.3Å; V211-A213 PolarHBondContact O-N 3.47Å; A213-M216 PolarHBondContact O-N 2.91Å; A213-V217 WeakPolarHBondContact O-CG2 3.47Å; A213-V217 PolarHBondContact O-N 3.48Å
214	A	96	Very high	94.2	Very high	56 Å²	56	30.2 Å²	30.2	46%	0.463	18%	0.184	S	C	.	.	H	α-helix	trans	-62.2	-44.5	177.8	0	0	0	0	0	111.6	G210 V211 M216 V217 V218	G210-A214 WeakPolarHBondContact O-CB 3.38Å; G210-A214 PolarHBondContact O-N 3.33Å; V211-A214 PolarHBondContact O-N 2.99Å; A214-M216 VanDerWaalsContact C-N 3.31Å; A214-M216 PolarHBondContact O-N 3.38Å; A214-V217 PolarHBondContact O-N 3.5Å; A214-V218 WeakPolarHBondContact O-CG2 3.43Å; A214-V218 PolarHBondContact O-N 3.48Å
215	L	94.4	Very high	94.5	Very high	50 Å²	50	34.7 Å²	34.7	26%	0.262	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-36.6	176	-74.1	174.4	0	0	0	112.3	F35 V211 P212 V218 A219	F35-L215 HydrophobicContact CD1-CD1 3.28Å; F35-L215 HydrophobicContact CE1-CD1 3.43Å; F35-L215 VanDerWaalsContact CE1-CD1 3.43Å; F35-L215 HydrophobicContact CG-CD1 3.9Å; F35-L215 HydrophobicContact CZ-CD1 4.14Å; V211-L215 HydrophobicContact CG1-CD1 4.17Å; V211-L215 WeakPolarHBondContact O-CG 3.36Å; V211-L215 PolarHBondContact O-N 2.85Å; P212-L215 PolarHBondContact O-N 2.83Å; L215-V218 PolarHBondContact O-N 3.2Å; L215-A219 WeakPolarHBondContact O-CB 3.34Å; L215-A219 PolarHBondContact O-N 2.74Å
216	M	94.8	Very high	94.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-39.3	175.2	-172.9	61.7	-154.4	0	0	112.2	E33 Y98 A99 P212 A213 A214 A219 L220	E33-M216 HydrophobicContact CB-SD 4.32Å; E33-M216 HydrophobicContact CG-SD 4.12Å; Y98-M216 HydrophobicContact CD1-CE 3.55Å; Y98-M216 HydrophobicContact CD1-CG 4.33Å; Y98-M216 HydrophobicContact CD1-SD 3.74Å; Y98-M216 HydrophobicContact CE1-CE 4.23Å; Y98-M216 HydrophobicContact CE1-SD 3.87Å; Y98-M216 HydrophobicContact CG-CE 4.08Å; Y98-M216 HydrophobicContact CG-CG 4.33Å; Y98-M216 HydrophobicContact CG-SD 4.32Å; A99-M216 HydrophobicContact CB-CG 4.31Å; P212-M216 WeakPolarHBondContact O-CB 3.3Å; P212-M216 PolarHBondContact O-N 3.32Å; A213-M216 PolarHBondContact O-N 2.91Å; A214-M216 VanDerWaalsContact C-N 3.31Å; A214-M216 PolarHBondContact O-N 3.38Å; M216-A219 WeakPolarHBondContact O-CB 3.38Å; M216-A219 PolarHBondContact O-N 2.79Å; M216-L220 PolarHBondContact O-N 2.75Å
217	V	96.2	Very high	94.3	Very high	63 Å²	63	34.6 Å²	34.6	38%	0.382	21%	0.212	S	C	.	.	H	α-helix	trans	-63.4	-44.3	173.1	172.9	0	0	0	0	110.6	A99 A213 A214 A219 L220 V221	A99-V217 HydrophobicContact CB-CG2 4.02Å; A213-V217 WeakPolarHBondContact O-CG2 3.47Å; A213-V217 PolarHBondContact O-N 3.48Å; A214-V217 PolarHBondContact O-N 3.5Å; V217-A219 VanDerWaalsContact C-N 3.33Å; V217-A219 PolarHBondContact O-N 2.98Å; V217-L220 WeakPolarHBondContact O-CB 3.27Å; V217-L220 PolarHBondContact O-N 2.88Å; V217-V221 WeakPolarHBondContact O-CG2 2.98Å; V217-V221 PolarHBondContact O-N 3.26Å
218	V	93.9	Very high	94.1	Very high	69 Å²	69	34.2 Å²	34.2	42%	0.418	22%	0.224	S	C	.	.	H	α-helix	trans	-60.1	-44.1	175.1	170.4	0	0	0	0	110.9	A214 L215 L220 V221 I222	A214-V218 WeakPolarHBondContact O-CG2 3.43Å; A214-V218 PolarHBondContact O-N 3.48Å; L215-V218 PolarHBondContact O-N 3.2Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 2.75Å; V218-V221 PolarHBondContact O-N 3.43Å; V218-I222 HydrophobicContact CG1-CD1 3.59Å; V218-I222 HydrophobicContact CG1-CG1 4.23Å; V218-I222 WeakPolarHBondContact O-CB 3.45Å; V218-I222 VanDerWaalsContact O-CG1 3.26Å; V218-I222 WeakPolarHBondContact O-CG1 3.43Å; V218-I222 PolarHBondContact O-N 3.33Å
219	A	92.5	Very high	93.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.4	-49.1	176.3	0	0	0	0	0	111.5	N29 C32 L215 M216 V217 V221 I222 F223	N29-A219 PolarHBondContact OD1-O 3.42Å; C32-A219 HydrophobicContact CB-CB 3.58Å; L215-A219 WeakPolarHBondContact O-CB 3.34Å; L215-A219 PolarHBondContact O-N 2.74Å; M216-A219 WeakPolarHBondContact O-CB 3.38Å; M216-A219 PolarHBondContact O-N 2.79Å; V217-A219 VanDerWaalsContact C-N 3.33Å; V217-A219 PolarHBondContact O-N 2.98Å; A219-V221 PolarHBondContact O-N 3.08Å; A219-I222 PolarHBondContact O-N 2.96Å; A219-F223 WeakPolarHBondContact O-CB 3.26Å; A219-F223 PolarHBondContact O-N 3.28Å
220	L	94.8	Very high	93.6	Very high	19 Å²	19	38.4 Å²	38.4	10%	0.099	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-46.6	177.5	174.2	62.3	0	0	0	112	V92 I96 M216 V217 V218 F223 I224	V92-L220 HydrophobicContact CG1-CD1 4.44Å; I96-L220 HydrophobicContact CB-CD2 4.49Å; I96-L220 HydrophobicContact CG1-CD1 4.38Å; I96-L220 HydrophobicContact CG1-CD2 3.6Å; M216-L220 PolarHBondContact O-N 2.75Å; V217-L220 WeakPolarHBondContact O-CB 3.27Å; V217-L220 PolarHBondContact O-N 2.88Å; V218-L220 VanDerWaalsContact C-N 3.34Å; V218-L220 PolarHBondContact O-N 2.75Å; L220-F223 PolarHBondContact O-N 3.24Å; L220-I224 HydrophobicContact CD1-CD1 3.67Å; L220-I224 HydrophobicContact CD1-CG1 4.12Å; L220-I224 HydrophobicContact CG-CD1 3.89Å; L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.48Å; L220-I224 PolarHBondContact O-N 3.34Å
221	V	95.3	Very high	93.1	Very high	82 Å²	82	41.2 Å²	41.2	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-47.9	178.8	172	0	0	0	0	110.5	V217 V218 A219 F223 I224 V225	V217-V221 WeakPolarHBondContact O-CG2 2.98Å; V217-V221 PolarHBondContact O-N 3.26Å; V218-V221 PolarHBondContact O-N 3.43Å; A219-V221 PolarHBondContact O-N 3.08Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.19Å; V221-I224 PolarHBondContact O-N 3.19Å; V221-V225 HydrophobicContact CG1-CG2 4.34Å; V221-V225 VanDerWaalsContact O-CG2 3.28Å; V221-V225 WeakPolarHBondContact O-CG2 3.16Å; V221-V225 PolarHBondContact O-N 3.48Å
222	I	92.9	Very high	92.7	Very high	44 Å²	44	44.1 Å²	44.1	23%	0.226	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-44.7	178.2	-70.9	175.1	0	0	0	110.6	F25 V28 V218 A219 V225 G226	F25-I222 HydrophobicContact CB-CG2 4.25Å; F25-I222 HydrophobicContact CD1-CG2 3.73Å; F25-I222 VanDerWaalsContact CD1-O 3.29Å; F25-I222 WeakPolarHBondContact CD1-O 3.19Å; F25-I222 HydrophobicContact CG-CG2 4.47Å; V28-I222 HydrophobicContact CB-CG2 4.38Å; V28-I222 HydrophobicContact CG1-CD1 3.71Å; V28-I222 HydrophobicContact CG1-CG2 4.26Å; V218-I222 HydrophobicContact CG1-CD1 3.59Å; V218-I222 HydrophobicContact CG1-CG1 4.23Å; V218-I222 WeakPolarHBondContact O-CB 3.45Å; V218-I222 VanDerWaalsContact O-CG1 3.26Å; V218-I222 WeakPolarHBondContact O-CG1 3.43Å; V218-I222 PolarHBondContact O-N 3.33Å; A219-I222 PolarHBondContact O-N 2.96Å; I222-V225 PolarHBondContact O-N 3.46Å; I222-G226 PolarHBondContact O-N 3.15Å
223	F	93.5	Very high	91.8	Very high	1 Å²	1	47 Å²	47	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-41.5	177.5	-170.1	-98.7	0	0	0	112.2	I26 N29 F88 I91 V92 F153 A219 L220 V221 G226 Y230	I26-F223 HydrophobicContact CG1-CE2 4.27Å; N29-F223 HydrophobicContact CB-CB 4.33Å; N29-F223 HydrophobicContact CB-CD2 4.26Å; F88-F223 AromaticContact CD2-CE1 3.65Å; F88-F223 HydrophobicContact CD2-CE1 3.65Å; F88-F223 HydrophobicContact CD2-CZ 4Å; F88-F223 HydrophobicContact CE2-CD1 4.15Å; F88-F223 AromaticContact CE2-CE1 3.59Å; F88-F223 HydrophobicContact CE2-CE1 3.59Å; F88-F223 HydrophobicContact CE2-CZ 4.26Å; I91-F223 HydrophobicContact CB-CE1 3.99Å; I91-F223 HydrophobicContact CB-CZ 4.13Å; I91-F223 HydrophobicContact CD1-CZ 3.86Å; I91-F223 HydrophobicContact CG2-CD1 4.03Å; I91-F223 HydrophobicContact CG2-CE1 3.52Å; I91-F223 HydrophobicContact CG2-CE2 4.3Å; I91-F223 HydrophobicContact CG2-CZ 3.68Å; V92-F223 HydrophobicContact CG2-CD1 4.04Å; V92-F223 HydrophobicContact CG2-CE1 4.04Å; F153-F223 AromaticContact CD1-CE2 3.97Å; F153-F223 HydrophobicContact CD1-CE2 3.97Å; F153-F223 AromaticContact CD1-CZ 3.77Å; F153-F223 HydrophobicContact CD1-CZ 3.77Å; F153-F223 AromaticContact CE1-CE2 3.86Å; F153-F223 HydrophobicContact CE1-CE2 3.86Å; F153-F223 AromaticContact CE1-CZ 3.54Å; F153-F223 HydrophobicContact CE1-CZ 3.54Å; F153-F223 HydrophobicContact CZ-CZ 4.39Å; A219-F223 WeakPolarHBondContact O-CB 3.26Å; A219-F223 PolarHBondContact O-N 3.28Å; L220-F223 PolarHBondContact O-N 3.24Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.19Å; F223-G226 PolarHBondContact O-N 3.47Å; F223-Y230 HydrophobicContact CD2-CE2 4.33Å; F223-Y230 HydrophobicContact CE1-CE2 4.42Å; F223-Y230 HydrophobicContact CE2-CE2 4.17Å; F223-Y230 HydrophobicContact CZ-CE2 4.21Å; F223-Y230 VanDerWaalsContact O-CE2 3.22Å; F223-Y230 WeakPolarHBondContact O-CE2 3.28Å; F223-Y230 PolarHBondContact O-OH 2.89Å
224	I	94.3	Very high	90.7	Very high	70 Å²	70	50.5 Å²	50.5	36%	0.359	31%	0.31	S	S	.	.	H	α-helix	trans	-67.8	-38.2	177.3	-68.5	168.9	0	0	0	111.6	V92 L220 V221 G226 S227	V92-I224 HydrophobicContact CG1-CD1 4.2Å; V92-I224 HydrophobicContact CG1-CG1 4.36Å; V92-I224 HydrophobicContact CG2-CG1 4.19Å; L220-I224 HydrophobicContact CD1-CD1 3.67Å; L220-I224 HydrophobicContact CD1-CG1 4.12Å; L220-I224 HydrophobicContact CG-CD1 3.89Å; L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.48Å; L220-I224 PolarHBondContact O-N 3.34Å; V221-I224 PolarHBondContact O-N 3.19Å; I224-G226 PolarHBondContact O-N 2.96Å; I224-S227 WeakPolarHBondContact O-CB 3.16Å; I224-S227 PolarHBondContact O-N 3.2Å; I224-S227 PolarHBondContact O-OG 2.96Å
225	V	94.2	Very high	89.6	Confident	98 Å²	98	51 Å²	51	59%	0.594	31%	0.308	S	S	*	.	H	α-helix	trans	-59.5	-38.1	176.3	169.1	0	0	0	0	111	F25 V221 I222 S227	F25-V225 HydrophobicContact CE1-CG1 4.02Å; V221-V225 HydrophobicContact CG1-CG2 4.34Å; V221-V225 VanDerWaalsContact O-CG2 3.28Å; V221-V225 WeakPolarHBondContact O-CG2 3.16Å; V221-V225 PolarHBondContact O-N 3.48Å; I222-V225 PolarHBondContact O-N 3.46Å; V225-S227 PolarHBondContact O-N 2.94Å
226	G	90.1	Very high	88.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-68.2	-8.1	174.1	0	0	0	0	0	115.1	I222 F223 I224 G228 M229 Y230	I222-G226 PolarHBondContact O-N 3.15Å; F223-G226 PolarHBondContact O-N 3.47Å; I224-G226 PolarHBondContact O-N 2.96Å; G226-G228 VanDerWaalsContact C-N 3.26Å; G226-G228 PolarHBondContact O-N 2.92Å; G226-G228 VanDerWaalsContact O-N 3.09Å; G226-M229 WeakPolarHBondContact O-CB 3.47Å; G226-M229 PolarHBondContact O-N 3.3Å; G226-Y230 VanDerWaalsContact C-CE2 3.45Å; G226-Y230 WeakPolarHBondContact O-CD2 3.13Å; G226-Y230 PolarHBondContact O-N 3.05Å
227	S	91.3	Very high	86.9	Confident	35 Å²	35	55.7 Å²	55.7	25%	0.245	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-59.2	-28.7	-169.4	68.1	0	0	0	0	115.6	F88 I224 V225 M229 K232	F88-S227 VanDerWaalsContact CZ-CB 3.42Å; I224-S227 WeakPolarHBondContact O-CB 3.16Å; I224-S227 PolarHBondContact O-N 3.2Å; I224-S227 PolarHBondContact O-OG 2.96Å; V225-S227 PolarHBondContact O-N 2.94Å; S227-M229 PolarHBondContact O-N 2.93Å; S227-K232 WeakPolarHBondContact O-CE 3.42Å; S227-K232 PolarHBondContact O-NZ 3.27Å
228	G	88.6	Confident	85.8	Confident	60 Å²	60	53.3 Å²	53.3	62%	0.619	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-74.7	-11.4	177	0	0	0	0	0	113.9	G226	G226-G228 VanDerWaalsContact C-N 3.26Å; G226-G228 PolarHBondContact O-N 2.92Å; G226-G228 VanDerWaalsContact O-N 3.09Å
229	M	88.8	Confident	85.1	Confident	72 Å²	72	52.1 Å²	52.1	36%	0.355	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-13.3	-173.1	-57	176.4	59.9	0	0	113.3	L21 F25 G226 S227	L21-M229 HydrophobicContact CB-CE 3.54Å; L21-M229 HydrophobicContact CD2-CE 3.76Å; L21-M229 HydrophobicContact CG-CE 3.62Å; F25-M229 HydrophobicContact CE2-SD 3.93Å; G226-M229 WeakPolarHBondContact O-CB 3.47Å; G226-M229 PolarHBondContact O-N 3.3Å; S227-M229 PolarHBondContact O-N 2.93Å
230	Y	90.9	Very high	84.4	Confident	17 Å²	17	54 Å²	54	7%	0.067	33%	0.333	C	S	.	.	S	Bend	trans	-76.4	141.7	-178.5	-59.6	-43.3	0	0	0	113.2	S22 F25 I26 F88 F153 F223 G226 K232	S22-Y230 WeakPolarHBondContact O-CE1 3.45Å; F25-Y230 WeakPolarHBondContact CB-OH 3.38Å; I26-Y230 HydrophobicContact CD1-CD1 4.3Å; I26-Y230 HydrophobicContact CD1-CE1 3.97Å; I26-Y230 HydrophobicContact CG1-CE1 3.78Å; F88-Y230 AromaticContact CD2-CD2 3.76Å; F88-Y230 HydrophobicContact CD2-CD2 3.76Å; F88-Y230 HydrophobicContact CD2-CE2 4.23Å; F88-Y230 AromaticContact CE2-CD2 3.59Å; F88-Y230 HydrophobicContact CE2-CD2 3.59Å; F88-Y230 AromaticContact CE2-CE2 3.8Å; F88-Y230 HydrophobicContact CE2-CE2 3.8Å; F153-Y230 AromaticContact CE1-CD1 3.99Å; F153-Y230 HydrophobicContact CE1-CD1 3.99Å; F153-Y230 AromaticContact CE1-CD2 3.76Å; F153-Y230 HydrophobicContact CE1-CD2 3.76Å; F153-Y230 HydrophobicContact CE1-CE1 4.35Å; F153-Y230 HydrophobicContact CE1-CE2 4.11Å; F153-Y230 AromaticContact CE1-CG 3.72Å; F153-Y230 HydrophobicContact CE1-CG 3.72Å; F153-Y230 HydrophobicContact CZ-CD1 4.25Å; F153-Y230 AromaticContact CZ-CD2 3.69Å; F153-Y230 HydrophobicContact CZ-CD2 3.69Å; F153-Y230 HydrophobicContact CZ-CE2 4.46Å; F153-Y230 AromaticContact CZ-CG 3.59Å; F153-Y230 HydrophobicContact CZ-CG 3.59Å; F223-Y230 HydrophobicContact CD2-CE2 4.33Å; F223-Y230 HydrophobicContact CE1-CE2 4.42Å; F223-Y230 HydrophobicContact CE2-CE2 4.17Å; F223-Y230 HydrophobicContact CZ-CE2 4.21Å; F223-Y230 VanDerWaalsContact O-CE2 3.22Å; F223-Y230 WeakPolarHBondContact O-CE2 3.28Å; F223-Y230 PolarHBondContact O-OH 2.89Å; G226-Y230 VanDerWaalsContact C-CE2 3.45Å; G226-Y230 WeakPolarHBondContact O-CD2 3.13Å; G226-Y230 PolarHBondContact O-N 3.05Å; Y230-K232 PolarHBondContact O-N 3.48Å
231	N	85.8	Confident	83.7	Confident	81 Å²	81	55.4 Å²	55.4	43%	0.433	34%	0.342	S	S	.	.			trans	-75	113.6	161.6	-170.1	19	0	0	0	109	D156 Q157	D156-N231 PolarHBondContact O-ND2 3.22Å; Q157-N231 PolarHBondContact NE2-O 2.86Å
232	K	87.6	Confident	83.1	Confident	104 Å²	104	57.1 Å²	57.1	45%	0.452	34%	0.343	S	S	.	.			trans	-104.1	96.4	-178.4	-64.2	173.4	-168.8	168.4	0	108.7	F88 S227 Y230	F88-K232 HydrophobicContact CB-CG 4.3Å; F88-K232 HydrophobicContact CD1-CD 4.13Å; F88-K232 HydrophobicContact CG-CD 4.26Å; F88-K232 HydrophobicContact CG-CG 4.4Å; S227-K232 WeakPolarHBondContact O-CE 3.42Å; S227-K232 PolarHBondContact O-NZ 3.27Å; Y230-K232 PolarHBondContact O-N 3.48Å
233	T	75.9	Confident	82.7	Confident	61 Å²	61	55.3 Å²	55.3	37%	0.374	33%	0.334	S	S	.	.			trans	-69.3	142.6	176.4	47.4	0	0	0	0	110.6	D156	D156-T233 HydrophobicContact CB-CG2 4.46Å; D156-T233 PolarHBondContact OD2-OG1 3.13Å
234	A	73.8	Confident	82.3	Confident	79 Å²	79	61.9 Å²	61.9	65%	0.653	36%	0.363	S	S	*	.			trans	-69.5	151.5	175.1	0	0	0	0	0	110.2	T236	A234-T236 PolarHBondContact O-N 3.26Å
235	P	72.1	Confident	81.9	Confident	67 Å²	67	64.5 Å²	64.5	44%	0.435	37%	0.372	S	S	.	.			trans	-60.3	113.3	179	-18	29.6	0	0	0	110.9	D82 G237	D82-P235 WeakPolarHBondContact O-CB 3.14Å; P235-G237 PolarHBondContact O-N 3.26Å
236	T	64	Low	81.6	Confident	104 Å²	104	59.9 Å²	59.9	64%	0.638	34%	0.343	S	S	*	.			trans	-83.9	109.8	171	49.5	0	0	0	0	107.3	A234	A234-T236 PolarHBondContact O-N 3.26Å
237	G	68.4	Low	81.4	Confident	44 Å²	44	61.4 Å²	61.4	45%	0.454	35%	0.351	S	S	.	.			trans	-43.8	146.1	-168.9	0	0	0	0	0	115.3	P235 I239	P235-G237 PolarHBondContact O-N 3.26Å; G237-I239 PolarHBondContact O-N 3.1Å; G237-I239 VanDerWaalsContact O-N 3.15Å
238	N	73	Confident	81.1	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.07	36%	0.356	C	S	.	.			trans	-65.4	110.2	-161.4	-171.9	-26.7	0	0	0	115.1	I79 D82 S83 M240 V241 K242	I79-N238 WeakPolarHBondContact CA-ND2 3.38Å; I79-N238 WeakPolarHBondContact CG1-ND2 3.23Å; D82-N238 HydrophobicContact CB-CB 4.24Å; S83-N238 VanDerWaalsContact OG-CB 3.31Å; S83-N238 WeakPolarHBondContact OG-CB 3.31Å; S83-N238 PolarHBondContact OG-ND2 2.85Å; N238-M240 WeakPolarHBondContact OD1-CA 3.3Å; N238-M240 WeakPolarHBondContact OD1-CB 3.13Å; N238-M240 PolarHBondContact OD1-N 3.24Å; N238-V241 HydrophobicContact CB-CB 4.12Å; N238-V241 HydrophobicContact CB-CG2 4.04Å; N238-V241 WeakPolarHBondContact ND2-CG2 3.41Å; N238-V241 PolarHBondContact O-N 2.99Å; N238-V241 PolarHBondContact OD1-N 3.02Å; N238-K242 PolarHBondContact O-N 3.46Å; N238-K242 VanDerWaalsContact O-N 3.15Å
239	I	78.5	Confident	81.1	Confident	43 Å²	43	61.9 Å²	61.9	22%	0.221	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-38.9	176.6	-69.2	148.8	0	0	0	111.4	G237 V241 K242 V243 N616 M617 V620	G237-I239 PolarHBondContact O-N 3.1Å; G237-I239 VanDerWaalsContact O-N 3.15Å; I239-V241 VanDerWaalsContact C-N 3.33Å; I239-V241 PolarHBondContact O-N 3.33Å; I239-K242 WeakPolarHBondContact O-CB 3.31Å; I239-K242 PolarHBondContact O-N 3.42Å; I239-K242 VanDerWaalsContact O-N 3.14Å; I239-V243 HydrophobicContact CG2-CG2 4.21Å; I239-V243 VanDerWaalsContact O-CG2 3.32Å; I239-V243 WeakPolarHBondContact O-CG2 3.43Å; I239-V243 PolarHBondContact O-N 3.01Å; I239-N616 WeakPolarHBondContact CD1-O 3.14Å; I239-M617 HydrophobicContact CG2-CG 3.89Å; I239-V620 HydrophobicContact CG2-CG2 4.05Å
240	M	77.9	Confident	80.9	Confident	39 Å²	39	58.4 Å²	58.4	19%	0.192	32%	0.321	C	S	.	.	H	α-helix	trans	-60.6	-42.5	177.9	-171.6	-171.8	-80.5	0	0	111.5	I75 N238 V243 F244 V620 A623	I75-M240 HydrophobicContact CG2-SD 3.9Å; N238-M240 WeakPolarHBondContact OD1-CA 3.3Å; N238-M240 WeakPolarHBondContact OD1-CB 3.13Å; N238-M240 PolarHBondContact OD1-N 3.24Å; M240-V243 PolarHBondContact O-N 3.35Å; M240-F244 PolarHBondContact O-N 3.27Å; M240-V620 HydrophobicContact CB-CG2 4.25Å; M240-A623 HydrophobicContact CE-CB 3.22Å
241	V	80.9	Confident	80.7	Confident	49 Å²	49	61.8 Å²	61.8	30%	0.297	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-38.9	175.3	172.5	0	0	0	0	111.3	N238 I239 F244 K245	N238-V241 HydrophobicContact CB-CB 4.12Å; N238-V241 HydrophobicContact CB-CG2 4.04Å; N238-V241 WeakPolarHBondContact ND2-CG2 3.41Å; N238-V241 PolarHBondContact O-N 2.99Å; N238-V241 PolarHBondContact OD1-N 3.02Å; I239-V241 VanDerWaalsContact C-N 3.33Å; I239-V241 PolarHBondContact O-N 3.33Å; V241-F244 PolarHBondContact O-N 3.06Å; V241-K245 HydrophobicContact CG1-CD 3.99Å; V241-K245 HydrophobicContact CG1-CG 4.35Å; V241-K245 WeakPolarHBondContact O-CB 3.12Å; V241-K245 VanDerWaalsContact O-CG 3.31Å; V241-K245 WeakPolarHBondContact O-CG 3.5Å; V241-K245 PolarHBondContact O-N 3.39Å
242	K	82.2	Confident	80.7	Confident	118 Å²	118	65.2 Å²	65.2	51%	0.513	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-45	174.4	-72.3	178.8	179.5	178.2	0	111.5	N238 I239 K245 C246	N238-K242 PolarHBondContact O-N 3.46Å; N238-K242 VanDerWaalsContact O-N 3.15Å; I239-K242 WeakPolarHBondContact O-CB 3.31Å; I239-K242 PolarHBondContact O-N 3.42Å; I239-K242 VanDerWaalsContact O-N 3.14Å; K242-K245 PolarHBondContact O-N 3.49Å; K242-C246 VanDerWaalsContact O-CB 3.28Å; K242-C246 WeakPolarHBondContact O-CB 3.16Å; K242-C246 PolarHBondContact O-N 3.38Å
243	V	84.3	Confident	80.6	Confident	7 Å²	7	61 Å²	61	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-49.3	176.6	170.6	0	0	0	0	110.5	I239 M240 K245 C246 I247 V284 M617 V620	I239-V243 HydrophobicContact CG2-CG2 4.21Å; I239-V243 VanDerWaalsContact O-CG2 3.32Å; I239-V243 WeakPolarHBondContact O-CG2 3.43Å; I239-V243 PolarHBondContact O-N 3.01Å; M240-V243 PolarHBondContact O-N 3.35Å; V243-K245 PolarHBondContact O-N 3.49Å; V243-C246 WeakPolarHBondContact O-CB 3.49Å; V243-C246 PolarHBondContact O-N 2.88Å; V243-I247 HydrophobicContact CG1-CD1 3.72Å; V243-I247 HydrophobicContact CG1-CG1 4.47Å; V243-I247 VanDerWaalsContact O-CG1 3.31Å; V243-I247 WeakPolarHBondContact O-CG1 3.27Å; V243-I247 PolarHBondContact O-N 3.02Å; V243-V284 HydrophobicContact CB-CG2 4.48Å; V243-V284 HydrophobicContact CG1-CG1 4.41Å; V243-V284 HydrophobicContact CG1-CG2 4.17Å; V243-V284 HydrophobicContact CG2-CG2 4.12Å; V243-M617 HydrophobicContact CG2-CE 3.71Å; V243-M617 HydrophobicContact CG2-CG 4.48Å; V243-M617 HydrophobicContact CG2-SD 3.84Å; V243-V620 HydrophobicContact CG2-CG2 4.45Å
244	F	85.8	Confident	80.9	Confident	139 Å²	139	64.5 Å²	64.5	61%	0.61	34%	0.339	S	S	*	.	H	α-helix	trans	-60.6	-47.4	178.6	-172.3	-98.1	0	0	0	111.9	M240 V241 C246 I247 S248	M240-F244 PolarHBondContact O-N 3.27Å; V241-F244 PolarHBondContact O-N 3.06Å; F244-C246 VanDerWaalsContact C-N 3.3Å; F244-C246 PolarHBondContact O-N 2.94Å; F244-I247 PolarHBondContact O-N 2.93Å; F244-S248 WeakPolarHBondContact O-CB 3.3Å; F244-S248 PolarHBondContact O-N 2.83Å; F244-S248 PolarHBondContact O-OG 3.38Å
245	K	86.9	Confident	81.3	Confident	125 Å²	125	68.7 Å²	68.7	54%	0.543	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-34.5	176.7	-74.1	179	178.5	176.5	0	112.9	V241 K242 V243 F249 Y276	V241-K245 HydrophobicContact CG1-CD 3.99Å; V241-K245 HydrophobicContact CG1-CG 4.35Å; V241-K245 WeakPolarHBondContact O-CB 3.12Å; V241-K245 VanDerWaalsContact O-CG 3.31Å; V241-K245 WeakPolarHBondContact O-CG 3.5Å; V241-K245 PolarHBondContact O-N 3.39Å; K242-K245 PolarHBondContact O-N 3.49Å; V243-K245 PolarHBondContact O-N 3.49Å; K245-F249 WeakPolarHBondContact O-CB 3.44Å; K245-F249 PolarHBondContact O-N 3.31Å; K245-Y276 WeakPolarHBondContact CB-OH 3.29Å; K245-Y276 PolarHBondContact O-OH 3.4Å
246	C	86.3	Confident	81.5	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.9	-49.8	174.6	-175.6	0	0	0	0	110.7	K242 V243 F244 F249 A250 Y276	K242-C246 VanDerWaalsContact O-CB 3.28Å; K242-C246 WeakPolarHBondContact O-CB 3.16Å; K242-C246 PolarHBondContact O-N 3.38Å; V243-C246 WeakPolarHBondContact O-CB 3.49Å; V243-C246 PolarHBondContact O-N 2.88Å; F244-C246 VanDerWaalsContact C-N 3.3Å; F244-C246 PolarHBondContact O-N 2.94Å; C246-F249 PolarHBondContact O-N 3.19Å; C246-A250 PolarHBondContact O-N 2.97Å; C246-Y276 HydrophobicContact CB-CD1 4.35Å; C246-Y276 HydrophobicContact CB-CD2 4.28Å; C246-Y276 HydrophobicContact CB-CE1 4.28Å; C246-Y276 HydrophobicContact CB-CE2 4.21Å; C246-Y276 HydrophobicContact CB-CG 4.33Å
247	I	86.4	Confident	81.9	Confident	32 Å²	32	72.2 Å²	72.2	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-60.7	-50.4	177.5	-64.7	165.1	0	0	0	111.1	V243 F244 F249 A250 I251 W268 M269 V284 L288	V243-I247 HydrophobicContact CG1-CD1 3.72Å; V243-I247 HydrophobicContact CG1-CG1 4.47Å; V243-I247 VanDerWaalsContact O-CG1 3.31Å; V243-I247 WeakPolarHBondContact O-CG1 3.27Å; V243-I247 PolarHBondContact O-N 3.02Å; F244-I247 PolarHBondContact O-N 2.93Å; I247-F249 VanDerWaalsContact C-N 3.29Å; I247-F249 PolarHBondContact O-N 3.31Å; I247-A250 PolarHBondContact O-N 3.38Å; I247-I251 HydrophobicContact CG2-CD1 3.79Å; I247-I251 HydrophobicContact CG2-CG1 4.48Å; I247-I251 WeakPolarHBondContact O-CG1 3.33Å; I247-I251 PolarHBondContact O-N 3.43Å; I247-W268 HydrophobicContact CG2-CH2 4.25Å; I247-W268 HydrophobicContact CG2-CZ3 4.47Å; I247-M269 HydrophobicContact CG1-CE 3.93Å; I247-M269 HydrophobicContact CG1-SD 4.5Å; I247-V284 HydrophobicContact CD1-CG1 4.09Å; I247-V284 HydrophobicContact CG1-CG1 3.72Å; I247-L288 HydrophobicContact CD1-CD1 4.48Å; I247-L288 HydrophobicContact CD1-CD2 4.01Å; I247-L288 HydrophobicContact CD1-CG 4.47Å; I247-L288 HydrophobicContact CG1-CD1 4.45Å
248	S	86.2	Confident	81.7	Confident	50 Å²	50	79 Å²	79	35%	0.35	35%	0.347	S	S	.	.	H	α-helix	trans	-61.2	-38.4	179.5	-55.8	0	0	0	0	112	F244 K252	F244-S248 WeakPolarHBondContact O-CB 3.3Å; F244-S248 PolarHBondContact O-N 2.83Å; F244-S248 PolarHBondContact O-OG 3.38Å; S248-K252 VanDerWaalsContact O-CB 3.26Å; S248-K252 WeakPolarHBondContact O-CB 3.47Å; S248-K252 PolarHBondContact O-N 3.16Å
249	F	87.7	Confident	81.2	Confident	55 Å²	55	81.9 Å²	81.9	24%	0.241	37%	0.368	C	S	.	.	H	α-helix	trans	-66.3	-45.2	175.5	-177.9	-94.1	0	0	0	111.5	K245 C246 I247 I251 K252 N253 A272 K275 Y276	K245-F249 WeakPolarHBondContact O-CB 3.44Å; K245-F249 PolarHBondContact O-N 3.31Å; C246-F249 PolarHBondContact O-N 3.19Å; I247-F249 VanDerWaalsContact C-N 3.29Å; I247-F249 PolarHBondContact O-N 3.31Å; F249-I251 VanDerWaalsContact C-N 3.34Å; F249-I251 PolarHBondContact O-N 2.86Å; F249-K252 PolarHBondContact O-N 3.15Å; F249-N253 HydrophobicContact CE1-CB 4.48Å; F249-N253 VanDerWaalsContact O-CB 3.25Å; F249-N253 WeakPolarHBondContact O-CB 3.49Å; F249-N253 PolarHBondContact O-N 3.18Å; F249-A272 HydrophobicContact CD1-CB 4.39Å; F249-K275 HydrophobicContact CD1-CB 4.22Å; F249-K275 HydrophobicContact CD2-CD 4Å; F249-K275 HydrophobicContact CE1-CB 3.7Å; F249-K275 HydrophobicContact CE2-CB 4.4Å; F249-K275 HydrophobicContact CE2-CD 3.86Å; F249-K275 HydrophobicContact CG-CD 4.39Å; F249-K275 HydrophobicContact CZ-CB 3.81Å; F249-K275 HydrophobicContact CZ-CD 4.13Å; F249-Y276 HydrophobicContact CB-CE2 3.89Å; F249-Y276 HydrophobicContact CD1-CD2 4.25Å; F249-Y276 HydrophobicContact CD1-CE2 4.02Å; F249-Y276 HydrophobicContact CG-CE2 4.02Å
250	A	85.1	Confident	80.1	Confident	0 Å²	0	86 Å²	86	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-57.5	-46	176.3	0	0	0	0	0	111.9	C246 I247 N253 R254 W268 M269 A272	C246-A250 PolarHBondContact O-N 2.97Å; I247-A250 PolarHBondContact O-N 3.38Å; A250-N253 PolarHBondContact O-N 3.41Å; A250-R254 VanDerWaalsContact O-CB 3.27Å; A250-R254 WeakPolarHBondContact O-CB 3.46Å; A250-R254 PolarHBondContact O-N 3.15Å; A250-W268 HydrophobicContact CB-CE3 4.49Å; A250-W268 HydrophobicContact CB-CZ3 4.37Å; A250-M269 HydrophobicContact CB-SD 3.65Å; A250-A272 HydrophobicContact CB-CB 4.08Å
251	I	86.1	Confident	79.1	Confident	88 Å²	88	93.5 Å²	93.5	45%	0.451	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-48	178.6	-65.8	169.8	0	0	0	110.8	I247 F249 N253 R254 Y255 W268	I247-I251 HydrophobicContact CG2-CD1 3.79Å; I247-I251 HydrophobicContact CG2-CG1 4.48Å; I247-I251 WeakPolarHBondContact O-CG1 3.33Å; I247-I251 PolarHBondContact O-N 3.43Å; F249-I251 VanDerWaalsContact C-N 3.34Å; F249-I251 PolarHBondContact O-N 2.86Å; I251-N253 VanDerWaalsContact C-N 3.33Å; I251-N253 PolarHBondContact O-N 2.95Å; I251-R254 PolarHBondContact O-N 3.25Å; I251-Y255 PolarHBondContact O-N 2.78Å; I251-W268 HydrophobicContact CD1-CZ3 4.41Å; I251-W268 HydrophobicContact CG1-CE3 4.47Å; I251-W268 HydrophobicContact CG1-CZ3 3.86Å
252	K	86.1	Confident	78.3	Confident	153 Å²	153	94.7 Å²	94.7	67%	0.665	44%	0.437	S	S	*	.	H	α-helix	trans	-61.6	-42.5	179.4	-173.1	174.8	-177.2	174.3	0	111.5	S248 F249 Y255 R256	S248-K252 VanDerWaalsContact O-CB 3.26Å; S248-K252 WeakPolarHBondContact O-CB 3.47Å; S248-K252 PolarHBondContact O-N 3.16Å; F249-K252 PolarHBondContact O-N 3.15Å; K252-Y255 PolarHBondContact O-N 3.33Å; K252-R256 WeakPolarHBondContact O-CB 3.39Å; K252-R256 PolarHBondContact O-N 2.9Å
253	N	84.1	Confident	77.4	Confident	15 Å²	15	94.3 Å²	94.3	8%	0.08	45%	0.446	C	S	.	.	H	α-helix	trans	-68.9	-39.7	179.5	-156.5	23.3	0	0	0	111.4	F249 A250 I251 Y255 R256 N257 W271 E274	F249-N253 HydrophobicContact CE1-CB 4.48Å; F249-N253 VanDerWaalsContact O-CB 3.25Å; F249-N253 WeakPolarHBondContact O-CB 3.49Å; F249-N253 PolarHBondContact O-N 3.18Å; A250-N253 PolarHBondContact O-N 3.41Å; I251-N253 VanDerWaalsContact C-N 3.33Å; I251-N253 PolarHBondContact O-N 2.95Å; N253-Y255 VanDerWaalsContact C-N 3.33Å; N253-Y255 PolarHBondContact O-N 2.91Å; N253-R256 PolarHBondContact O-N 3.18Å; N253-N257 VanDerWaalsContact O-CB 3.31Å; N253-N257 WeakPolarHBondContact O-CB 3.31Å; N253-N257 PolarHBondContact O-N 3.19Å; N253-N257 PolarHBondContact OD1-ND2 3.47Å; N253-W271 HydrophobicContact CB-CB 4.36Å; N253-W271 PolarHBondContact ND2-O 3.38Å; N253-E274 VanDerWaalsContact ND2-CD 3.31Å; N253-E274 PolarHBondContact ND2-OE1 3.44Å; N253-E274 PolarHBondContact ND2-OE2 2.92Å
254	R	82.6	Confident	76.4	Confident	134 Å²	134	103.9 Å²	103.9	51%	0.506	49%	0.487	S	S	.	.	H	α-helix	trans	-59.1	-42.1	172.2	-177.1	-179	-178.1	-173.3	1	112.4	A250 I251 R258 W271	A250-R254 VanDerWaalsContact O-CB 3.27Å; A250-R254 WeakPolarHBondContact O-CB 3.46Å; A250-R254 PolarHBondContact O-N 3.15Å; I251-R254 PolarHBondContact O-N 3.25Å; R254-R258 PolarHBondContact O-N 2.75Å; R254-W271 HydrophobicContact CB-CD2 4.46Å; R254-W271 HydrophobicContact CB-CG 4.13Å
255	Y	81.8	Confident	75.6	Confident	167 Å²	167	100.8 Å²	100.8	66%	0.655	47%	0.471	S	S	*	.	H	α-helix	trans	-71.7	-38.9	179.6	-138.4	-90.3	0	0	0	112	I251 K252 N253	I251-Y255 PolarHBondContact O-N 2.78Å; K252-Y255 PolarHBondContact O-N 3.33Å; N253-Y255 VanDerWaalsContact C-N 3.33Å; N253-Y255 PolarHBondContact O-N 2.91Å
256	R	78.3	Confident	74.7	Confident	206 Å²	206	104.6 Å²	104.6	78%	0.777	49%	0.491	S	S	*	.	H	α-helix	trans	-67.4	-34.4	177.6	-167.4	175.4	-174.7	176.1	1.4	112.7	K252 N253	K252-R256 WeakPolarHBondContact O-CB 3.39Å; K252-R256 PolarHBondContact O-N 2.9Å; N253-R256 PolarHBondContact O-N 3.18Å
257	N	70.6	Confident	74.3	Confident	39 Å²	39	107.8 Å²	107.8	21%	0.209	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	25	-176	-65.5	-14	0	0	0	113	N253 S259 I262 W271	N253-N257 VanDerWaalsContact O-CB 3.31Å; N253-N257 WeakPolarHBondContact O-CB 3.31Å; N253-N257 PolarHBondContact O-N 3.19Å; N253-N257 PolarHBondContact OD1-ND2 3.47Å; N257-S259 PolarHBondContact O-N 3.33Å; N257-I262 HydrophobicContact CB-CD1 3.75Å; N257-W271 HydrophobicContact CB-CE3 4.2Å; N257-W271 HydrophobicContact CB-CH2 3.78Å; N257-W271 HydrophobicContact CB-CZ3 3.4Å; N257-W271 VanDerWaalsContact CB-CZ3 3.4Å
258	R	65	Low	74.1	Confident	188 Å²	188	110 Å²	110	71%	0.709	51%	0.512	S	S	*	.			trans	-70.5	10.2	179.5	-158.9	177.7	177.7	176.5	-1.2	114.3	R254	R254-R258 PolarHBondContact O-N 2.75Å
259	S	62.3	Low	73.9	Confident	73 Å²	73	107.7 Å²	107.7	51%	0.51	50%	0.496	S	S	.	.	S	Bend	trans	-74.6	141.3	178.1	-176.9	0	0	0	0	111.5	N257 K261 I262	N257-S259 PolarHBondContact O-N 3.33Å; S259-K261 PolarHBondContact O-N 3.19Å; S259-I262 PolarHBondContact O-N 3.09Å
260	S	55.4	Low	73.7	Confident	130 Å²	130	106.3 Å²	106.3	91%	0.909	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-1.4	-175.4	-155.1	0	0	0	0	115.1
261	K	57.8	Low	73.4	Confident	196 Å²	196	107.4 Å²	107.4	85%	0.852	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.8	-178.2	-70.9	-175.2	177.1	-178	0	114.6	S259	S259-K261 PolarHBondContact O-N 3.19Å
262	I	62.8	Low	73.3	Confident	74 Å²	74	103.2 Å²	103.2	38%	0.379	47%	0.474	S	S	.	.	S	Bend	trans	-105.1	130.4	-177.8	-58.1	169.8	0	0	0	108.9	N257 S259 K264 W271	N257-I262 HydrophobicContact CB-CD1 3.75Å; S259-I262 PolarHBondContact O-N 3.09Å; I262-K264 PolarHBondContact O-N 3.38Å; I262-W271 HydrophobicContact CG2-CH2 3.76Å; I262-W271 HydrophobicContact CG2-CZ3 4.23Å
263	P	63.2	Low	73	Confident	110 Å²	110	100 Å²	100	71%	0.714	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-59.7	136.7	180	22.3	-31.7	0	0	0	111.3	R265	P263-R265 PolarHBondContact O-N 3.02Å
264	K	63.2	Low	72.8	Confident	208 Å²	208	104.7 Å²	104.7	90%	0.904	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-67.3	126.1	176.5	-68.8	180	-179.3	174.7	0	109	I262	I262-K264 PolarHBondContact O-N 3.38Å
265	R	68.8	Low	72.8	Confident	74 Å²	74	104.9 Å²	104.9	28%	0.279	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-73.6	152.8	171.4	-56.6	-171.1	-179.1	-127.9	5.6	110.6	P263 H267 D270 E273 E274	P263-R265 PolarHBondContact O-N 3.02Å; R265-H267 PolarHBondContact O-N 3.22Å; R265-D270 HydrophobicContact CB-CB 4.03Å; R265-D270 VanDerWaalsContact CD-C 3.48Å; R265-D270 HydrophobicContact CG-CB 4.45Å; R265-D270 VanDerWaalsContact CZ-O 3.27Å; R265-D270 PolarHBondContact NH1-O 2.95Å; R265-E273 IonicContact CZ-OE2 3.23Å; R265-E273 IonicContact NH1-OE2 2.71Å; R265-E273 PolarHBondContact NH1-OE2 3.19Å; R265-E274 IonicContact NH2-OE1 2.81Å; R265-E274 PolarHBondContact NH2-OE1 3.36Å
266	E	68.9	Low	73	Confident	204 Å²	204	98.8 Å²	98.8	95%	0.953	46%	0.463	S	S	*	.	S	Bend	trans	-61.3	-40.9	-178.1	-69.6	-174.1	167.7	0	0	113.1
267	H	78.8	Confident	73.2	Confident	67 Å²	67	94.9 Å²	94.9	31%	0.31	46%	0.458	S	S	.	.	S	Bend	trans	-125.3	146.1	174.4	-167.8	-90.4	0	0	0	111.5	R265 M269 D270	R265-H267 PolarHBondContact O-N 3.22Å; H267-M269 WeakPolarHBondContact ND1-CB 3.42Å; H267-M269 PolarHBondContact ND1-N 3.47Å; H267-M269 VanDerWaalsContact ND1-N 3.13Å; H267-M269 PolarHBondContact O-N 3.29Å; H267-M269 VanDerWaalsContact O-N 3.15Å; H267-D270 WeakPolarHBondContact CB-OD2 3.37Å; H267-D270 PolarHBondContact N-OD2 3.48Å; H267-D270 VanDerWaalsContact N-OD2 3.09Å; H267-D270 WeakPolarHBondContact O-CB 3.24Å; H267-D270 PolarHBondContact O-N 3.21Å
268	W	80.4	Confident	73.8	Confident	80 Å²	80	98.4 Å²	98.4	30%	0.303	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-65.4	-20.3	-177.4	68.2	-92.7	0	0	0	114.2	I247 A250 I251 D270 W271 L288	I247-W268 HydrophobicContact CG2-CH2 4.25Å; I247-W268 HydrophobicContact CG2-CZ3 4.47Å; A250-W268 HydrophobicContact CB-CE3 4.49Å; A250-W268 HydrophobicContact CB-CZ3 4.37Å; I251-W268 HydrophobicContact CD1-CZ3 4.41Å; I251-W268 HydrophobicContact CG1-CE3 4.47Å; I251-W268 HydrophobicContact CG1-CZ3 3.86Å; W268-D270 VanDerWaalsContact C-N 3.28Å; W268-W271 VanDerWaalsContact O-CD1 3.25Å; W268-L288 HydrophobicContact CH2-CD1 3.74Å; W268-L288 HydrophobicContact CZ2-CD1 3.63Å
269	M	83.3	Confident	74.7	Confident	0 Å²	0	91.9 Å²	91.9	0%	0	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-73.7	-19.9	174.8	-163.9	57.6	66.3	0	0	112.7	I247 A250 H267 W271 A272 I281 V284 K285 L288	I247-M269 HydrophobicContact CG1-CE 3.93Å; I247-M269 HydrophobicContact CG1-SD 4.5Å; A250-M269 HydrophobicContact CB-SD 3.65Å; H267-M269 WeakPolarHBondContact ND1-CB 3.42Å; H267-M269 PolarHBondContact ND1-N 3.47Å; H267-M269 VanDerWaalsContact ND1-N 3.13Å; H267-M269 PolarHBondContact O-N 3.29Å; H267-M269 VanDerWaalsContact O-N 3.15Å; M269-W271 PolarHBondContact O-N 2.91Å; M269-W271 VanDerWaalsContact O-N 3.09Å; M269-A272 WeakPolarHBondContact O-CB 2.99Å; M269-A272 PolarHBondContact O-N 3.49Å; M269-I281 HydrophobicContact CB-CG2 4.41Å; M269-I281 HydrophobicContact CG-CG2 3.94Å; M269-V284 HydrophobicContact CE-CG1 3.75Å; M269-V284 HydrophobicContact CG-CG1 4.47Å; M269-V284 HydrophobicContact SD-CG1 4.1Å; M269-K285 HydrophobicContact CB-CG 3.92Å; M269-K285 HydrophobicContact CG-CG 4.23Å; M269-L288 HydrophobicContact CE-CD1 3.17Å
270	D	83.4	Confident	75.7	Confident	27 Å²	27	89.7 Å²	89.7	14%	0.144	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-68.1	-13.9	-176.9	-61.6	-34.9	0	0	0	112.3	R265 H267 W268 A272 E273 K285	R265-D270 HydrophobicContact CB-CB 4.03Å; R265-D270 VanDerWaalsContact CD-C 3.48Å; R265-D270 HydrophobicContact CG-CB 4.45Å; R265-D270 VanDerWaalsContact CZ-O 3.27Å; R265-D270 PolarHBondContact NH1-O 2.95Å; H267-D270 WeakPolarHBondContact CB-OD2 3.37Å; H267-D270 PolarHBondContact N-OD2 3.48Å; H267-D270 VanDerWaalsContact N-OD2 3.09Å; H267-D270 WeakPolarHBondContact O-CB 3.24Å; H267-D270 PolarHBondContact O-N 3.21Å; W268-D270 VanDerWaalsContact C-N 3.28Å; D270-A272 PolarHBondContact O-N 3.35Å; D270-A272 VanDerWaalsContact O-N 3.09Å; D270-E273 VanDerWaalsContact O-CB 3.25Å; D270-E273 WeakPolarHBondContact O-CB 3.49Å; D270-E273 PolarHBondContact O-N 2.91Å; D270-K285 VanDerWaalsContact CG-NZ 3.3Å; D270-K285 WeakPolarHBondContact OD1-CE 3.45Å; D270-K285 IonicContact OD1-NZ 2.74Å; D270-K285 PolarHBondContact OD1-NZ 3.29Å; D270-K285 IonicContact OD2-NZ 3.48Å; D270-K285 PolarHBondContact OD2-NZ 3.02Å
271	W	78.7	Confident	77.1	Confident	23 Å²	23	83.8 Å²	83.8	9%	0.087	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-63.1	-9.8	170.1	-69.2	94.2	0	0	0	114	N253 R254 N257 I262 W268 M269	N253-W271 HydrophobicContact CB-CB 4.36Å; N253-W271 PolarHBondContact ND2-O 3.38Å; R254-W271 HydrophobicContact CB-CD2 4.46Å; R254-W271 HydrophobicContact CB-CG 4.13Å; N257-W271 HydrophobicContact CB-CE3 4.2Å; N257-W271 HydrophobicContact CB-CH2 3.78Å; N257-W271 HydrophobicContact CB-CZ3 3.4Å; N257-W271 VanDerWaalsContact CB-CZ3 3.4Å; I262-W271 HydrophobicContact CG2-CH2 3.76Å; I262-W271 HydrophobicContact CG2-CZ3 4.23Å; W268-W271 VanDerWaalsContact O-CD1 3.25Å; M269-W271 PolarHBondContact O-N 2.91Å; M269-W271 VanDerWaalsContact O-N 3.09Å
272	A	83.4	Confident	78.5	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-84.8	-10.8	172.2	0	0	0	0	0	114.6	F249 A250 M269 D270 E274 K275 Y276 I281	F249-A272 HydrophobicContact CD1-CB 4.39Å; A250-A272 HydrophobicContact CB-CB 4.08Å; M269-A272 WeakPolarHBondContact O-CB 2.99Å; M269-A272 PolarHBondContact O-N 3.49Å; D270-A272 PolarHBondContact O-N 3.35Å; D270-A272 VanDerWaalsContact O-N 3.09Å; A272-E274 PolarHBondContact O-N 3.03Å; A272-E274 VanDerWaalsContact O-N 3.07Å; A272-K275 PolarHBondContact O-N 3.5Å; A272-Y276 HydrophobicContact CB-CD2 4.05Å; A272-Y276 PolarHBondContact O-N 2.8Å; A272-I281 HydrophobicContact CB-CD1 3.9Å; A272-I281 HydrophobicContact CB-CG1 4.05Å
273	E	80.1	Confident	79.7	Confident	84 Å²	84	71.9 Å²	71.9	39%	0.393	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.9	-173.8	-168.5	-177.6	-171.6	0	0	113.5	R265 D270 K275 K278 I281	R265-E273 IonicContact CZ-OE2 3.23Å; R265-E273 IonicContact NH1-OE2 2.71Å; R265-E273 PolarHBondContact NH1-OE2 3.19Å; D270-E273 VanDerWaalsContact O-CB 3.25Å; D270-E273 WeakPolarHBondContact O-CB 3.49Å; D270-E273 PolarHBondContact O-N 2.91Å; E273-K275 PolarHBondContact O-N 3.48Å; E273-K278 HydrophobicContact CG-CG 4.39Å; E273-K278 WeakPolarHBondContact OE1-CE 3.47Å; E273-K278 IonicContact OE1-NZ 3.4Å; E273-K278 PolarHBondContact OE1-NZ 3.37Å; E273-I281 VanDerWaalsContact CA-CD1 3.45Å; E273-I281 HydrophobicContact CB-CD1 4.01Å
274	E	79.8	Confident	80.8	Confident	115 Å²	115	66.6 Å²	66.6	54%	0.537	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-22.2	176.2	-69.5	167.8	-158.9	0	0	113.4	N253 R265 A272	N253-E274 VanDerWaalsContact ND2-CD 3.31Å; N253-E274 PolarHBondContact ND2-OE1 3.44Å; N253-E274 PolarHBondContact ND2-OE2 2.92Å; R265-E274 IonicContact NH2-OE1 2.81Å; R265-E274 PolarHBondContact NH2-OE1 3.36Å; A272-E274 PolarHBondContact O-N 3.03Å; A272-E274 VanDerWaalsContact O-N 3.07Å
275	K	82.4	Confident	82.1	Confident	137 Å²	137	59.7 Å²	59.7	60%	0.596	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-24.3	-173.1	-174.8	171	-178.8	175.9	0	114.2	F249 A272 E273	F249-K275 HydrophobicContact CD1-CB 4.22Å; F249-K275 HydrophobicContact CD2-CD 4Å; F249-K275 HydrophobicContact CE1-CB 3.7Å; F249-K275 HydrophobicContact CE2-CB 4.4Å; F249-K275 HydrophobicContact CE2-CD 3.86Å; F249-K275 HydrophobicContact CG-CD 4.39Å; F249-K275 HydrophobicContact CZ-CB 3.81Å; F249-K275 HydrophobicContact CZ-CD 4.13Å; A272-K275 PolarHBondContact O-N 3.5Å; E273-K275 PolarHBondContact O-N 3.48Å
276	Y	85.6	Confident	83	Confident	39 Å²	39	56.5 Å²	56.5	15%	0.153	26%	0.263	C	S	.	.	S	Bend	trans	-124.6	149	-172.2	-64.8	-82.7	0	0	0	111.7	K245 C246 F249 A272 L280 I281	K245-Y276 WeakPolarHBondContact CB-OH 3.29Å; K245-Y276 PolarHBondContact O-OH 3.4Å; C246-Y276 HydrophobicContact CB-CD1 4.35Å; C246-Y276 HydrophobicContact CB-CD2 4.28Å; C246-Y276 HydrophobicContact CB-CE1 4.28Å; C246-Y276 HydrophobicContact CB-CE2 4.21Å; C246-Y276 HydrophobicContact CB-CG 4.33Å; F249-Y276 HydrophobicContact CB-CE2 3.89Å; F249-Y276 HydrophobicContact CD1-CD2 4.25Å; F249-Y276 HydrophobicContact CD1-CE2 4.02Å; F249-Y276 HydrophobicContact CG-CE2 4.02Å; A272-Y276 HydrophobicContact CB-CD2 4.05Å; A272-Y276 PolarHBondContact O-N 2.8Å; Y276-L280 HydrophobicContact CD1-CD2 3.71Å; Y276-L280 HydrophobicContact CG-CD2 4.32Å; Y276-I281 WeakPolarHBondContact O-CD1 3.42Å
277	D	83.6	Confident	83.9	Confident	125 Å²	125	46.9 Å²	46.9	67%	0.668	22%	0.218	S	C	*	.			trans	-62.1	143.2	-179	-56.1	-43.8	0	0	0	112.1	L279 L280 I281	D277-L279 PolarHBondContact O-N 3.37Å; D277-L280 HydrophobicContact CB-CB 4.42Å; D277-L280 WeakPolarHBondContact O-CB 3.44Å; D277-L280 PolarHBondContact O-N 2.72Å; D277-I281 WeakPolarHBondContact O-CG1 3.32Å; D277-I281 PolarHBondContact O-N 3.09Å
278	K	83.4	Confident	84.5	Confident	113 Å²	113	45.8 Å²	45.8	49%	0.491	21%	0.214	S	C	.	.	H	α-helix	trans	-56.7	-37.2	178.6	-71.2	177.5	172.1	176.7	0	112.7	E273 I281 A282 F685	E273-K278 HydrophobicContact CG-CG 4.39Å; E273-K278 WeakPolarHBondContact OE1-CE 3.47Å; E273-K278 IonicContact OE1-NZ 3.4Å; E273-K278 PolarHBondContact OE1-NZ 3.37Å; K278-I281 PolarHBondContact O-N 3.12Å; K278-A282 WeakPolarHBondContact O-CB 3.46Å; K278-A282 PolarHBondContact O-N 2.93Å; K278-F685 HydrophobicContact CB-CD1 4.5Å; K278-F685 HydrophobicContact CB-CE1 4.15Å
279	L	83.8	Confident	84.9	Confident	50 Å²	50	44.8 Å²	44.8	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-62	-48.1	175.2	177	63.1	0	0	0	111.1	D277 I281 A282 Q283 E682 F685	D277-L279 PolarHBondContact O-N 3.37Å; L279-I281 VanDerWaalsContact C-N 3.31Å; L279-I281 PolarHBondContact O-N 3.47Å; L279-A282 PolarHBondContact O-N 3.15Å; L279-Q283 HydrophobicContact CD1-CG 4.31Å; L279-Q283 VanDerWaalsContact O-CG 3.31Å; L279-Q283 WeakPolarHBondContact O-CG 3.34Å; L279-Q283 PolarHBondContact O-N 3.14Å; L279-E682 HydrophobicContact CD1-CG 4.37Å; L279-F685 HydrophobicContact CB-CB 4.39Å; L279-F685 HydrophobicContact CD1-CB 3.86Å; L279-F685 HydrophobicContact CD1-CD2 4.14Å; L279-F685 HydrophobicContact CD1-CG 4.22Å
280	L	84.1	Confident	85.3	Confident	28 Å²	28	44.9 Å²	44.9	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-43	178.1	-174.9	71.8	0	0	0	110.9	Y276 D277 A282 Q283 V284 M617	Y276-L280 HydrophobicContact CD1-CD2 3.71Å; Y276-L280 HydrophobicContact CG-CD2 4.32Å; D277-L280 HydrophobicContact CB-CB 4.42Å; D277-L280 WeakPolarHBondContact O-CB 3.44Å; D277-L280 PolarHBondContact O-N 2.72Å; L280-A282 PolarHBondContact O-N 3.28Å; L280-Q283 PolarHBondContact O-N 2.91Å; L280-V284 VanDerWaalsContact O-CG2 3.27Å; L280-V284 WeakPolarHBondContact O-CG2 3.49Å; L280-V284 PolarHBondContact O-N 2.88Å; L280-M617 HydrophobicContact CD1-CE 3.4Å; L280-M617 VanDerWaalsContact CD1-CE 3.4Å; L280-M617 HydrophobicContact CG-CE 4.44Å
281	I	84.8	Confident	85.7	Confident	5 Å²	5	46 Å²	46	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-45	176.8	-68.6	171.4	0	0	0	110.9	M269 A272 E273 Y276 D277 K278 L279 V284 K285	M269-I281 HydrophobicContact CB-CG2 4.41Å; M269-I281 HydrophobicContact CG-CG2 3.94Å; A272-I281 HydrophobicContact CB-CD1 3.9Å; A272-I281 HydrophobicContact CB-CG1 4.05Å; E273-I281 VanDerWaalsContact CA-CD1 3.45Å; E273-I281 HydrophobicContact CB-CD1 4.01Å; Y276-I281 WeakPolarHBondContact O-CD1 3.42Å; D277-I281 WeakPolarHBondContact O-CG1 3.32Å; D277-I281 PolarHBondContact O-N 3.09Å; K278-I281 PolarHBondContact O-N 3.12Å; L279-I281 VanDerWaalsContact C-N 3.31Å; L279-I281 PolarHBondContact O-N 3.47Å; I281-V284 PolarHBondContact O-N 3.43Å; I281-K285 WeakPolarHBondContact O-CG 3.4Å; I281-K285 PolarHBondContact O-N 3.11Å
282	A	86.3	Confident	86.4	Confident	14 Å²	14	50.9 Å²	50.9	12%	0.116	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-42	176.4	0	0	0	0	0	112.1	K278 L279 L280 K285 M286 I681 F685	K278-A282 WeakPolarHBondContact O-CB 3.46Å; K278-A282 PolarHBondContact O-N 2.93Å; L279-A282 PolarHBondContact O-N 3.15Å; L280-A282 PolarHBondContact O-N 3.28Å; A282-K285 WeakPolarHBondContact O-CB 3.36Å; A282-K285 PolarHBondContact O-N 2.84Å; A282-M286 WeakPolarHBondContact O-CG 3.17Å; A282-M286 PolarHBondContact O-N 2.93Å; A282-M286 VanDerWaalsContact O-N 3.1Å; A282-I681 HydrophobicContact CB-CG2 4.45Å; A282-F685 HydrophobicContact CB-CD2 4.37Å; A282-F685 HydrophobicContact CB-CE2 3.61Å; A282-F685 HydrophobicContact CB-CZ 4Å
283	Q	87.1	Confident	86.8	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-42.9	175.4	-69.4	177	-32.1	0	0	112.1	L279 L280 K285 M286 V287 P614 N616 M617 E682	L279-Q283 HydrophobicContact CD1-CG 4.31Å; L279-Q283 VanDerWaalsContact O-CG 3.31Å; L279-Q283 WeakPolarHBondContact O-CG 3.34Å; L279-Q283 PolarHBondContact O-N 3.14Å; L280-Q283 PolarHBondContact O-N 2.91Å; Q283-K285 VanDerWaalsContact C-N 3.34Å; Q283-K285 PolarHBondContact O-N 3.34Å; Q283-M286 HydrophobicContact CB-CE 4.38Å; Q283-M286 HydrophobicContact CG-CE 3.99Å; Q283-M286 WeakPolarHBondContact O-CB 3.29Å; Q283-M286 PolarHBondContact O-N 3.22Å; Q283-V287 PolarHBondContact O-N 3.01Å; Q283-P614 HydrophobicContact CB-CB 4.08Å; Q283-P614 HydrophobicContact CB-CG 3.86Å; Q283-P614 HydrophobicContact CG-CB 3.84Å; Q283-P614 HydrophobicContact CG-CG 4.09Å; Q283-N616 VanDerWaalsContact CD-OD1 3.3Å; Q283-N616 PolarHBondContact NE2-ND2 2.94Å; Q283-N616 PolarHBondContact NE2-OD1 2.9Å; Q283-N616 VanDerWaalsContact NE2-OD1 3.13Å; Q283-N616 PolarHBondContact OE1-ND2 2.9Å; Q283-N616 PolarHBondContact OE1-OD1 3.03Å; Q283-M617 HydrophobicContact CB-CE 3.57Å; Q283-M617 HydrophobicContact CB-SD 3.77Å; Q283-E682 PolarHBondContact NE2-OE1 3.15Å
284	V	87.9	Confident	87.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-39.5	174.7	175.5	0	0	0	0	111.4	V243 I247 M269 L280 I281 M286 V287 L288 M617	V243-V284 HydrophobicContact CB-CG2 4.48Å; V243-V284 HydrophobicContact CG1-CG1 4.41Å; V243-V284 HydrophobicContact CG1-CG2 4.17Å; V243-V284 HydrophobicContact CG2-CG2 4.12Å; I247-V284 HydrophobicContact CD1-CG1 4.09Å; I247-V284 HydrophobicContact CG1-CG1 3.72Å; M269-V284 HydrophobicContact CE-CG1 3.75Å; M269-V284 HydrophobicContact CG-CG1 4.47Å; M269-V284 HydrophobicContact SD-CG1 4.1Å; L280-V284 VanDerWaalsContact O-CG2 3.27Å; L280-V284 WeakPolarHBondContact O-CG2 3.49Å; L280-V284 PolarHBondContact O-N 2.88Å; I281-V284 PolarHBondContact O-N 3.43Å; V284-M286 VanDerWaalsContact C-N 3.31Å; V284-M286 PolarHBondContact O-N 2.88Å; V284-V287 PolarHBondContact O-N 2.92Å; V284-L288 HydrophobicContact CG1-CD1 3.99Å; V284-L288 HydrophobicContact CG1-CG 4.26Å; V284-L288 WeakPolarHBondContact O-CB 3.32Å; V284-L288 WeakPolarHBondContact O-CG 3.42Å; V284-L288 PolarHBondContact O-N 3.16Å; V284-M617 HydrophobicContact CG2-CE 4.03Å; V284-M617 HydrophobicContact CG2-SD 4.5Å
285	K	89.4	Confident	88.2	Confident	63 Å²	63	47.4 Å²	47.4	27%	0.274	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-41	174.2	-72	177	-175.2	-178.1	0	111.7	M269 D270 I281 A282 Q283 K289	M269-K285 HydrophobicContact CB-CG 3.92Å; M269-K285 HydrophobicContact CG-CG 4.23Å; D270-K285 VanDerWaalsContact CG-NZ 3.3Å; D270-K285 WeakPolarHBondContact OD1-CE 3.45Å; D270-K285 IonicContact OD1-NZ 2.74Å; D270-K285 PolarHBondContact OD1-NZ 3.29Å; D270-K285 IonicContact OD2-NZ 3.48Å; D270-K285 PolarHBondContact OD2-NZ 3.02Å; I281-K285 WeakPolarHBondContact O-CG 3.4Å; I281-K285 PolarHBondContact O-N 3.11Å; A282-K285 WeakPolarHBondContact O-CB 3.36Å; A282-K285 PolarHBondContact O-N 2.84Å; Q283-K285 VanDerWaalsContact C-N 3.34Å; Q283-K285 PolarHBondContact O-N 3.34Å; K285-K289 PolarHBondContact O-N 3.47Å
286	M	87.1	Confident	88.8	Confident	7 Å²	7	41.4 Å²	41.4	3%	0.034	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-50.4	176.1	-68	-171.9	-88.4	0	0	111.4	A282 Q283 V284 L288 K289 V290 P614 I676 P678 I681	A282-M286 WeakPolarHBondContact O-CG 3.17Å; A282-M286 PolarHBondContact O-N 2.93Å; A282-M286 VanDerWaalsContact O-N 3.1Å; Q283-M286 HydrophobicContact CB-CE 4.38Å; Q283-M286 HydrophobicContact CG-CE 3.99Å; Q283-M286 WeakPolarHBondContact O-CB 3.29Å; Q283-M286 PolarHBondContact O-N 3.22Å; V284-M286 VanDerWaalsContact C-N 3.31Å; V284-M286 PolarHBondContact O-N 2.88Å; M286-L288 PolarHBondContact O-N 3.27Å; M286-K289 WeakPolarHBondContact O-CB 3.4Å; M286-K289 PolarHBondContact O-N 3.33Å; M286-K289 VanDerWaalsContact O-N 3.15Å; M286-V290 PolarHBondContact O-N 3.4Å; M286-P614 HydrophobicContact CB-CG 4.32Å; M286-P614 HydrophobicContact CE-CG 4.03Å; M286-I676 HydrophobicContact CG-CD1 4.27Å; M286-I676 HydrophobicContact CG-CG2 4.19Å; M286-I676 HydrophobicContact SD-CG2 3.71Å; M286-P678 HydrophobicContact SD-CB 4.43Å; M286-I681 HydrophobicContact CE-CB 4.28Å; M286-I681 HydrophobicContact CE-CG2 3.96Å; M286-I681 HydrophobicContact CG-CD1 4.49Å; M286-I681 HydrophobicContact SD-CB 4.44Å; M286-I681 HydrophobicContact SD-CD1 3.88Å
287	V	88.9	Confident	89.3	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-46.4	178.9	170.4	0	0	0	0	111.3	Q283 V284 K289 V290 L291 P614 M617 V620 L621	Q283-V287 PolarHBondContact O-N 3.01Å; V284-V287 PolarHBondContact O-N 2.92Å; V287-K289 VanDerWaalsContact C-N 3.26Å; V287-K289 PolarHBondContact O-N 3.22Å; V287-V290 PolarHBondContact O-N 3.5Å; V287-V290 VanDerWaalsContact O-N 3.15Å; V287-L291 HydrophobicContact CG1-CD1 3.77Å; V287-L291 HydrophobicContact CG1-CG 4.1Å; V287-L291 WeakPolarHBondContact O-CG 3.32Å; V287-L291 PolarHBondContact O-N 3.29Å; V287-P614 HydrophobicContact CG2-CG 4.09Å; V287-M617 HydrophobicContact CG2-CB 3.83Å; V287-M617 HydrophobicContact CG2-CG 4.39Å; V287-M617 HydrophobicContact CG2-SD 3.67Å; V287-V620 HydrophobicContact CG1-CG1 4.06Å; V287-L621 HydrophobicContact CG1-CD2 3.91Å; V287-L621 HydrophobicContact CG1-CG 4.16Å; V287-L621 HydrophobicContact CG2-CD1 4.41Å; V287-L621 HydrophobicContact CG2-CG 4.36Å
288	L	90	Very high	90	Very high	43 Å²	43	34.1 Å²	34.1	23%	0.225	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-32.5	179.2	-74.3	175.7	0	0	0	113.3	I247 W268 M269 V284 M286 V290 L291 F292	I247-L288 HydrophobicContact CD1-CD1 4.48Å; I247-L288 HydrophobicContact CD1-CD2 4.01Å; I247-L288 HydrophobicContact CD1-CG 4.47Å; I247-L288 HydrophobicContact CG1-CD1 4.45Å; W268-L288 HydrophobicContact CH2-CD1 3.74Å; W268-L288 HydrophobicContact CZ2-CD1 3.63Å; M269-L288 HydrophobicContact CE-CD1 3.17Å; V284-L288 HydrophobicContact CG1-CD1 3.99Å; V284-L288 HydrophobicContact CG1-CG 4.26Å; V284-L288 WeakPolarHBondContact O-CB 3.32Å; V284-L288 WeakPolarHBondContact O-CG 3.42Å; V284-L288 PolarHBondContact O-N 3.16Å; M286-L288 PolarHBondContact O-N 3.27Å; L288-V290 VanDerWaalsContact C-N 3.34Å; L288-L291 HydrophobicContact CD2-CD1 4.42Å; L288-L291 PolarHBondContact O-N 3.34Å; L288-F292 WeakPolarHBondContact O-CB 3.38Å; L288-F292 PolarHBondContact O-N 3.24Å
289	K	90.4	Very high	90.6	Very high	60 Å²	60	29.3 Å²	29.3	26%	0.261	15%	0.145	S	C	.	.	H	α-helix	trans	-66.1	-38.7	176.2	-160.1	-169.8	-180	-177.5	0	111.8	K285 M286 V287 L293 Y673 T674 I676	K285-K289 PolarHBondContact O-N 3.47Å; M286-K289 WeakPolarHBondContact O-CB 3.4Å; M286-K289 PolarHBondContact O-N 3.33Å; M286-K289 VanDerWaalsContact O-N 3.15Å; V287-K289 VanDerWaalsContact C-N 3.26Å; V287-K289 PolarHBondContact O-N 3.22Å; K289-L293 PolarHBondContact O-N 3.27Å; K289-Y673 HydrophobicContact CD-CE2 3.85Å; K289-Y673 HydrophobicContact CG-CD2 4.43Å; K289-Y673 HydrophobicContact CG-CE2 3.81Å; K289-T674 PolarHBondContact NZ-O 2.9Å; K289-T674 PolarHBondContact NZ-OG1 3.4Å; K289-I676 HydrophobicContact CD-CD1 3.65Å
290	V	91.4	Very high	91.3	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-73.1	-43.3	175.1	-179.9	0	0	0	0	110.8	M286 V287 L288 F292 L293 Y294 F608 Q612 L621	M286-V290 PolarHBondContact O-N 3.4Å; V287-V290 PolarHBondContact O-N 3.5Å; V287-V290 VanDerWaalsContact O-N 3.15Å; L288-V290 VanDerWaalsContact C-N 3.34Å; V290-F292 PolarHBondContact O-N 2.94Å; V290-L293 WeakPolarHBondContact O-CA 3.36Å; V290-L293 VanDerWaalsContact O-CB 3.32Å; V290-L293 WeakPolarHBondContact O-CB 3.43Å; V290-L293 PolarHBondContact O-N 3.43Å; V290-Y294 HydrophobicContact CG1-CD1 4.35Å; V290-Y294 HydrophobicContact CG1-CE1 3.7Å; V290-Y294 WeakPolarHBondContact O-CD1 3.29Å; V290-Y294 PolarHBondContact O-N 3.34Å; V290-Y294 VanDerWaalsContact O-N 3.15Å; V290-F608 HydrophobicContact CG1-CE1 4.2Å; V290-Q612 HydrophobicContact CG2-CB 3.69Å; V290-L621 HydrophobicContact CB-CD1 4.17Å; V290-L621 HydrophobicContact CB-CD2 3.75Å; V290-L621 HydrophobicContact CG1-CD1 4.12Å; V290-L621 HydrophobicContact CG1-CD2 3.67Å; V290-L621 HydrophobicContact CG2-CD1 4.28Å
291	L	91.7	Very high	91.9	Very high	52 Å²	52	26.2 Å²	26.2	27%	0.272	13%	0.128	S	C	.	.	H	α-helix	trans	-61.9	-32.4	175.9	-69.1	177.7	0	0	0	112.5	V287 L288 L293 Y294 L621	V287-L291 HydrophobicContact CG1-CD1 3.77Å; V287-L291 HydrophobicContact CG1-CG 4.1Å; V287-L291 WeakPolarHBondContact O-CG 3.32Å; V287-L291 PolarHBondContact O-N 3.29Å; L288-L291 HydrophobicContact CD2-CD1 4.42Å; L288-L291 PolarHBondContact O-N 3.34Å; L291-L293 VanDerWaalsContact C-N 3.32Å; L291-Y294 HydrophobicContact CD2-CD2 3.77Å; L291-Y294 HydrophobicContact CD2-CE2 4.01Å; L291-Y294 WeakPolarHBondContact O-CB 3.35Å; L291-Y294 PolarHBondContact O-N 2.9Å; L291-Y294 VanDerWaalsContact O-N 3.08Å; L291-L621 HydrophobicContact CD2-CD2 3.84Å; L291-L621 HydrophobicContact CG-CD2 3.91Å
292	F	92.8	Very high	92.4	Very high	124 Å²	124	26 Å²	26	54%	0.544	13%	0.127	S	C	.	.	H	α-helix	trans	-63.3	-39.9	172.1	-176.9	-104.9	0	0	0	111.5	L288 V290 Y294 I295 M669	L288-F292 WeakPolarHBondContact O-CB 3.38Å; L288-F292 PolarHBondContact O-N 3.24Å; V290-F292 PolarHBondContact O-N 2.94Å; F292-Y294 PolarHBondContact O-N 2.98Å; F292-I295 HydrophobicContact CD2-CD1 3.62Å; F292-I295 HydrophobicContact CE2-CD1 3.97Å; F292-I295 HydrophobicContact CG-CD1 4.42Å; F292-I295 WeakPolarHBondContact O-CG1 3.3Å; F292-I295 PolarHBondContact O-N 2.96Å; F292-M669 HydrophobicContact CD1-CE 3.73Å; F292-M669 HydrophobicContact CE1-CE 3.53Å; F292-M669 HydrophobicContact CG-CE 4.45Å; F292-M669 HydrophobicContact CZ-CE 4.09Å; F292-M669 VanDerWaalsContact O-CE 3.23Å; F292-M669 WeakPolarHBondContact O-CE 3.08Å
293	L	92.8	Very high	92.9	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.026	12%	0.121	C	C	.	.	H	α-helix	trans	-65.4	-20.5	171.8	-79.6	-176.7	0	0	0	113.5	K289 V290 L291 P296 L297 L365 F608 M669 Y673	K289-L293 PolarHBondContact O-N 3.27Å; V290-L293 WeakPolarHBondContact O-CA 3.36Å; V290-L293 VanDerWaalsContact O-CB 3.32Å; V290-L293 WeakPolarHBondContact O-CB 3.43Å; V290-L293 PolarHBondContact O-N 3.43Å; L291-L293 VanDerWaalsContact C-N 3.32Å; L293-P296 VanDerWaalsContact O-CD 3.25Å; L293-P296 WeakPolarHBondContact O-CD 3.46Å; L293-L297 WeakPolarHBondContact O-CD1 3.28Å; L293-L365 HydrophobicContact CD1-CD1 4.09Å; L293-L365 HydrophobicContact CD1-CD2 3.94Å; L293-F608 HydrophobicContact CD1-CE1 3.94Å; L293-F608 HydrophobicContact CD1-CZ 3.71Å; L293-M669 HydrophobicContact CD2-CB 3.98Å; L293-M669 HydrophobicContact CD2-CE 4.22Å; L293-Y673 HydrophobicContact CD1-CD1 4.14Å; L293-Y673 HydrophobicContact CD1-CD2 3.21Å; L293-Y673 HydrophobicContact CD1-CE1 4.29Å; L293-Y673 HydrophobicContact CD1-CE2 3.36Å; L293-Y673 HydrophobicContact CD1-CG 3.61Å; L293-Y673 HydrophobicContact CD2-CD2 4.15Å; L293-Y673 HydrophobicContact CG-CD2 3.66Å; L293-Y673 HydrophobicContact CG-CE2 3.96Å; L293-Y673 HydrophobicContact CG-CG 4.37Å
294	Y	94.4	Very high	93.4	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.035	13%	0.125	C	C	.	.	H	α-helix	trans	-77.3	-17.9	178.6	-73.4	2.2	0	0	0	114.2	V290 L291 F292 P296 L297 P298 S609 L621 W625 T628	V290-Y294 HydrophobicContact CG1-CD1 4.35Å; V290-Y294 HydrophobicContact CG1-CE1 3.7Å; V290-Y294 WeakPolarHBondContact O-CD1 3.29Å; V290-Y294 PolarHBondContact O-N 3.34Å; V290-Y294 VanDerWaalsContact O-N 3.15Å; L291-Y294 HydrophobicContact CD2-CD2 3.77Å; L291-Y294 HydrophobicContact CD2-CE2 4.01Å; L291-Y294 WeakPolarHBondContact O-CB 3.35Å; L291-Y294 PolarHBondContact O-N 2.9Å; L291-Y294 VanDerWaalsContact O-N 3.08Å; F292-Y294 PolarHBondContact O-N 2.98Å; Y294-P296 VanDerWaalsContact C-CD 3.45Å; Y294-P296 VanDerWaalsContact C-N 3.29Å; Y294-L297 HydrophobicContact CD1-CD2 3.48Å; Y294-L297 VanDerWaalsContact CD1-CD2 3.48Å; Y294-L297 HydrophobicContact CE1-CD2 4.07Å; Y294-L297 HydrophobicContact CG-CD2 3.97Å; Y294-L297 WeakPolarHBondContact O-CB 3.32Å; Y294-L297 PolarHBondContact O-N 3.35Å; Y294-P298 VanDerWaalsContact O-CD 3.23Å; Y294-P298 WeakPolarHBondContact O-CD 3.31Å; Y294-S609 WeakPolarHBondContact OH-CB 3.29Å; Y294-S609 PolarHBondContact OH-OG 3.4Å; Y294-L621 HydrophobicContact CE2-CD2 4.39Å; Y294-W625 AromaticContact CE1-CE3 3.95Å; Y294-W625 HydrophobicContact CE1-CE3 3.95Å; Y294-W625 HydrophobicContact CE1-CZ3 4.35Å; Y294-W625 HydrophobicContact CE2-CB 4.12Å; Y294-W625 HydrophobicContact CE2-CE3 4.48Å; Y294-W625 AromaticContact CZ-CE3 3.89Å; Y294-T628 HydrophobicContact CD2-CG2 4.1Å; Y294-T628 HydrophobicContact CG-CG2 4.18Å
295	I	94.8	Very high	93.8	Very high	112 Å²	112	26.3 Å²	26.3	57%	0.574	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.2	-176.4	-64.8	171	0	0	0	113.1	F292 P298	F292-I295 HydrophobicContact CD2-CD1 3.62Å; F292-I295 HydrophobicContact CE2-CD1 3.97Å; F292-I295 HydrophobicContact CG-CD1 4.42Å; F292-I295 WeakPolarHBondContact O-CG1 3.3Å; F292-I295 PolarHBondContact O-N 2.96Å; I295-P298 VanDerWaalsContact O-CD 3.28Å; I295-P298 WeakPolarHBondContact O-CD 3.26Å
296	P	95.6	Very high	94.1	Very high	12 Å²	12	23.3 Å²	23.3	8%	0.078	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-18.3	178.4	-18.1	35.7	0	0	0	114.8	L293 Y294 P298 M299 V662 F666 M669	L293-P296 VanDerWaalsContact O-CD 3.25Å; L293-P296 WeakPolarHBondContact O-CD 3.46Å; Y294-P296 VanDerWaalsContact C-CD 3.45Å; Y294-P296 VanDerWaalsContact C-N 3.29Å; P296-P298 VanDerWaalsContact C-CD 3.4Å; P296-M299 PolarHBondContact O-N 2.97Å; P296-V662 HydrophobicContact CB-CG1 3.69Å; P296-V662 WeakPolarHBondContact O-CG1 3.3Å; P296-F666 HydrophobicContact CB-CB 4.09Å; P296-F666 HydrophobicContact CB-CD2 4.18Å; P296-F666 HydrophobicContact CG-CB 4.4Å; P296-F666 HydrophobicContact CG-CD2 4.14Å; P296-M669 HydrophobicContact CG-CE 4.15Å; P296-M669 HydrophobicContact CG-SD 3.62Å
297	L	95.5	Very high	94.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.9	-171.9	-75.9	50.5	0	0	0	114.9	L293 Y294 M299 F300 M368 M372 F601 W625 T628 F666	L293-L297 WeakPolarHBondContact O-CD1 3.28Å; Y294-L297 HydrophobicContact CD1-CD2 3.48Å; Y294-L297 VanDerWaalsContact CD1-CD2 3.48Å; Y294-L297 HydrophobicContact CE1-CD2 4.07Å; Y294-L297 HydrophobicContact CG-CD2 3.97Å; Y294-L297 WeakPolarHBondContact O-CB 3.32Å; Y294-L297 PolarHBondContact O-N 3.35Å; L297-M299 PolarHBondContact O-N 2.94Å; L297-F300 WeakPolarHBondContact O-CB 3.38Å; L297-F300 PolarHBondContact O-N 3.32Å; L297-M368 HydrophobicContact CD2-CE 4.09Å; L297-M368 HydrophobicContact CG-CE 4.26Å; L297-M372 HydrophobicContact CD1-CE 4.15Å; L297-M372 HydrophobicContact CG-CE 4.48Å; L297-F601 HydrophobicContact CB-CZ 4.06Å; L297-F601 HydrophobicContact CD2-CZ 4.43Å; L297-F601 HydrophobicContact CG-CE2 4.23Å; L297-F601 HydrophobicContact CG-CZ 3.75Å; L297-W625 HydrophobicContact CD2-CE3 3.98Å; L297-W625 HydrophobicContact CD2-CH2 4.31Å; L297-W625 HydrophobicContact CD2-CZ3 3.56Å; L297-T628 HydrophobicContact CB-CG2 4.15Å; L297-F666 HydrophobicContact CD1-CD2 3.96Å; L297-F666 HydrophobicContact CD1-CE2 3.66Å
298	P	97.3	Very high	94.6	Very high	9 Å²	9	23.5 Å²	23.5	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-50.1	-32.6	178	-31.8	36.4	0	0	0	114.6	Y294 I295 P296 F300 W301 A302 T628 V631 G632 I635	Y294-P298 VanDerWaalsContact O-CD 3.23Å; Y294-P298 WeakPolarHBondContact O-CD 3.31Å; I295-P298 VanDerWaalsContact O-CD 3.28Å; I295-P298 WeakPolarHBondContact O-CD 3.26Å; P296-P298 VanDerWaalsContact C-CD 3.4Å; P298-F300 VanDerWaalsContact C-N 3.29Å; P298-F300 PolarHBondContact O-N 2.78Å; P298-W301 PolarHBondContact O-N 3.36Å; P298-W301 VanDerWaalsContact O-N 3.15Å; P298-A302 PolarHBondContact O-N 2.84Å; P298-T628 WeakPolarHBondContact CA-O 3.14Å; P298-T628 HydrophobicContact CG-CG2 4.43Å; P298-V631 HydrophobicContact CB-CB 4Å; P298-V631 HydrophobicContact CB-CG1 3.74Å; P298-V631 HydrophobicContact CG-CB 3.95Å; P298-V631 HydrophobicContact CG-CG1 3.79Å; P298-G632 WeakPolarHBondContact O-CA 3.41Å; P298-I635 HydrophobicContact CB-CD1 3.69Å
299	M	96.6	Very high	94.9	Very high	13 Å²	13	21.5 Å²	21.5	6%	0.064	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-33.9	-179.7	-157.2	62.1	-112.4	0	0	112.6	P296 L297 A302 L303 I635 F655 L658 L659 V662	P296-M299 PolarHBondContact O-N 2.97Å; L297-M299 PolarHBondContact O-N 2.94Å; M299-A302 HydrophobicContact CE-CB 3.54Å; M299-A302 PolarHBondContact O-N 2.9Å; M299-L303 HydrophobicContact CE-CD1 3.44Å; M299-L303 VanDerWaalsContact CE-CD1 3.44Å; M299-L303 VanDerWaalsContact O-CD1 3.28Å; M299-L303 WeakPolarHBondContact O-CD1 2.97Å; M299-L303 PolarHBondContact O-N 3.19Å; M299-I635 HydrophobicContact CE-CG2 4.03Å; M299-I635 HydrophobicContact SD-CG2 4.02Å; M299-F655 HydrophobicContact CE-CD1 3.63Å; M299-F655 HydrophobicContact CE-CE1 3.95Å; M299-L658 HydrophobicContact SD-CB 4.29Å; M299-L659 HydrophobicContact CB-CD1 4.03Å; M299-L659 HydrophobicContact CG-CB 4.35Å; M299-L659 HydrophobicContact CG-CD1 3.98Å; M299-V662 HydrophobicContact CB-CB 4.14Å; M299-V662 HydrophobicContact CB-CG1 3.83Å; M299-V662 HydrophobicContact CB-CG2 3.99Å; M299-V662 HydrophobicContact CG-CB 4.2Å; M299-V662 HydrophobicContact CG-CG1 4.44Å; M299-V662 HydrophobicContact CG-CG2 3.87Å
300	F	97.5	Very high	95	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-45.8	173.7	178.4	-87.5	0	0	0	110.8	L297 P298 A302 L303 F304 M372 A375 E598 F601	L297-F300 WeakPolarHBondContact O-CB 3.38Å; L297-F300 PolarHBondContact O-N 3.32Å; P298-F300 VanDerWaalsContact C-N 3.29Å; P298-F300 PolarHBondContact O-N 2.78Å; F300-A302 VanDerWaalsContact C-N 3.34Å; F300-A302 PolarHBondContact O-N 3.08Å; F300-L303 PolarHBondContact O-N 3.48Å; F300-F304 HydrophobicContact CD1-CB 4.41Å; F300-F304 HydrophobicContact CE1-CB 4.09Å; F300-F304 HydrophobicContact CE1-CD2 4.33Å; F300-F304 HydrophobicContact CE1-CG 4.35Å; F300-F304 WeakPolarHBondContact O-CB 3.47Å; F300-F304 PolarHBondContact O-N 3.18Å; F300-M372 HydrophobicContact CD2-CG 4.4Å; F300-A375 HydrophobicContact CD2-CB 3.9Å; F300-A375 HydrophobicContact CE2-CB 3.64Å; F300-E598 HydrophobicContact CZ-CB 4.3Å; F300-F601 HydrophobicContact CB-CD1 4.42Å; F300-F601 HydrophobicContact CB-CE1 3.83Å; F300-F601 HydrophobicContact CB-CE2 4.25Å; F300-F601 HydrophobicContact CB-CZ 3.71Å; F300-F601 AromaticContact CD1-CD1 3.34Å; F300-F601 HydrophobicContact CD1-CD1 3.34Å; F300-F601 AromaticContact CD1-CE1 3.28Å; F300-F601 HydrophobicContact CD1-CE1 3.28Å; F300-F601 HydrophobicContact CD1-CG 4.18Å; F300-F601 HydrophobicContact CD1-CZ 4.07Å; F300-F601 HydrophobicContact CD2-CB 4.41Å; F300-F601 AromaticContact CD2-CD1 3.95Å; F300-F601 HydrophobicContact CD2-CD1 3.95Å; F300-F601 HydrophobicContact CD2-CD2 4.23Å; F300-F601 HydrophobicContact CD2-CE1 4.22Å; F300-F601 HydrophobicContact CD2-CE2 4.5Å; F300-F601 AromaticContact CD2-CG 3.94Å; F300-F601 HydrophobicContact CD2-CG 3.94Å; F300-F601 HydrophobicContact CD2-CZ 4.46Å; F300-F601 AromaticContact CE1-CD1 3.46Å; F300-F601 HydrophobicContact CE1-CD1 3.46Å; F300-F601 VanDerWaalsContact CE1-CD1 3.46Å; F300-F601 AromaticContact CE1-CE1 3.89Å; F300-F601 HydrophobicContact CE1-CE1 3.89Å; F300-F601 HydrophobicContact CE1-CG 4.21Å; F300-F601 HydrophobicContact CE2-CB 3.97Å; F300-F601 HydrophobicContact CE2-CD1 4.03Å; F300-F601 AromaticContact CE2-CG 3.96Å; F300-F601 HydrophobicContact CE2-CG 3.96Å; F300-F601 AromaticContact CG-CD1 3.62Å; F300-F601 HydrophobicContact CG-CD1 3.62Å; F300-F601 HydrophobicContact CG-CD2 4.37Å; F300-F601 AromaticContact CG-CE1 3.49Å; F300-F601 HydrophobicContact CG-CE1 3.49Å; F300-F601 VanDerWaalsContact CG-CE1 3.49Å; F300-F601 HydrophobicContact CG-CE2 4.28Å; F300-F601 HydrophobicContact CG-CG 4.06Å; F300-F601 AromaticContact CG-CZ 3.82Å; F300-F601 HydrophobicContact CG-CZ 3.82Å; F300-F601 HydrophobicContact CZ-CB 4.07Å; F300-F601 AromaticContact CZ-CD1 3.82Å; F300-F601 HydrophobicContact CZ-CD1 3.82Å; F300-F601 HydrophobicContact CZ-CG 4.12Å
301	W	96.8	Very high	95.3	Very high	13 Å²	13	18.8 Å²	18.8	5%	0.049	9%	0.091	C	C	.	.	H	α-helix	trans	-67.8	-34.4	-179.5	-62.9	119	0	0	0	113.1	P298 L303 F304 D305 F601 W625 T628 V629	P298-W301 PolarHBondContact O-N 3.36Å; P298-W301 VanDerWaalsContact O-N 3.15Å; W301-L303 PolarHBondContact O-N 3.25Å; W301-F304 HydrophobicContact CE3-CB 4.13Å; W301-F304 AromaticContact CE3-CD1 3.81Å; W301-F304 HydrophobicContact CE3-CD1 3.81Å; W301-F304 HydrophobicContact CE3-CG 4.11Å; W301-F304 AromaticContact CZ3-CD1 3.8Å; W301-F304 HydrophobicContact CZ3-CD1 3.8Å; W301-F304 HydrophobicContact CZ3-CE1 4.14Å; W301-F304 HydrophobicContact CZ3-CG 4.17Å; W301-F304 PolarHBondContact O-N 3.37Å; W301-D305 WeakPolarHBondContact O-CB 3.37Å; W301-D305 PolarHBondContact O-N 3.06Å; W301-F601 HydrophobicContact CZ2-CE1 4.16Å; W301-W625 AromaticContact CZ2-CE2 3.91Å; W301-W625 AromaticContact CZ2-CZ2 3.68Å; W301-W625 HydrophobicContact CZ2-CZ2 3.68Å; W301-W625 AromaticContact CZ2-NE1 3.79Å; W301-T628 PolarHBondContact NE1-OG1 2.88Å; W301-T628 VanDerWaalsContact NE1-OG1 3.14Å; W301-V629 HydrophobicContact CB-CG1 4.43Å; W301-V629 HydrophobicContact CD2-CB 4.45Å; W301-V629 HydrophobicContact CD2-CG1 4.44Å; W301-V629 HydrophobicContact CD2-CG2 3.78Å; W301-V629 HydrophobicContact CE3-CG2 4.36Å; W301-V629 HydrophobicContact CG-CB 4.22Å; W301-V629 HydrophobicContact CG-CG1 4.38Å; W301-V629 HydrophobicContact CG-CG2 3.94Å; W301-V629 HydrophobicContact CZ2-CG2 4.18Å
302	A	96.7	Very high	95.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.1	-33.3	173.5	0	0	0	0	0	112.6	P298 M299 F300 Q306 G632 I635 V636	P298-A302 PolarHBondContact O-N 2.84Å; M299-A302 HydrophobicContact CE-CB 3.54Å; M299-A302 PolarHBondContact O-N 2.9Å; F300-A302 VanDerWaalsContact C-N 3.34Å; F300-A302 PolarHBondContact O-N 3.08Å; A302-Q306 WeakPolarHBondContact O-CG 3.21Å; A302-Q306 PolarHBondContact O-NE2 3.02Å; A302-G632 VanDerWaalsContact CB-O 3.23Å; A302-G632 WeakPolarHBondContact CB-O 3.43Å; A302-I635 HydrophobicContact CB-CB 4.31Å; A302-I635 HydrophobicContact CB-CG2 4.29Å; A302-V636 HydrophobicContact CB-CG2 3.84Å; A302-V636 VanDerWaalsContact O-CG2 3.27Å; A302-V636 WeakPolarHBondContact O-CG2 2.93Å
303	L	97	Very high	95.5	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-82.9	-43.9	173.6	-86.8	76.3	0	0	0	111.4	M299 F300 W301 D305 Q306 F379 M594 F655 L659	M299-L303 HydrophobicContact CE-CD1 3.44Å; M299-L303 VanDerWaalsContact CE-CD1 3.44Å; M299-L303 VanDerWaalsContact O-CD1 3.28Å; M299-L303 WeakPolarHBondContact O-CD1 2.97Å; M299-L303 PolarHBondContact O-N 3.19Å; F300-L303 PolarHBondContact O-N 3.48Å; W301-L303 PolarHBondContact O-N 3.25Å; L303-D305 PolarHBondContact O-N 3.33Å; L303-Q306 PolarHBondContact O-N 2.92Å; L303-F379 HydrophobicContact CB-CD2 3.96Å; L303-F379 HydrophobicContact CB-CE1 4.48Å; L303-F379 HydrophobicContact CB-CE2 3.43Å; L303-F379 VanDerWaalsContact CB-CE2 3.43Å; L303-F379 HydrophobicContact CB-CZ 3.73Å; L303-F379 HydrophobicContact CD2-CB 4.03Å; L303-F379 HydrophobicContact CD2-CD1 3.94Å; L303-F379 HydrophobicContact CD2-CD2 3.37Å; L303-F379 HydrophobicContact CD2-CE1 4.26Å; L303-F379 HydrophobicContact CD2-CE2 3.77Å; L303-F379 HydrophobicContact CD2-CG 3.47Å; L303-F379 VanDerWaalsContact CD2-CG 3.47Å; L303-F379 HydrophobicContact CD2-CZ 4.19Å; L303-F379 HydrophobicContact CG-CD1 4.05Å; L303-F379 HydrophobicContact CG-CD2 3.73Å; L303-F379 HydrophobicContact CG-CE1 3.86Å; L303-F379 HydrophobicContact CG-CE2 3.55Å; L303-F379 HydrophobicContact CG-CG 3.98Å; L303-F379 HydrophobicContact CG-CZ 3.61Å; L303-F379 VanDerWaalsContact O-CE2 3.32Å; L303-F379 WeakPolarHBondContact O-CE2 3.33Å; L303-F379 WeakPolarHBondContact O-CZ 3.36Å; L303-M594 HydrophobicContact CB-CE 4.04Å; L303-F655 HydrophobicContact CD1-CB 3.91Å; L303-F655 HydrophobicContact CD1-CD1 3.74Å; L303-F655 HydrophobicContact CD1-CG 4.21Å; L303-F655 HydrophobicContact CD2-CB 4.32Å; L303-F655 HydrophobicContact CG-CB 4.05Å; L303-F655 HydrophobicContact CG-CD1 4.49Å; L303-L659 HydrophobicContact CD1-CB 4.22Å; L303-L659 HydrophobicContact CD1-CD2 4.41Å; L303-L659 HydrophobicContact CD2-CB 3.99Å; L303-L659 HydrophobicContact CD2-CD2 3.56Å; L303-L659 HydrophobicContact CD2-CG 4.41Å; L303-L659 HydrophobicContact CG-CD2 4.38Å
304	F	96.8	Very high	95.6	Very high	22 Å²	22	10.3 Å²	10.3	10%	0.096	5%	0.052	C	C	.	.	H	α-helix	trans	-59.1	-44.7	-177.1	-179.7	-96.9	0	0	0	112.9	F300 W301 Q306 Q307 M594 E598	F300-F304 HydrophobicContact CD1-CB 4.41Å; F300-F304 HydrophobicContact CE1-CB 4.09Å; F300-F304 HydrophobicContact CE1-CD2 4.33Å; F300-F304 HydrophobicContact CE1-CG 4.35Å; F300-F304 WeakPolarHBondContact O-CB 3.47Å; F300-F304 PolarHBondContact O-N 3.18Å; W301-F304 HydrophobicContact CE3-CB 4.13Å; W301-F304 AromaticContact CE3-CD1 3.81Å; W301-F304 HydrophobicContact CE3-CD1 3.81Å; W301-F304 HydrophobicContact CE3-CG 4.11Å; W301-F304 AromaticContact CZ3-CD1 3.8Å; W301-F304 HydrophobicContact CZ3-CD1 3.8Å; W301-F304 HydrophobicContact CZ3-CE1 4.14Å; W301-F304 HydrophobicContact CZ3-CG 4.17Å; W301-F304 PolarHBondContact O-N 3.37Å; F304-Q306 VanDerWaalsContact C-N 3.25Å; F304-Q306 PolarHBondContact O-N 2.62Å; F304-Q307 VanDerWaalsContact CD2-NE2 3.26Å; F304-Q307 WeakPolarHBondContact O-CG 3.3Å; F304-Q307 PolarHBondContact O-N 3.32Å; F304-Q307 PolarHBondContact O-NE2 3.08Å; F304-M594 HydrophobicContact CB-SD 4.25Å; F304-M594 HydrophobicContact CD2-CG 3.92Å; F304-M594 HydrophobicContact CD2-SD 3.96Å; F304-M594 HydrophobicContact CE2-CG 4.47Å; F304-E598 HydrophobicContact CD2-CB 4.34Å; F304-E598 HydrophobicContact CD2-CG 4.43Å; F304-E598 HydrophobicContact CE2-CB 3.93Å; F304-E598 HydrophobicContact CE2-CG 3.81Å; F304-E598 WeakPolarHBondContact CE2-OE2 3.41Å; F304-E598 HydrophobicContact CZ-CG 4.24Å; F304-E598 WeakPolarHBondContact CZ-OE1 3.14Å; F304-E598 WeakPolarHBondContact CZ-OE2 3.3Å
305	D	95.9	Very high	95.7	Very high	4 Å²	4	9.9 Å²	9.9	2%	0.021	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	-75.9	-8.3	-174.2	-79.9	-40.5	0	0	0	114.2	R41 W301 L303 Q307 N633	R41-D305 IonicContact CZ-OD1 2.68Å; R41-D305 IonicContact NH1-OD1 2.86Å; R41-D305 IonicContact NH2-OD1 3.84Å; R41-D305 PolarHBondContact NH2-OD1 2.97Å; W301-D305 WeakPolarHBondContact O-CB 3.37Å; W301-D305 PolarHBondContact O-N 3.06Å; L303-D305 PolarHBondContact O-N 3.33Å; D305-Q307 PolarHBondContact O-N 2.87Å; D305-N633 PolarHBondContact OD2-ND2 3.2Å
306	Q	95.2	Very high	95.6	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.028	C	C	.	.	G	3₁₀ helix	trans	-70.5	-13.3	175	-72.3	-177	45.4	0	0	113.8	A302 L303 F304 G308 S309 R310 W311 F379 F655	A302-Q306 WeakPolarHBondContact O-CG 3.21Å; A302-Q306 PolarHBondContact O-NE2 3.02Å; L303-Q306 PolarHBondContact O-N 2.92Å; F304-Q306 VanDerWaalsContact C-N 3.25Å; F304-Q306 PolarHBondContact O-N 2.62Å; Q306-G308 PolarHBondContact O-N 3.42Å; Q306-S309 WeakPolarHBondContact CA-OG 3.19Å; Q306-S309 CarbonylContact O-C 3.56Å; Q306-S309 PolarHBondContact O-N 3.17Å; Q306-S309 VanDerWaalsContact O-N 3.07Å; Q306-S309 PolarHBondContact O-OG 3.14Å; Q306-R310 HydrophobicContact CB-CB 4.45Å; Q306-R310 PolarHBondContact O-N 2.99Å; Q306-W311 PolarHBondContact O-N 2.56Å; Q306-W311 VanDerWaalsContact O-N 3.14Å; Q306-F379 HydrophobicContact CB-CZ 4.01Å; Q306-F379 HydrophobicContact CG-CZ 4.24Å; Q306-F379 VanDerWaalsContact OE1-CE1 3.29Å; Q306-F655 VanDerWaalsContact NE2-CE2 3.34Å
307	Q	94.8	Very high	95.4	Very high	12 Å²	12	6.6 Å²	6.6	6%	0.056	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	-53	-39	173.5	-73.2	175.7	80.6	0	0	112.2	F304 D305 W311 T312 Y591	F304-Q307 VanDerWaalsContact CD2-NE2 3.26Å; F304-Q307 WeakPolarHBondContact O-CG 3.3Å; F304-Q307 PolarHBondContact O-N 3.32Å; F304-Q307 PolarHBondContact O-NE2 3.08Å; D305-Q307 PolarHBondContact O-N 2.87Å; Q307-W311 HydrophobicContact CB-CE3 4.27Å; Q307-W311 HydrophobicContact CG-CD2 4.13Å; Q307-W311 HydrophobicContact CG-CE3 3.54Å; Q307-W311 HydrophobicContact CG-CH2 4.28Å; Q307-W311 HydrophobicContact CG-CZ3 3.61Å; Q307-T312 PolarHBondContact O-OG1 3.5Å; Q307-T312 VanDerWaalsContact O-OG1 3.11Å; Q307-Y591 HydrophobicContact CB-CE1 4.17Å; Q307-Y591 HydrophobicContact CG-CD1 4.45Å; Q307-Y591 HydrophobicContact CG-CE1 3.91Å; Q307-Y591 VanDerWaalsContact OE1-CD1 3.25Å
308	G	93.1	Very high	95.3	Very high	2 Å²	2	6.6 Å²	6.6	2%	0.021	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	-92	3.9	-179.8	0	0	0	0	0	115.5	V45 Y63 Q306	V45-G308 WeakPolarHBondContact CG1-O 3.18Å; Y63-G308 WeakPolarHBondContact OH-CA 3.31Å; Q306-G308 PolarHBondContact O-N 3.42Å
309	S	94.9	Very high	95.1	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-94.1	175.4	56.5	0	0	0	0	110.1	H64 Q306 W311 T312 L313	H64-S309 PolarHBondContact NE2-OG 3.3Å; Q306-S309 WeakPolarHBondContact CA-OG 3.19Å; Q306-S309 CarbonylContact O-C 3.56Å; Q306-S309 PolarHBondContact O-N 3.17Å; Q306-S309 VanDerWaalsContact O-N 3.07Å; Q306-S309 PolarHBondContact O-OG 3.14Å; S309-W311 VanDerWaalsContact C-N 3.31Å; S309-W311 PolarHBondContact O-N 3.45Å; S309-T312 WeakPolarHBondContact O-CA 3.44Å; S309-T312 WeakPolarHBondContact O-CB 3.44Å; S309-T312 PolarHBondContact O-N 3.08Å; S309-L313 PolarHBondContact O-N 3.15Å
310	R	94.2	Very high	94.8	Very high	5 Å²	5	7.3 Å²	7.3	2%	0.019	4%	0.039	C	C	.	.	H	α-helix	trans	-53.9	-40.8	-174.7	-68.5	-60	-160.6	-165.1	6.5	113.6	D57 T60 Q306 L313 Q314 E651 Y652	D57-R310 IonicContact OD1-CZ 2.89Å; D57-R310 IonicContact OD1-NH1 3.63Å; D57-R310 PolarHBondContact OD1-NH1 3.49Å; D57-R310 IonicContact OD1-NH2 3.67Å; D57-R310 PolarHBondContact OD1-NH2 2.96Å; T60-R310 HydrophobicContact CG2-CG 4.27Å; Q306-R310 HydrophobicContact CB-CB 4.45Å; Q306-R310 PolarHBondContact O-N 2.99Å; R310-L313 PolarHBondContact O-N 2.01Å; R310-Q314 WeakPolarHBondContact O-CB 3.24Å; R310-Q314 PolarHBondContact O-N 2.97Å; R310-E651 IonicContact CZ-OE1 2.72Å; R310-E651 IonicContact CZ-OE2 3.63Å; R310-E651 VanDerWaalsContact CZ-OE2 3.31Å; R310-E651 IonicContact NE-OE1 3.67Å; R310-E651 PolarHBondContact NE-OE1 3.3Å; R310-E651 IonicContact NE-OE2 2.86Å; R310-E651 PolarHBondContact NE-OE2 2.89Å; R310-E651 IonicContact NH2-OE1 3.7Å; R310-E651 IonicContact NH2-OE2 3.67Å; R310-E651 PolarHBondContact NH2-OE2 2.71Å; R310-Y652 HydrophobicContact CB-CE1 4.01Å; R310-Y652 PolarHBondContact O-OH 3.43Å
311	W	96.3	Very high	94.6	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-72.3	-30.9	178.7	-67.8	10.1	0	0	0	113	Q306 Q307 S309 A315 A378 F379 A382 Q587 Q590 Y591 M594 Y652	Q306-W311 PolarHBondContact O-N 2.56Å; Q306-W311 VanDerWaalsContact O-N 3.14Å; Q307-W311 HydrophobicContact CB-CE3 4.27Å; Q307-W311 HydrophobicContact CG-CD2 4.13Å; Q307-W311 HydrophobicContact CG-CE3 3.54Å; Q307-W311 HydrophobicContact CG-CH2 4.28Å; Q307-W311 HydrophobicContact CG-CZ3 3.61Å; S309-W311 VanDerWaalsContact C-N 3.31Å; S309-W311 PolarHBondContact O-N 3.45Å; W311-A315 PolarHBondContact O-N 2.73Å; W311-A378 HydrophobicContact CH2-CB 4.44Å; W311-F379 HydrophobicContact CZ2-CD2 4.13Å; W311-F379 AromaticContact CZ2-CE2 3.86Å; W311-F379 HydrophobicContact CZ2-CE2 3.86Å; W311-A382 HydrophobicContact CZ2-CB 4.46Å; W311-Q587 PolarHBondContact O-NE2 3.28Å; W311-Q590 VanDerWaalsContact CD2-NE2 3.25Å; W311-Q590 HydrophobicContact CE3-CG 4.23Å; W311-Q590 HydrophobicContact CH2-CB 3.8Å; W311-Q590 HydrophobicContact CH2-CG 3.91Å; W311-Q590 HydrophobicContact CZ2-CB 4.11Å; W311-Q590 HydrophobicContact CZ2-CG 4.26Å; W311-Q590 HydrophobicContact CZ3-CB 4.26Å; W311-Q590 HydrophobicContact CZ3-CG 3.88Å; W311-Y591 HydrophobicContact CE3-CD1 4.18Å; W311-Y591 HydrophobicContact CE3-CD2 4.02Å; W311-Y591 AromaticContact CE3-CE1 3.88Å; W311-Y591 HydrophobicContact CE3-CE1 3.88Å; W311-Y591 AromaticContact CE3-CE2 3.69Å; W311-Y591 HydrophobicContact CE3-CE2 3.69Å; W311-Y591 HydrophobicContact CE3-CG 4.24Å; W311-Y591 AromaticContact CE3-CZ 3.62Å; W311-Y591 AromaticContact CZ3-CD1 3.84Å; W311-Y591 HydrophobicContact CZ3-CD1 3.84Å; W311-Y591 AromaticContact CZ3-CD2 3.99Å; W311-Y591 HydrophobicContact CZ3-CD2 3.99Å; W311-Y591 AromaticContact CZ3-CE1 4Å; W311-Y591 HydrophobicContact CZ3-CE1 4Å; W311-Y591 HydrophobicContact CZ3-CE2 4.13Å; W311-Y591 AromaticContact CZ3-CG 3.83Å; W311-Y591 HydrophobicContact CZ3-CG 3.83Å; W311-M594 HydrophobicContact CH2-CB 3.9Å; W311-M594 HydrophobicContact CH2-CE 4.43Å; W311-M594 HydrophobicContact CH2-CG 4.34Å; W311-M594 HydrophobicContact CZ2-CE 4.46Å; W311-M594 HydrophobicContact CZ3-CB 4.46Å; W311-Y652 AromaticContact CD1-CE1 3.85Å; W311-Y652 AromaticContact NE1-CE1 3.88Å
312	T	95.9	Very high	94.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-69.2	-40.7	172.8	-61.8	0	0	0	0	110.1	V45 L46 Q307 S309 A315 T316 P329 D330 Q333	V45-T312 HydrophobicContact CG1-CG2 3.7Å; L46-T312 HydrophobicContact CD1-CG2 4.37Å; L46-T312 HydrophobicContact CD2-CG2 4.05Å; L46-T312 HydrophobicContact CG-CG2 4.07Å; Q307-T312 PolarHBondContact O-OG1 3.5Å; Q307-T312 VanDerWaalsContact O-OG1 3.11Å; S309-T312 WeakPolarHBondContact O-CA 3.44Å; S309-T312 WeakPolarHBondContact O-CB 3.44Å; S309-T312 PolarHBondContact O-N 3.08Å; T312-A315 WeakPolarHBondContact O-CB 3.49Å; T312-A315 PolarHBondContact O-N 3.38Å; T312-T316 WeakPolarHBondContact O-CG2 3.14Å; T312-T316 PolarHBondContact O-N 2.79Å; T312-P329 HydrophobicContact CG2-CB 4.48Å; T312-D330 HydrophobicContact CG2-CB 4.14Å; T312-Q333 PolarHBondContact OG1-NE2 2.95Å
313	L	94.1	Very high	93.7	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-43.8	174.3	-66.8	172.6	0	0	0	112	V45 K49 D56 S309 R310 A315 T316	V45-L313 HydrophobicContact CG2-CD1 4.18Å; V45-L313 HydrophobicContact CG2-CD2 4.23Å; V45-L313 HydrophobicContact CG2-CG 4.14Å; K49-L313 HydrophobicContact CD-CD2 3.75Å; D56-L313 HydrophobicContact CB-CD1 3.85Å; S309-L313 PolarHBondContact O-N 3.15Å; R310-L313 PolarHBondContact O-N 2.01Å; L313-A315 PolarHBondContact O-N 2.96Å; L313-T316 WeakPolarHBondContact O-CB 3.23Å; L313-T316 PolarHBondContact O-N 3.36Å; L313-T316 PolarHBondContact O-OG1 3.42Å
314	Q	95.1	Very high	93	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.1	-38.9	171.8	175.4	179.6	75.5	0	0	111.9	R310 T316 T317 M318 A382 Q386 I389	R310-Q314 WeakPolarHBondContact O-CB 3.24Å; R310-Q314 PolarHBondContact O-N 2.97Å; Q314-T316 VanDerWaalsContact C-N 3.25Å; Q314-T316 PolarHBondContact O-N 2.79Å; Q314-T317 PolarHBondContact O-N 3.2Å; Q314-T317 PolarHBondContact O-OG1 3Å; Q314-M318 HydrophobicContact CG-SD 4.39Å; Q314-M318 WeakPolarHBondContact O-CG 3.44Å; Q314-A382 PolarHBondContact NE2-O 3.3Å; Q314-Q386 VanDerWaalsContact CG-OE1 3.31Å; Q314-I389 HydrophobicContact CG-CD1 3.68Å
315	A	94.9	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.4	-24	177.7	0	0	0	0	0	112.9	W311 T312 L313 T317 M318 P329 M332 M584	W311-A315 PolarHBondContact O-N 2.73Å; T312-A315 WeakPolarHBondContact O-CB 3.49Å; T312-A315 PolarHBondContact O-N 3.38Å; L313-A315 PolarHBondContact O-N 2.96Å; A315-T317 PolarHBondContact O-N 2.95Å; A315-M318 PolarHBondContact O-N 3.13Å; A315-M318 VanDerWaalsContact O-N 3.15Å; A315-P329 HydrophobicContact CB-CB 3.79Å; A315-M332 HydrophobicContact CB-CG 4.45Å; A315-M584 HydrophobicContact CB-CE 4.42Å; A315-M584 WeakPolarHBondContact O-CE 3.4Å
316	T	92.7	Very high	92.1	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.117	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-22.3	178.3	68.7	0	0	0	0	113.5	L46 T312 L313 Q314 P329	L46-T316 HydrophobicContact CD2-CG2 3.82Å; T312-T316 WeakPolarHBondContact O-CG2 3.14Å; T312-T316 PolarHBondContact O-N 2.79Å; L313-T316 WeakPolarHBondContact O-CB 3.23Å; L313-T316 PolarHBondContact O-N 3.36Å; L313-T316 PolarHBondContact O-OG1 3.42Å; Q314-T316 VanDerWaalsContact C-N 3.25Å; Q314-T316 PolarHBondContact O-N 2.79Å; T316-P329 HydrophobicContact CG2-CB 4Å; T316-P329 HydrophobicContact CG2-CG 4.05Å
317	T	91.6	Very high	92	Very high	36 Å²	36	30 Å²	30	22%	0.221	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	14.9	178.8	56	0	0	0	0	113	Q314 A315 I389 N580	Q314-T317 PolarHBondContact O-N 3.2Å; Q314-T317 PolarHBondContact O-OG1 3Å; A315-T317 PolarHBondContact O-N 2.95Å; T317-I389 WeakPolarHBondContact OG1-CG2 3.07Å; T317-N580 PolarHBondContact O-ND2 3.47Å; T317-N580 PolarHBondContact O-OD1 3.37Å
318	M	93.7	Very high	91.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	19%	0.189	C	C	.	.	S	Bend	trans	-111.5	165.7	-178.5	-62.8	179.9	89.5	0	0	111.6	Q314 A315 V385 I389 N580 I582 H583 M584 W586 Q587	Q314-M318 HydrophobicContact CG-SD 4.39Å; Q314-M318 WeakPolarHBondContact O-CG 3.44Å; A315-M318 PolarHBondContact O-N 3.13Å; A315-M318 VanDerWaalsContact O-N 3.15Å; M318-V385 HydrophobicContact CE-CG1 3.8Å; M318-I389 HydrophobicContact CE-CD1 4.25Å; M318-I389 HydrophobicContact CG-CD1 3.68Å; M318-I389 HydrophobicContact CG-CG1 4.32Å; M318-I389 HydrophobicContact SD-CD1 3.97Å; M318-N580 PolarHBondContact N-ND2 2.96Å; M318-N580 PolarHBondContact O-ND2 3.23Å; M318-I582 CarbonylContact C-O 3.52Å; M318-I582 WeakPolarHBondContact CA-O 3.4Å; M318-I582 VanDerWaalsContact CB-O 3.31Å; M318-I582 WeakPolarHBondContact CB-O 3.49Å; M318-I582 HydrophobicContact CE-CB 4.47Å; M318-I582 HydrophobicContact CE-CG2 3.66Å; M318-H583 VanDerWaalsContact CE-O 3.28Å; M318-H583 WeakPolarHBondContact CE-O 3.43Å; M318-M584 HydrophobicContact CB-CB 4.49Å; M318-M584 HydrophobicContact CB-CG 3.58Å; M318-M584 HydrophobicContact SD-CG 4.42Å; M318-W586 HydrophobicContact CE-CB 4.2Å; M318-Q587 HydrophobicContact CE-CG 4.09Å; M318-Q587 HydrophobicContact SD-CG 3.77Å
319	D	93.2	Very high	91.8	Very high	36 Å²	36	32.1 Å²	32.1	19%	0.193	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-82.6	120	171.5	176.3	11	0	0	0	110.1	N321 F549 I582 M584	D319-N321 VanDerWaalsContact OD1-CB 3.25Å; D319-N321 WeakPolarHBondContact OD1-CB 3.13Å; D319-N321 PolarHBondContact OD1-N 3.01Å; D319-F549 HydrophobicContact CB-CD2 4.41Å; D319-F549 WeakPolarHBondContact OD1-CD2 3.23Å; D319-F549 WeakPolarHBondContact OD1-CE2 3.39Å; D319-I582 PolarHBondContact N-O 3Å; D319-M584 WeakPolarHBondContact O-CG 3.34Å; D319-M584 PolarHBondContact O-N 3.22Å
320	G	91.5	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.194	C	C	.	.			trans	-94	7.5	-179.6	0	0	0	0	0	114.8	F322 V326 I327	G320-F322 PolarHBondContact O-N 2.78Å; G320-V326 WeakPolarHBondContact O-CA 3.41Å; G320-I327 PolarHBondContact O-N 3.4Å
321	N	91.6	Very high	91.8	Very high	69 Å²	69	32.8 Å²	32.8	37%	0.369	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-81.7	97.4	-177.3	-174.7	10.2	0	0	0	113.3	D319 G323 F549 H583	D319-N321 VanDerWaalsContact OD1-CB 3.25Å; D319-N321 WeakPolarHBondContact OD1-CB 3.13Å; D319-N321 PolarHBondContact OD1-N 3.01Å; N321-G323 PolarHBondContact O-N 3.15Å; N321-G323 WeakPolarHBondContact OD1-CA 3.39Å; N321-G323 PolarHBondContact OD1-N 3.5Å; N321-F549 HydrophobicContact CB-CE2 3.83Å; N321-F549 HydrophobicContact CB-CZ 4.25Å; N321-H583 PolarHBondContact O-NE2 3.44Å
322	F	89.7	Confident	91.7	Very high	79 Å²	79	33 Å²	33	35%	0.346	20%	0.198	S	C	.	.			trans	-86.1	24	172.1	-76.9	-106.8	0	0	0	112.7	G320 S324 M325 I327 H583 M584 A585	G320-F322 PolarHBondContact O-N 2.78Å; F322-S324 VanDerWaalsContact C-N 3.34Å; F322-S324 PolarHBondContact O-N 2.99Å; F322-M325 HydrophobicContact CB-CG 4.45Å; F322-M325 PolarHBondContact N-O 2.88Å; F322-M325 VanDerWaalsContact N-O 3.1Å; F322-I327 HydrophobicContact CB-CG1 4.49Å; F322-I327 HydrophobicContact CD2-CB 3.85Å; F322-I327 HydrophobicContact CD2-CG1 3.43Å; F322-I327 VanDerWaalsContact CD2-CG1 3.43Å; F322-I327 HydrophobicContact CE2-CB 3.87Å; F322-I327 HydrophobicContact CE2-CG1 3.73Å; F322-I327 HydrophobicContact CE2-CG2 4.42Å; F322-I327 HydrophobicContact CG-CG1 4.03Å; F322-H583 AromaticContact CD1-CE1 3.81Å; F322-H583 AromaticContact CD2-CE1 3.71Å; F322-H583 AromaticContact CD2-NE2 3.8Å; F322-H583 AromaticContact CE1-CE1 3.61Å; F322-H583 AromaticContact CE2-CE1 3.5Å; F322-H583 VanDerWaalsContact CE2-CE1 3.5Å; F322-H583 WeakPolarHBondContact CE2-CE1 3.37Å; F322-H583 AromaticContact CE2-NE2 3.97Å; F322-H583 AromaticContact CG-CE1 3.88Å; F322-H583 AromaticContact CZ-CE1 3.45Å; F322-H583 VanDerWaalsContact CZ-CE1 3.45Å; F322-H583 WeakPolarHBondContact CZ-CE1 3.34Å; F322-M584 HydrophobicContact CE2-CB 4.11Å; F322-M584 HydrophobicContact CZ-CB 4.48Å; F322-A585 HydrophobicContact CE1-CB 4.05Å; F322-A585 HydrophobicContact CZ-CB 4.03Å
323	G	85.6	Confident	91.7	Very high	65 Å²	65	34.1 Å²	34.1	67%	0.67	20%	0.203	S	C	*	.	S	Bend	trans	81.8	-64.2	177.7	0	0	0	0	0	113.7	N321	N321-G323 PolarHBondContact O-N 3.15Å; N321-G323 WeakPolarHBondContact OD1-CA 3.39Å; N321-G323 PolarHBondContact OD1-N 3.5Å
324	S	82.6	Confident	91.6	Very high	120 Å²	120	34.7 Å²	34.7	84%	0.839	21%	0.207	S	C	*	.	S	Bend	trans	-90.7	-19.3	-178.2	60.7	0	0	0	0	114	F322	F322-S324 VanDerWaalsContact C-N 3.34Å; F322-S324 PolarHBondContact O-N 2.99Å
325	M	85.5	Confident	91.6	Very high	101 Å²	101	36.1 Å²	36.1	50%	0.498	22%	0.215	S	C	.	.	S	Bend	trans	-146.5	144.2	-178.8	60.5	-176.6	-60.7	0	0	109.8	F322 I327	F322-M325 HydrophobicContact CB-CG 4.45Å; F322-M325 PolarHBondContact N-O 2.88Å; F322-M325 VanDerWaalsContact N-O 3.1Å; M325-I327 HydrophobicContact CE-CD1 3.38Å; M325-I327 HydrophobicContact CE-CG1 4.42Å; M325-I327 HydrophobicContact CG-CD1 4.46Å; M325-I327 HydrophobicContact SD-CD1 4.17Å
326	V	88.4	Confident	91.5	Very high	54 Å²	54	37.1 Å²	37.1	33%	0.327	22%	0.221	S	C	.	.	B	Isolated β-bridge	trans	-92.2	117.9	171.2	178.1	0	0	0	0	108.2	G320 F549	G320-V326 WeakPolarHBondContact O-CA 3.41Å; V326-F549 HydrophobicContact CG1-CE1 3.8Å; V326-F549 HydrophobicContact CG1-CZ 3.72Å; V326-F549 HydrophobicContact CG2-CZ 4.32Å
327	I	91.8	Very high	91.4	Very high	29 Å²	29	36.4 Å²	36.4	15%	0.149	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-84.6	131.2	176.4	-65.4	-70.7	0	0	0	108.8	G320 F322 M325 Q331 M332 M584	G320-I327 PolarHBondContact O-N 3.4Å; F322-I327 HydrophobicContact CB-CG1 4.49Å; F322-I327 HydrophobicContact CD2-CB 3.85Å; F322-I327 HydrophobicContact CD2-CG1 3.43Å; F322-I327 VanDerWaalsContact CD2-CG1 3.43Å; F322-I327 HydrophobicContact CE2-CB 3.87Å; F322-I327 HydrophobicContact CE2-CG1 3.73Å; F322-I327 HydrophobicContact CE2-CG2 4.42Å; F322-I327 HydrophobicContact CG-CG1 4.03Å; M325-I327 HydrophobicContact CE-CD1 3.38Å; M325-I327 HydrophobicContact CE-CG1 4.42Å; M325-I327 HydrophobicContact CG-CD1 4.46Å; M325-I327 HydrophobicContact SD-CD1 4.17Å; I327-Q331 HydrophobicContact CG2-CB 4.01Å; I327-M332 HydrophobicContact CG2-SD 4.04Å; I327-M584 HydrophobicContact CG2-SD 4.36Å
328	Q	92.2	Very high	91.5	Very high	40 Å²	40	38.3 Å²	38.3	19%	0.187	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-80	150.5	174.8	-62.4	-67.8	-45.7	0	0	111.1	A193 D330 Q331	A193-Q328 HydrophobicContact CB-CG 4.11Å; Q328-D330 VanDerWaalsContact C-N 3.31Å; Q328-D330 VanDerWaalsContact CB-OD1 3.27Å; Q328-D330 WeakPolarHBondContact CB-OD1 3.32Å; Q328-D330 PolarHBondContact O-N 3.36Å; Q328-Q331 HydrophobicContact CB-CG 4.05Å; Q328-Q331 WeakPolarHBondContact O-CB 3.45Å; Q328-Q331 PolarHBondContact O-N 2.89Å
329	P	93.4	Very high	91.5	Very high	18 Å²	18	39.1 Å²	39.1	12%	0.117	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-53.9	-43	-178.1	-27.7	34.9	0	0	0	114.2	T312 A315 T316 Q331 M332 M584	T312-P329 HydrophobicContact CG2-CB 4.48Å; A315-P329 HydrophobicContact CB-CB 3.79Å; T316-P329 HydrophobicContact CG2-CB 4Å; T316-P329 HydrophobicContact CG2-CG 4.05Å; P329-Q331 VanDerWaalsContact C-N 3.3Å; P329-Q331 PolarHBondContact O-N 3.25Å; P329-M332 WeakPolarHBondContact O-CB 3.08Å; P329-M332 PolarHBondContact O-N 3.46Å; P329-M584 HydrophobicContact CB-CE 4.39Å; P329-M584 HydrophobicContact CG-CE 3.88Å
330	D	94.1	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-70.5	-20.5	178.9	48.9	-24.6	0	0	0	113.6	V43 L46 P189 R192 T312 Q328 M332	V43-D330 WeakPolarHBondContact CG1-OD2 3.27Å; L46-D330 HydrophobicContact CD1-CB 3.85Å; P189-D330 VanDerWaalsContact CB-OD2 3.31Å; P189-D330 WeakPolarHBondContact CB-OD2 3.23Å; P189-D330 HydrophobicContact CG-CB 4.28Å; R192-D330 IonicContact CZ-OD1 3.2Å; R192-D330 IonicContact CZ-OD2 3.61Å; R192-D330 IonicContact NE-OD1 3.22Å; R192-D330 IonicContact NE-OD2 2.83Å; R192-D330 PolarHBondContact NE-OD2 3.19Å; R192-D330 IonicContact NH2-OD1 3.96Å; R192-D330 PolarHBondContact NH2-OD1 3.45Å; R192-D330 IonicContact NH2-OD2 2.63Å; T312-D330 HydrophobicContact CG2-CB 4.14Å; Q328-D330 VanDerWaalsContact C-N 3.31Å; Q328-D330 VanDerWaalsContact CB-OD1 3.27Å; Q328-D330 WeakPolarHBondContact CB-OD1 3.32Å; Q328-D330 PolarHBondContact O-N 3.36Å; D330-M332 VanDerWaalsContact C-N 3.27Å; D330-M332 PolarHBondContact O-N 2.99Å
331	Q	94.7	Very high	91.3	Very high	18 Å²	18	41.5 Å²	41.5	8%	0.084	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-72.5	-19.1	174.2	-70.1	-179	-55.3	0	0	113.2	P189 I327 Q328 P329 Q333 T334	P189-Q331 HydrophobicContact CB-CG 3.41Å; P189-Q331 VanDerWaalsContact CB-CG 3.41Å; P189-Q331 HydrophobicContact CG-CG 3.93Å; I327-Q331 HydrophobicContact CG2-CB 4.01Å; Q328-Q331 HydrophobicContact CB-CG 4.05Å; Q328-Q331 WeakPolarHBondContact O-CB 3.45Å; Q328-Q331 PolarHBondContact O-N 2.89Å; P329-Q331 VanDerWaalsContact C-N 3.3Å; P329-Q331 PolarHBondContact O-N 3.25Å; Q331-Q333 PolarHBondContact O-N 3.39Å; Q331-Q333 VanDerWaalsContact O-N 3.12Å; Q331-T334 WeakPolarHBondContact O-CB 3.49Å; Q331-T334 PolarHBondContact O-N 3.18Å; Q331-T334 PolarHBondContact O-OG1 3.01Å
332	M	94.3	Very high	91.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.03	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-59.2	-24.9	176.8	-72.2	-56.6	-61.9	0	0	112.5	A315 I327 P329 D330 T334 V335 M584 Q587 I588 Y591	A315-M332 HydrophobicContact CB-CG 4.45Å; I327-M332 HydrophobicContact CG2-SD 4.04Å; P329-M332 WeakPolarHBondContact O-CB 3.08Å; P329-M332 PolarHBondContact O-N 3.46Å; D330-M332 VanDerWaalsContact C-N 3.27Å; D330-M332 PolarHBondContact O-N 2.99Å; M332-T334 PolarHBondContact O-N 2.94Å; M332-T334 VanDerWaalsContact O-N 3.15Å; M332-V335 HydrophobicContact CE-CG2 4.08Å; M332-V335 WeakPolarHBondContact O-CB 3.42Å; M332-V335 VanDerWaalsContact O-CG2 3.32Å; M332-V335 WeakPolarHBondContact O-CG2 3.49Å; M332-V335 PolarHBondContact O-N 2.95Å; M332-V335 VanDerWaalsContact O-N 3.08Å; M332-M584 HydrophobicContact CG-SD 4.35Å; M332-M584 HydrophobicContact SD-CB 4.21Å; M332-Q587 HydrophobicContact CE-CB 3.99Å; M332-I588 HydrophobicContact CE-CG1 4.48Å; M332-Y591 HydrophobicContact CB-CE2 4.15Å; M332-Y591 HydrophobicContact CE-CE2 4.42Å
333	Q	94.3	Very high	91.4	Very high	23 Å²	23	39.9 Å²	39.9	11%	0.107	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-61.1	-21.8	173.1	-63.3	-180	45.3	0	0	113.1	A42 T312 Q331 V335 N336 P337	A42-Q333 PolarHBondContact O-NE2 3.48Å; A42-Q333 VanDerWaalsContact O-NE2 3.09Å; T312-Q333 PolarHBondContact OG1-NE2 2.95Å; Q331-Q333 PolarHBondContact O-N 3.39Å; Q331-Q333 VanDerWaalsContact O-N 3.12Å; Q333-V335 PolarHBondContact O-N 2.88Å; Q333-N336 PolarHBondContact O-N 3.37Å; Q333-P337 WeakPolarHBondContact O-CD 3.36Å
334	T	93.8	Very high	91.6	Very high	13 Å²	13	38 Å²	38	8%	0.08	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-63.5	-25.6	175.3	-58.9	0	0	0	0	112.6	L182 T185 V186 Q331 M332 N336 P337 I338	L182-T334 HydrophobicContact CD1-CG2 3.82Å; T185-T334 VanDerWaalsContact C-OG1 3.27Å; T185-T334 WeakPolarHBondContact CB-OG1 3.22Å; T185-T334 PolarHBondContact O-OG1 3.45Å; T185-T334 VanDerWaalsContact O-OG1 3.1Å; T185-T334 WeakPolarHBondContact OG1-CA 3.42Å; T185-T334 PolarHBondContact OG1-OG1 2.8Å; V186-T334 HydrophobicContact CG2-CG2 3.41Å; V186-T334 VanDerWaalsContact CG2-CG2 3.41Å; Q331-T334 WeakPolarHBondContact O-CB 3.49Å; Q331-T334 PolarHBondContact O-N 3.18Å; Q331-T334 PolarHBondContact O-OG1 3.01Å; M332-T334 PolarHBondContact O-N 2.94Å; M332-T334 VanDerWaalsContact O-N 3.15Å; T334-N336 PolarHBondContact O-N 3.46Å; T334-P337 WeakPolarHBondContact O-CD 3.32Å; T334-P337 VanDerWaalsContact O-CG 3.3Å; T334-P337 WeakPolarHBondContact O-CG 3.37Å; T334-I338 HydrophobicContact CG2-CD1 3.8Å; T334-I338 HydrophobicContact CG2-CG1 4.26Å; T334-I338 WeakPolarHBondContact O-CG1 3.5Å; T334-I338 PolarHBondContact O-N 2.89Å
335	V	94.3	Very high	91.9	Very high	30 Å²	30	35 Å²	35	18%	0.182	19%	0.188	C	C	.	.	H	α-helix	trans	-59.5	-38.5	179	178.8	0	0	0	0	110.5	M332 Q333 I338 L339 Y591	M332-V335 HydrophobicContact CE-CG2 4.08Å; M332-V335 WeakPolarHBondContact O-CB 3.42Å; M332-V335 VanDerWaalsContact O-CG2 3.32Å; M332-V335 WeakPolarHBondContact O-CG2 3.49Å; M332-V335 PolarHBondContact O-N 2.95Å; M332-V335 VanDerWaalsContact O-N 3.08Å; Q333-V335 PolarHBondContact O-N 2.88Å; V335-I338 PolarHBondContact O-N 3.4Å; V335-L339 HydrophobicContact CG1-CD1 3.62Å; V335-L339 HydrophobicContact CG1-CG 4.05Å; V335-L339 WeakPolarHBondContact O-CB 3.47Å; V335-L339 VanDerWaalsContact O-CG 3.23Å; V335-L339 WeakPolarHBondContact O-CG 3.48Å; V335-L339 PolarHBondContact O-N 2.94Å; V335-Y591 HydrophobicContact CB-CD1 4.36Å; V335-Y591 HydrophobicContact CB-CG 4.17Å; V335-Y591 HydrophobicContact CG1-CG 4.11Å
336	N	92.6	Very high	92.3	Very high	21 Å²	21	32.4 Å²	32.4	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-59.3	-179.8	-173.2	45.6	0	0	0	113.6	Q333 T334 I338 L339 I340 Y591 T595 E598	Q333-N336 PolarHBondContact O-N 3.37Å; T334-N336 PolarHBondContact O-N 3.46Å; N336-I338 VanDerWaalsContact C-N 3.29Å; N336-I338 PolarHBondContact O-N 2.76Å; N336-L339 PolarHBondContact O-N 3.49Å; N336-L339 VanDerWaalsContact O-N 3.08Å; N336-I340 WeakPolarHBondContact O-CG1 3.44Å; N336-I340 PolarHBondContact O-N 3.03Å; N336-Y591 HydrophobicContact CB-CD1 4.3Å; N336-T595 WeakPolarHBondContact OD1-CG2 2.97Å; N336-T595 PolarHBondContact OD1-OG1 3.39Å; N336-E598 PolarHBondContact OD1-OE2 3.24Å
337	P	91.3	Very high	92.4	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-32.9	179.6	23.2	-33.2	0	0	0	113.6	L182 Q333 T334 I340 L341	L182-P337 HydrophobicContact CB-CB 4.22Å; L182-P337 HydrophobicContact CB-CG 4.41Å; L182-P337 HydrophobicContact CD1-CB 4.36Å; L182-P337 HydrophobicContact CD1-CG 4.11Å; Q333-P337 WeakPolarHBondContact O-CD 3.36Å; T334-P337 WeakPolarHBondContact O-CD 3.32Å; T334-P337 VanDerWaalsContact O-CG 3.3Å; T334-P337 WeakPolarHBondContact O-CG 3.37Å; P337-I340 PolarHBondContact O-N 3.41Å; P337-L341 WeakPolarHBondContact O-CG 3.39Å; P337-L341 PolarHBondContact O-N 2.65Å; P337-L341 VanDerWaalsContact O-N 3.15Å
338	I	93.7	Very high	92.2	Very high	76 Å²	76	32.3 Å²	32.3	39%	0.39	18%	0.176	S	C	.	.	H	α-helix	trans	-61.2	-49.3	172.5	-66.9	175.8	0	0	0	110.1	L182 T334 V335 N336 I340 L341 I342	L182-I338 HydrophobicContact CD1-CD1 4.14Å; L182-I338 HydrophobicContact CD1-CG1 3.4Å; L182-I338 VanDerWaalsContact CD1-CG1 3.4Å; T334-I338 HydrophobicContact CG2-CD1 3.8Å; T334-I338 HydrophobicContact CG2-CG1 4.26Å; T334-I338 WeakPolarHBondContact O-CG1 3.5Å; T334-I338 PolarHBondContact O-N 2.89Å; V335-I338 PolarHBondContact O-N 3.4Å; N336-I338 VanDerWaalsContact C-N 3.29Å; N336-I338 PolarHBondContact O-N 2.76Å; I338-I340 PolarHBondContact O-N 2.99Å; I338-L341 PolarHBondContact O-N 3.03Å; I338-I342 HydrophobicContact CG2-CD1 3.93Å; I338-I342 WeakPolarHBondContact O-CG1 3.36Å; I338-I342 PolarHBondContact O-N 3.09Å
339	L	94	Very high	92.1	Very high	20 Å²	20	38.1 Å²	38.1	11%	0.105	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-37.6	179.5	-73.7	176.1	0	0	0	112	V335 N336 L341 I342 M343 F592 T595	V335-L339 HydrophobicContact CG1-CD1 3.62Å; V335-L339 HydrophobicContact CG1-CG 4.05Å; V335-L339 WeakPolarHBondContact O-CB 3.47Å; V335-L339 VanDerWaalsContact O-CG 3.23Å; V335-L339 WeakPolarHBondContact O-CG 3.48Å; V335-L339 PolarHBondContact O-N 2.94Å; N336-L339 PolarHBondContact O-N 3.49Å; N336-L339 VanDerWaalsContact O-N 3.08Å; L339-L341 PolarHBondContact O-N 3.29Å; L339-I342 PolarHBondContact O-N 3.42Å; L339-M343 HydrophobicContact CD2-CE 4.38Å; L339-M343 WeakPolarHBondContact O-CA 3.49Å; L339-M343 WeakPolarHBondContact O-CB 3.44Å; L339-M343 WeakPolarHBondContact O-CG 3.23Å; L339-M343 PolarHBondContact O-N 3.42Å; L339-F592 HydrophobicContact CD1-CB 4.31Å; L339-F592 HydrophobicContact CD2-CD2 4.2Å; L339-T595 HydrophobicContact CB-CG2 3.6Å; L339-T595 WeakPolarHBondContact CD1-OG1 3.37Å
340	I	89.9	Confident	92.1	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-48.7	174.9	-69.3	173.1	0	0	0	110.4	N336 P337 I338 I342 M343 V344 T595 E598	N336-I340 WeakPolarHBondContact O-CG1 3.44Å; N336-I340 PolarHBondContact O-N 3.03Å; P337-I340 PolarHBondContact O-N 3.41Å; I338-I340 PolarHBondContact O-N 2.99Å; I340-I342 PolarHBondContact O-N 3.36Å; I340-M343 PolarHBondContact O-N 3.42Å; I340-V344 HydrophobicContact CG2-CG2 3.98Å; I340-V344 WeakPolarHBondContact O-CB 3.4Å; I340-V344 WeakPolarHBondContact O-CG2 3.23Å; I340-V344 PolarHBondContact O-N 3.31Å; I340-T595 HydrophobicContact CB-CG2 4.44Å; I340-T595 HydrophobicContact CG1-CG2 3.55Å; I340-E598 WeakPolarHBondContact CD1-OE2 3.31Å
341	L	88.8	Confident	91.9	Very high	72 Å²	72	45 Å²	45	38%	0.377	23%	0.234	S	C	.	.	H	α-helix	trans	-61.3	-29.5	-179.2	-71.1	173.5	0	0	0	112.9	N178 L182 P337 I338 L339 P345	N178-L341 HydrophobicContact CB-CD2 3.9Å; N178-L341 HydrophobicContact CB-CG 4.43Å; L182-L341 HydrophobicContact CD2-CD1 4.25Å; P337-L341 WeakPolarHBondContact O-CG 3.39Å; P337-L341 PolarHBondContact O-N 2.65Å; P337-L341 VanDerWaalsContact O-N 3.15Å; I338-L341 PolarHBondContact O-N 3.03Å; L339-L341 PolarHBondContact O-N 3.29Å; L341-P345 VanDerWaalsContact O-CD 3.23Å; L341-P345 WeakPolarHBondContact O-CD 3.22Å; L341-P345 WeakPolarHBondContact O-CG 3.31Å
342	I	92.5	Very high	91.7	Very high	88 Å²	88	45.7 Å²	45.7	45%	0.451	24%	0.237	S	C	.	.	H	α-helix	trans	-85.5	-47.1	176.7	-62.9	169.1	0	0	0	111.1	I338 L339 I340 P345 V346	I338-I342 HydrophobicContact CG2-CD1 3.93Å; I338-I342 WeakPolarHBondContact O-CG1 3.36Å; I338-I342 PolarHBondContact O-N 3.09Å; L339-I342 PolarHBondContact O-N 3.42Å; I340-I342 PolarHBondContact O-N 3.36Å; I342-P345 WeakPolarHBondContact O-CD 3.41Å; I342-V346 HydrophobicContact CG2-CG2 4.41Å; I342-V346 WeakPolarHBondContact O-CG2 3.31Å; I342-V346 PolarHBondContact O-N 3.32Å
343	M	91.6	Very high	91.4	Very high	26 Å²	26	48 Å²	48	13%	0.128	25%	0.253	C	S	.	.	H	α-helix	trans	-74.3	-34.4	-170.3	-70.5	-60.5	140.5	0	0	112.8	L339 I340 V346 V347 F592 V599	L339-M343 HydrophobicContact CD2-CE 4.38Å; L339-M343 WeakPolarHBondContact O-CA 3.49Å; L339-M343 WeakPolarHBondContact O-CB 3.44Å; L339-M343 WeakPolarHBondContact O-CG 3.23Å; L339-M343 PolarHBondContact O-N 3.42Å; I340-M343 PolarHBondContact O-N 3.42Å; M343-V346 PolarHBondContact O-N 3.42Å; M343-V347 VanDerWaalsContact O-CB 3.32Å; M343-V347 WeakPolarHBondContact O-CB 3.48Å; M343-V347 WeakPolarHBondContact O-CG2 3.41Å; M343-V347 PolarHBondContact O-N 3.06Å; M343-F592 HydrophobicContact CE-CD2 4.08Å; M343-F592 HydrophobicContact CE-CE2 3.41Å; M343-F592 VanDerWaalsContact CE-CE2 3.41Å; M343-F592 HydrophobicContact CE-CZ 4.32Å; M343-F592 HydrophobicContact SD-CE2 4.08Å; M343-V599 HydrophobicContact CB-CG2 4.06Å
344	V	89.2	Confident	91.2	Very high	27 Å²	27	51.4 Å²	51.4	16%	0.164	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-54.5	178	168.7	0	0	0	0	111	I340 V346 V347 D348 V599	I340-V344 HydrophobicContact CG2-CG2 3.98Å; I340-V344 WeakPolarHBondContact O-CB 3.4Å; I340-V344 WeakPolarHBondContact O-CG2 3.23Å; I340-V344 PolarHBondContact O-N 3.31Å; V344-V346 VanDerWaalsContact C-N 3.34Å; V344-V346 PolarHBondContact O-N 3.42Å; V344-V347 PolarHBondContact O-N 3.43Å; V344-D348 PolarHBondContact O-N 3.35Å; V344-V599 HydrophobicContact CG2-CG1 3.96Å; V344-V599 HydrophobicContact CG2-CG2 3.83Å
345	P	89.8	Confident	91	Very high	57 Å²	57	52.6 Å²	52.6	37%	0.37	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-39.9	173.7	-24.3	32.9	0	0	0	114	L341 I342 F349	L341-P345 VanDerWaalsContact O-CD 3.23Å; L341-P345 WeakPolarHBondContact O-CD 3.22Å; L341-P345 WeakPolarHBondContact O-CG 3.31Å; I342-P345 WeakPolarHBondContact O-CD 3.41Å; P345-F349 HydrophobicContact CB-CD2 4.09Å; P345-F349 HydrophobicContact CB-CE2 4.41Å; P345-F349 WeakPolarHBondContact O-CB 3.28Å; P345-F349 VanDerWaalsContact O-CD2 3.27Å; P345-F349 WeakPolarHBondContact O-CD2 3Å; P345-F349 PolarHBondContact O-N 2.81Å
346	V	93.4	Very high	90.7	Very high	45 Å²	45	55.3 Å²	55.3	27%	0.273	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-44.3	179.6	168.7	0	0	0	0	111	I342 M343 V344 I350 I351	I342-V346 HydrophobicContact CG2-CG2 4.41Å; I342-V346 WeakPolarHBondContact O-CG2 3.31Å; I342-V346 PolarHBondContact O-N 3.32Å; M343-V346 PolarHBondContact O-N 3.42Å; V344-V346 VanDerWaalsContact C-N 3.34Å; V344-V346 PolarHBondContact O-N 3.42Å; V346-I350 HydrophobicContact CG1-CD1 4.48Å; V346-I350 HydrophobicContact CG2-CD1 4.5Å; V346-I350 WeakPolarHBondContact O-CA 3.25Å; V346-I350 VanDerWaalsContact O-CB 3.23Å; V346-I350 WeakPolarHBondContact O-CB 3.36Å; V346-I350 PolarHBondContact O-N 3.39Å; V346-I351 HydrophobicContact CG1-CD1 4.15Å; V346-I351 HydrophobicContact CG1-CG1 4.28Å; V346-I351 PolarHBondContact O-N 3.09Å
347	V	91	Very high	90.5	Very high	6 Å²	6	62.2 Å²	62.2	4%	0.036	33%	0.326	C	S	.	.	I	π-helix	trans	-64	-47.1	179.3	169.7	0	0	0	0	110.5	M343 V344 I351 Y352 V599 V600	M343-V347 VanDerWaalsContact O-CB 3.32Å; M343-V347 WeakPolarHBondContact O-CB 3.48Å; M343-V347 WeakPolarHBondContact O-CG2 3.41Å; M343-V347 PolarHBondContact O-N 3.06Å; V344-V347 PolarHBondContact O-N 3.43Å; V347-I351 HydrophobicContact CG2-CD1 3.92Å; V347-I351 PolarHBondContact O-N 3.26Å; V347-Y352 HydrophobicContact CG1-CD1 4.09Å; V347-Y352 HydrophobicContact CG1-CD2 4.1Å; V347-Y352 HydrophobicContact CG1-CE1 3.53Å; V347-Y352 HydrophobicContact CG1-CE2 3.57Å; V347-Y352 HydrophobicContact CG1-CG 4.36Å; V347-Y352 WeakPolarHBondContact CG1-OH 3.37Å; V347-Y352 PolarHBondContact O-N 3.35Å; V347-V599 HydrophobicContact CB-CG1 4.04Å; V347-V599 HydrophobicContact CG1-CG1 4.24Å; V347-V599 HydrophobicContact CG2-CG1 3.86Å; V347-V600 HydrophobicContact CG1-CG1 4.21Å
348	D	87.3	Confident	90.5	Very high	75 Å²	75	66.3 Å²	66.3	40%	0.401	35%	0.353	S	S	.	.	I	π-helix	trans	-74	-42.4	-175.1	-75.5	-18.1	0	0	0	113.6	V344 Y352 P353	V344-D348 PolarHBondContact O-N 3.35Å; D348-Y352 WeakPolarHBondContact OD1-CE2 3.23Å; D348-P353 VanDerWaalsContact O-CD 3.25Å; D348-P353 WeakPolarHBondContact O-CD 3.12Å
349	F	90.1	Very high	90.1	Very high	162 Å²	162	71.7 Å²	71.7	71%	0.711	37%	0.373	S	S	*	.	I	π-helix	trans	-94.6	-21.8	-174.3	-64.3	-63	0	0	0	114.3	P345 P353	P345-F349 HydrophobicContact CB-CD2 4.09Å; P345-F349 HydrophobicContact CB-CE2 4.41Å; P345-F349 WeakPolarHBondContact O-CB 3.28Å; P345-F349 VanDerWaalsContact O-CD2 3.27Å; P345-F349 WeakPolarHBondContact O-CD2 3Å; P345-F349 PolarHBondContact O-N 2.81Å; F349-P353 WeakPolarHBondContact O-CG 3.38Å
350	I	92.8	Very high	89.6	Confident	93 Å²	93	76.2 Å²	76.2	48%	0.477	40%	0.397	S	S	.	.	I	π-helix	trans	-114.3	-60.1	-176.5	-54	176.5	0	0	0	110.2	V346 P353 L354	V346-I350 HydrophobicContact CG1-CD1 4.48Å; V346-I350 HydrophobicContact CG2-CD1 4.5Å; V346-I350 WeakPolarHBondContact O-CA 3.25Å; V346-I350 VanDerWaalsContact O-CB 3.23Å; V346-I350 WeakPolarHBondContact O-CB 3.36Å; V346-I350 PolarHBondContact O-N 3.39Å; I350-P353 WeakPolarHBondContact O-CD 3.05Å; I350-L354 HydrophobicContact CG2-CD1 3.69Å; I350-L354 WeakPolarHBondContact O-CB 3.31Å; I350-L354 WeakPolarHBondContact O-CD1 3.23Å; I350-L354 WeakPolarHBondContact O-CG 3.5Å; I350-L354 PolarHBondContact O-N 3.08Å; I350-L354 VanDerWaalsContact O-N 3.09Å
351	I	91.3	Very high	89.1	Confident	69 Å²	69	81.8 Å²	81.8	35%	0.354	43%	0.427	S	S	.	.	I	π-helix	trans	-68.1	-52.6	-169.8	-60.1	179.4	0	0	0	111.7	V346 V347 L354 I355	V346-I351 HydrophobicContact CG1-CD1 4.15Å; V346-I351 HydrophobicContact CG1-CG1 4.28Å; V346-I351 PolarHBondContact O-N 3.09Å; V347-I351 HydrophobicContact CG2-CD1 3.92Å; V347-I351 PolarHBondContact O-N 3.26Å; I351-L354 PolarHBondContact O-N 2.75Å; I351-I355 HydrophobicContact CG2-CD1 3.66Å; I351-I355 HydrophobicContact CG2-CG1 4.32Å; I351-I355 VanDerWaalsContact O-CG1 3.31Å; I351-I355 WeakPolarHBondContact O-CG1 3.48Å; I351-I355 PolarHBondContact O-N 3.1Å
352	Y	89.1	Confident	88.9	Confident	33 Å²	33	80.5 Å²	80.5	13%	0.129	42%	0.419	C	S	.	.	H	α-helix	trans	-62.1	-43.3	-178.8	-66.4	-21.1	0	0	0	113.3	V347 D348 L354 I355 S356 F362 R367	V347-Y352 HydrophobicContact CG1-CD1 4.09Å; V347-Y352 HydrophobicContact CG1-CD2 4.1Å; V347-Y352 HydrophobicContact CG1-CE1 3.53Å; V347-Y352 HydrophobicContact CG1-CE2 3.57Å; V347-Y352 HydrophobicContact CG1-CG 4.36Å; V347-Y352 WeakPolarHBondContact CG1-OH 3.37Å; V347-Y352 PolarHBondContact O-N 3.35Å; D348-Y352 WeakPolarHBondContact OD1-CE2 3.23Å; Y352-L354 PolarHBondContact O-N 2.72Å; Y352-I355 PolarHBondContact O-N 2.6Å; Y352-S356 WeakPolarHBondContact O-CB 3.44Å; Y352-S356 PolarHBondContact O-N 3.32Å; Y352-F362 HydrophobicContact CD1-CD1 4.21Å; Y352-F362 HydrophobicContact CD1-CE1 4.4Å; Y352-F362 HydrophobicContact CE1-CD1 4.09Å; Y352-F362 AromaticContact CE1-CE1 3.96Å; Y352-F362 HydrophobicContact CE1-CE1 3.96Å; Y352-R367 HydrophobicContact CE1-CG 4.47Å
353	P	88.9	Confident	88.8	Confident	56 Å²	56	78.5 Å²	78.5	36%	0.364	41%	0.411	S	S	.	.	H	α-helix	trans	-62.8	-37.6	173.7	-28.6	39.5	0	0	0	113.5	D348 F349 I350 S356 K357	D348-P353 VanDerWaalsContact O-CD 3.25Å; D348-P353 WeakPolarHBondContact O-CD 3.12Å; F349-P353 WeakPolarHBondContact O-CG 3.38Å; I350-P353 WeakPolarHBondContact O-CD 3.05Å; P353-S356 WeakPolarHBondContact O-CB 3.49Å; P353-S356 PolarHBondContact O-N 3.35Å; P353-K357 WeakPolarHBondContact O-CG 3.28Å; P353-K357 PolarHBondContact O-N 3.28Å
354	L	90.4	Very high	88.7	Confident	93 Å²	93	79 Å²	79	49%	0.487	42%	0.416	S	S	.	.	H	α-helix	trans	-65.6	-44.3	175.7	-73.8	171.8	0	0	0	112	I350 I351 Y352 S356 K357 C358	I350-L354 HydrophobicContact CG2-CD1 3.69Å; I350-L354 WeakPolarHBondContact O-CB 3.31Å; I350-L354 WeakPolarHBondContact O-CD1 3.23Å; I350-L354 WeakPolarHBondContact O-CG 3.5Å; I350-L354 PolarHBondContact O-N 3.08Å; I350-L354 VanDerWaalsContact O-N 3.09Å; I351-L354 PolarHBondContact O-N 2.75Å; Y352-L354 PolarHBondContact O-N 2.72Å; L354-S356 VanDerWaalsContact C-N 3.27Å; L354-S356 PolarHBondContact O-N 2.78Å; L354-K357 WeakPolarHBondContact O-CB 3.43Å; L354-K357 PolarHBondContact O-N 3Å; L354-K357 VanDerWaalsContact O-N 3.15Å; L354-C358 PolarHBondContact O-N 2.91Å; L354-C358 PolarHBondContact O-SG 3.42Å; L354-C358 VanDerWaalsContact O-SG 3.4Å
355	I	89.4	Confident	88.8	Confident	39 Å²	39	77.9 Å²	77.9	20%	0.2	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-39.7	175.4	-66.7	171.5	0	0	0	110.7	I351 Y352 C358 K359 L360 F362	I351-I355 HydrophobicContact CG2-CD1 3.66Å; I351-I355 HydrophobicContact CG2-CG1 4.32Å; I351-I355 VanDerWaalsContact O-CG1 3.31Å; I351-I355 WeakPolarHBondContact O-CG1 3.48Å; I351-I355 PolarHBondContact O-N 3.1Å; Y352-I355 PolarHBondContact O-N 2.6Å; I355-C358 CarbonylContact O-C 3.55Å; I355-C358 WeakPolarHBondContact O-CB 3.45Å; I355-C358 PolarHBondContact O-N 3.28Å; I355-C358 VanDerWaalsContact O-N 3.14Å; I355-K359 PolarHBondContact O-N 2.82Å; I355-L360 HydrophobicContact CG2-CB 3.89Å; I355-L360 PolarHBondContact O-N 2.81Å; I355-F362 HydrophobicContact CD1-CD1 3.85Å; I355-F362 HydrophobicContact CD1-CE1 3.92Å; I355-F362 HydrophobicContact CG2-CB 3.87Å; I355-F362 HydrophobicContact CG2-CD1 4.43Å; I355-F362 HydrophobicContact CG2-CG 4.3Å
356	S	87.3	Confident	88.9	Confident	86 Å²	86	81.6 Å²	81.6	60%	0.601	42%	0.416	S	S	*	.	H	α-helix	trans	-62.9	-40.5	175	-175.2	0	0	0	0	112	Y352 P353 L354 C358 K359	Y352-S356 WeakPolarHBondContact O-CB 3.44Å; Y352-S356 PolarHBondContact O-N 3.32Å; P353-S356 WeakPolarHBondContact O-CB 3.49Å; P353-S356 PolarHBondContact O-N 3.35Å; L354-S356 VanDerWaalsContact C-N 3.27Å; L354-S356 PolarHBondContact O-N 2.78Å; S356-C358 VanDerWaalsContact C-N 3.26Å; S356-C358 PolarHBondContact O-N 2.96Å; S356-K359 PolarHBondContact O-N 3.43Å
357	K	89.6	Confident	88.9	Confident	167 Å²	167	81.9 Å²	81.9	73%	0.726	41%	0.412	S	S	*	.	H	α-helix	trans	-61.6	-33.5	172.5	-74.3	178.4	-179.1	-179.7	0	112.5	P353 L354 K359	P353-K357 WeakPolarHBondContact O-CG 3.28Å; P353-K357 PolarHBondContact O-N 3.28Å; L354-K357 WeakPolarHBondContact O-CB 3.43Å; L354-K357 PolarHBondContact O-N 3Å; L354-K357 VanDerWaalsContact O-N 3.15Å; K357-K359 PolarHBondContact O-N 3.26Å
358	C	89.6	Confident	89.1	Confident	89 Å²	89	81.8 Å²	81.8	60%	0.601	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	3.2	173.4	-63.5	0	0	0	0	114.1	L354 I355 S356 L360	L354-C358 PolarHBondContact O-N 2.91Å; L354-C358 PolarHBondContact O-SG 3.42Å; L354-C358 VanDerWaalsContact O-SG 3.4Å; I355-C358 CarbonylContact O-C 3.55Å; I355-C358 WeakPolarHBondContact O-CB 3.45Å; I355-C358 PolarHBondContact O-N 3.28Å; I355-C358 VanDerWaalsContact O-N 3.14Å; S356-C358 VanDerWaalsContact C-N 3.26Å; S356-C358 PolarHBondContact O-N 2.96Å; C358-L360 HydrophobicContact CB-CD1 4.37Å; C358-L360 HydrophobicContact CB-CG 4.34Å; C358-L360 PolarHBondContact O-N 3.35Å; C358-L360 VanDerWaalsContact O-N 3.15Å
359	K	85.9	Confident	89.5	Confident	189 Å²	189	79.5 Å²	79.5	82%	0.822	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.5	-178.8	-57.7	-177.3	179.8	178.2	0	114.4	I355 S356 K357	I355-K359 PolarHBondContact O-N 2.82Å; S356-K359 PolarHBondContact O-N 3.43Å; K357-K359 PolarHBondContact O-N 3.26Å
360	L	83.3	Confident	89.7	Confident	116 Å²	116	74.6 Å²	74.6	61%	0.607	38%	0.383	S	S	*	.			trans	-85.7	119.7	175.2	-68.7	174	0	0	0	109.7	I355 C358 F362	I355-L360 HydrophobicContact CG2-CB 3.89Å; I355-L360 PolarHBondContact O-N 2.81Å; C358-L360 HydrophobicContact CB-CD1 4.37Å; C358-L360 HydrophobicContact CB-CG 4.34Å; C358-L360 PolarHBondContact O-N 3.35Å; C358-L360 VanDerWaalsContact O-N 3.15Å; L360-F362 PolarHBondContact O-N 3.07Å
361	N	79.9	Confident	89.9	Confident	130 Å²	130	70.1 Å²	70.1	70%	0.695	36%	0.36	S	S	*	.			trans	-72.6	95.6	174.2	-76.5	-17.2	0	0	0	110.3	T363 R366	N361-T363 PolarHBondContact O-N 2.87Å; N361-R366 PolarHBondContact O-NH1 3.32Å
362	F	85.4	Confident	90.2	Very high	44 Å²	44	66.9 Å²	66.9	19%	0.193	34%	0.343	C	S	.	.			trans	-96.8	77.6	-179.1	-157.7	-142.6	0	0	0	110.8	Y352 I355 L360 R366 R367 V370	Y352-F362 HydrophobicContact CD1-CD1 4.21Å; Y352-F362 HydrophobicContact CD1-CE1 4.4Å; Y352-F362 HydrophobicContact CE1-CD1 4.09Å; Y352-F362 AromaticContact CE1-CE1 3.96Å; Y352-F362 HydrophobicContact CE1-CE1 3.96Å; I355-F362 HydrophobicContact CD1-CD1 3.85Å; I355-F362 HydrophobicContact CD1-CE1 3.92Å; I355-F362 HydrophobicContact CG2-CB 3.87Å; I355-F362 HydrophobicContact CG2-CD1 4.43Å; I355-F362 HydrophobicContact CG2-CG 4.3Å; L360-F362 PolarHBondContact O-N 3.07Å; F362-R366 HydrophobicContact CD2-CB 4.03Å; F362-R366 HydrophobicContact CE2-CB 4.19Å; F362-R367 HydrophobicContact CD1-CG 3.4Å; F362-R367 VanDerWaalsContact CD1-CG 3.4Å; F362-R367 HydrophobicContact CD2-CG 4.18Å; F362-R367 HydrophobicContact CE1-CB 4.18Å; F362-R367 HydrophobicContact CE1-CG 3.34Å; F362-R367 HydrophobicContact CE2-CG 4.07Å; F362-R367 HydrophobicContact CG-CG 3.85Å; F362-R367 HydrophobicContact CZ-CB 4.11Å; F362-R367 HydrophobicContact CZ-CG 3.67Å; F362-R367 PolarHBondContact O-NE 3.25Å; F362-R367 PolarHBondContact O-NH2 3.21Å; F362-V370 HydrophobicContact CE2-CG2 3.79Å; F362-V370 HydrophobicContact CZ-CB 4.2Å; F362-V370 HydrophobicContact CZ-CG2 3.87Å
363	T	88.9	Confident	90.6	Very high	46 Å²	46	70.3 Å²	70.3	28%	0.282	36%	0.359	S	S	.	.			trans	-64.6	156.6	179.8	62.3	0	0	0	0	111.6	N361 L365 R366 R367	N361-T363 PolarHBondContact O-N 2.87Å; T363-L365 VanDerWaalsContact C-N 3.29Å; T363-L365 PolarHBondContact O-N 3.15Å; T363-R366 WeakPolarHBondContact O-CB 3.35Å; T363-R366 PolarHBondContact O-N 3.47Å; T363-R366 WeakPolarHBondContact OG1-CD 3.34Å; T363-R366 WeakPolarHBondContact OG1-CG 3.22Å; T363-R367 PolarHBondContact O-N 2.91Å
364	P	89.1	Confident	91	Very high	38 Å²	38	69.5 Å²	69.5	25%	0.247	35%	0.351	C	S	.	.	H	α-helix	trans	-51.7	-44	179.9	-30.6	36.8	0	0	0	113.9	R366 R367 M368 T604 F608 Y675	P364-R366 PolarHBondContact O-N 3.2Å; P364-R367 WeakPolarHBondContact O-CB 3.31Å; P364-R367 PolarHBondContact O-N 2.97Å; P364-M368 WeakPolarHBondContact O-CG 3.27Å; P364-M368 PolarHBondContact O-N 3.34Å; P364-M368 VanDerWaalsContact O-N 3.08Å; P364-T604 HydrophobicContact CB-CG2 3.64Å; P364-T604 WeakPolarHBondContact O-CG2 3.24Å; P364-F608 HydrophobicContact CB-CB 4.1Å; P364-F608 HydrophobicContact CB-CD2 4.2Å; P364-Y675 HydrophobicContact CG-CE1 4.5Å
365	L	92.5	Very high	91.4	Very high	2 Å²	2	65 Å²	65	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-34.7	179.2	-61	175.9	0	0	0	112.9	L293 T363 M368 T369 F608 F666 A670 Y673 Y675	L293-L365 HydrophobicContact CD1-CD1 4.09Å; L293-L365 HydrophobicContact CD1-CD2 3.94Å; T363-L365 VanDerWaalsContact C-N 3.29Å; T363-L365 PolarHBondContact O-N 3.15Å; L365-M368 HydrophobicContact CD2-SD 4.21Å; L365-M368 PolarHBondContact O-N 3.42Å; L365-T369 PolarHBondContact O-N 3.11Å; L365-T369 PolarHBondContact O-OG1 2.8Å; L365-T369 VanDerWaalsContact O-OG1 3.06Å; L365-F608 HydrophobicContact CD1-CE2 4.35Å; L365-F608 HydrophobicContact CD1-CZ 4.41Å; L365-F608 HydrophobicContact CD2-CD1 4.26Å; L365-F608 HydrophobicContact CD2-CD2 4.28Å; L365-F608 HydrophobicContact CD2-CE1 3.95Å; L365-F608 HydrophobicContact CD2-CE2 3.95Å; L365-F608 HydrophobicContact CD2-CG 4.41Å; L365-F608 HydrophobicContact CD2-CZ 3.78Å; L365-F608 HydrophobicContact CG-CE2 4.12Å; L365-F608 HydrophobicContact CG-CZ 4.35Å; L365-F666 HydrophobicContact CD2-CZ 4.02Å; L365-A670 HydrophobicContact CB-CB 3.72Å; L365-A670 HydrophobicContact CD1-CB 4.04Å; L365-A670 HydrophobicContact CG-CB 4.43Å; L365-Y673 HydrophobicContact CD1-CD1 3.65Å; L365-Y673 HydrophobicContact CD1-CE1 4.5Å; L365-Y673 HydrophobicContact CD1-CG 3.88Å; L365-Y675 WeakPolarHBondContact CG-OH 3.41Å
366	R	92.4	Very high	91.8	Very high	135 Å²	135	63.3 Å²	63.3	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-66.7	-37.2	174.4	-72.6	175.1	178.7	-173.6	-5.6	111.8	N361 F362 T363 P364 M368 T369 V370	N361-R366 PolarHBondContact O-NH1 3.32Å; F362-R366 HydrophobicContact CD2-CB 4.03Å; F362-R366 HydrophobicContact CE2-CB 4.19Å; T363-R366 WeakPolarHBondContact O-CB 3.35Å; T363-R366 PolarHBondContact O-N 3.47Å; T363-R366 WeakPolarHBondContact OG1-CD 3.34Å; T363-R366 WeakPolarHBondContact OG1-CG 3.22Å; P364-R366 PolarHBondContact O-N 3.2Å; R366-M368 VanDerWaalsContact C-N 3.35Å; R366-T369 WeakPolarHBondContact O-CB 3.31Å; R366-T369 PolarHBondContact O-N 3.04Å; R366-V370 WeakPolarHBondContact O-CG2 3.35Å; R366-V370 PolarHBondContact O-N 3.27Å
367	R	92.6	Very high	92.3	Very high	52 Å²	52	62.3 Å²	62.3	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-45.4	173.8	-65.5	168.6	-169.7	-164.3	3.6	111	Y352 F362 T363 P364 T369 V370 G371 T604	Y352-R367 HydrophobicContact CE1-CG 4.47Å; F362-R367 HydrophobicContact CD1-CG 3.4Å; F362-R367 VanDerWaalsContact CD1-CG 3.4Å; F362-R367 HydrophobicContact CD2-CG 4.18Å; F362-R367 HydrophobicContact CE1-CB 4.18Å; F362-R367 HydrophobicContact CE1-CG 3.34Å; F362-R367 HydrophobicContact CE2-CG 4.07Å; F362-R367 HydrophobicContact CG-CG 3.85Å; F362-R367 HydrophobicContact CZ-CB 4.11Å; F362-R367 HydrophobicContact CZ-CG 3.67Å; F362-R367 PolarHBondContact O-NE 3.25Å; F362-R367 PolarHBondContact O-NH2 3.21Å; T363-R367 PolarHBondContact O-N 2.91Å; P364-R367 WeakPolarHBondContact O-CB 3.31Å; P364-R367 PolarHBondContact O-N 2.97Å; R367-T369 VanDerWaalsContact C-N 3.34Å; R367-T369 PolarHBondContact O-N 3Å; R367-V370 PolarHBondContact O-N 3.05Å; R367-G371 PolarHBondContact O-N 2.86Å; R367-T604 HydrophobicContact CB-CG2 4.01Å
368	M	94.8	Very high	92.7	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-41.3	176	-67.4	176.9	72.7	0	0	112.1	L297 P364 L365 R366 V370 G371 M372 F601 T604 W625 F666	L297-M368 HydrophobicContact CD2-CE 4.09Å; L297-M368 HydrophobicContact CG-CE 4.26Å; P364-M368 WeakPolarHBondContact O-CG 3.27Å; P364-M368 PolarHBondContact O-N 3.34Å; P364-M368 VanDerWaalsContact O-N 3.08Å; L365-M368 HydrophobicContact CD2-SD 4.21Å; L365-M368 PolarHBondContact O-N 3.42Å; R366-M368 VanDerWaalsContact C-N 3.35Å; M368-V370 PolarHBondContact O-N 3.23Å; M368-G371 PolarHBondContact O-N 2.89Å; M368-G371 VanDerWaalsContact O-N 3.16Å; M368-M372 PolarHBondContact O-N 3.36Å; M368-F601 HydrophobicContact CB-CD2 3.89Å; M368-F601 HydrophobicContact CB-CE2 4.36Å; M368-F601 HydrophobicContact CE-CD2 4.09Å; M368-F601 HydrophobicContact CE-CE2 3.71Å; M368-F601 HydrophobicContact CE-CZ 4.21Å; M368-F601 HydrophobicContact CG-CD2 4.24Å; M368-T604 HydrophobicContact CG-CG2 4.48Å; M368-W625 HydrophobicContact CE-CH2 4.27Å; M368-W625 HydrophobicContact CE-CZ3 4.17Å; M368-F666 HydrophobicContact CB-CE1 3.73Å; M368-F666 HydrophobicContact CB-CZ 4Å; M368-F666 HydrophobicContact CE-CZ 4.04Å; M368-F666 HydrophobicContact SD-CZ 4.16Å
369	T	95.5	Very high	93.1	Very high	27 Å²	27	50.1 Å²	50.1	17%	0.166	24%	0.244	C	C	.	.	H	α-helix	trans	-59.3	-44.9	173.9	-53.1	0	0	0	0	111.9	L365 R366 R367 G371 M372 F373 C663 A667	L365-T369 PolarHBondContact O-N 3.11Å; L365-T369 PolarHBondContact O-OG1 2.8Å; L365-T369 VanDerWaalsContact O-OG1 3.06Å; R366-T369 WeakPolarHBondContact O-CB 3.31Å; R366-T369 PolarHBondContact O-N 3.04Å; R367-T369 VanDerWaalsContact C-N 3.34Å; R367-T369 PolarHBondContact O-N 3Å; T369-G371 VanDerWaalsContact C-N 3.28Å; T369-G371 PolarHBondContact O-N 3.37Å; T369-M372 PolarHBondContact O-N 3.45Å; T369-F373 PolarHBondContact O-N 3.24Å; T369-C663 VanDerWaalsContact CG2-SG 3.58Å; T369-C663 PolarHBondContact O-SG 3.43Å; T369-C663 VanDerWaalsContact O-SG 3.41Å; T369-A667 HydrophobicContact CG2-CB 3.85Å
370	V	95.5	Very high	93.7	Very high	58 Å²	58	44.3 Å²	44.3	35%	0.352	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-39.8	175.5	172.7	0	0	0	0	110.9	F362 R366 R367 M368 F373 L374	F362-V370 HydrophobicContact CE2-CG2 3.79Å; F362-V370 HydrophobicContact CZ-CB 4.2Å; F362-V370 HydrophobicContact CZ-CG2 3.87Å; R366-V370 WeakPolarHBondContact O-CG2 3.35Å; R366-V370 PolarHBondContact O-N 3.27Å; R367-V370 PolarHBondContact O-N 3.05Å; M368-V370 PolarHBondContact O-N 3.23Å; V370-F373 WeakPolarHBondContact O-CB 3.5Å; V370-F373 PolarHBondContact O-N 3.47Å; V370-L374 HydrophobicContact CG1-CD1 4.15Å; V370-L374 HydrophobicContact CG1-CG 4.33Å; V370-L374 WeakPolarHBondContact O-CG 3.19Å; V370-L374 PolarHBondContact O-N 3.15Å
371	G	96.6	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-42.9	177	0	0	0	0	0	113.7	R367 M368 T369 F373 L374 A375	R367-G371 PolarHBondContact O-N 2.86Å; M368-G371 PolarHBondContact O-N 2.89Å; M368-G371 VanDerWaalsContact O-N 3.16Å; T369-G371 VanDerWaalsContact C-N 3.28Å; T369-G371 PolarHBondContact O-N 3.37Å; G371-F373 VanDerWaalsContact C-N 3.3Å; G371-F373 PolarHBondContact O-N 3.48Å; G371-L374 PolarHBondContact O-N 3Å; G371-A375 PolarHBondContact O-N 3.11Å
372	M	97.3	Very high	95.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-40.2	172.7	-68.1	-175.4	177.7	0	0	111.9	L297 F300 M368 T369 A375 A376 F601 L659 C663 F666	L297-M372 HydrophobicContact CD1-CE 4.15Å; L297-M372 HydrophobicContact CG-CE 4.48Å; F300-M372 HydrophobicContact CD2-CG 4.4Å; M368-M372 PolarHBondContact O-N 3.36Å; T369-M372 PolarHBondContact O-N 3.45Å; M372-A375 PolarHBondContact O-N 2.9Å; M372-A376 PolarHBondContact O-N 2.93Å; M372-A376 VanDerWaalsContact O-N 3.08Å; M372-F601 HydrophobicContact CE-CD2 4.45Å; M372-F601 HydrophobicContact CE-CE2 3.52Å; M372-F601 HydrophobicContact CE-CZ 4.19Å; M372-F601 HydrophobicContact CG-CD2 4.03Å; M372-F601 HydrophobicContact CG-CE2 3.93Å; M372-L659 HydrophobicContact CB-CD1 4.22Å; M372-L659 HydrophobicContact CG-CD1 4.38Å; M372-L659 VanDerWaalsContact O-CD2 3.23Å; M372-L659 WeakPolarHBondContact O-CD2 3.36Å; M372-C663 HydrophobicContact CB-CB 4.01Å; M372-C663 HydrophobicContact SD-CB 4.45Å; M372-F666 HydrophobicContact CE-CB 4.06Å; M372-F666 HydrophobicContact CE-CD1 3.98Å; M372-F666 HydrophobicContact CE-CD2 3.98Å; M372-F666 HydrophobicContact CE-CE1 4.46Å; M372-F666 HydrophobicContact CE-CE2 4.45Å; M372-F666 HydrophobicContact CE-CG 3.72Å; M372-F666 HydrophobicContact SD-CB 3.92Å; M372-F666 HydrophobicContact SD-CD1 4.02Å; M372-F666 HydrophobicContact SD-CG 4.01Å
373	F	97.5	Very high	95.7	Very high	106 Å²	106	31.7 Å²	31.7	47%	0.465	16%	0.163	S	C	.	.	H	α-helix	trans	-65.9	-42.3	177.1	-177.7	-103.8	0	0	0	112.6	T369 V370 G371 A375 A376 L377	T369-F373 PolarHBondContact O-N 3.24Å; V370-F373 WeakPolarHBondContact O-CB 3.5Å; V370-F373 PolarHBondContact O-N 3.47Å; G371-F373 VanDerWaalsContact C-N 3.3Å; G371-F373 PolarHBondContact O-N 3.48Å; F373-A375 PolarHBondContact O-N 3.18Å; F373-A376 WeakPolarHBondContact O-CB 3.16Å; F373-A376 PolarHBondContact O-N 3.39Å; F373-L377 HydrophobicContact CD1-CD1 4.04Å; F373-L377 HydrophobicContact CD1-CG 4.49Å; F373-L377 HydrophobicContact CE1-CD1 3.54Å; F373-L377 HydrophobicContact CE1-CG 4.11Å; F373-L377 HydrophobicContact CZ-CD1 4.07Å; F373-L377 HydrophobicContact CZ-CD2 4.35Å; F373-L377 HydrophobicContact CZ-CG 4.26Å; F373-L377 PolarHBondContact O-N 3.48Å
374	L	97.9	Very high	96.1	Very high	38 Å²	38	34.5 Å²	34.5	20%	0.199	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-40.5	175.8	-70.3	175	0	0	0	112.3	V370 G371 A376 L377 A378 L593 V600	V370-L374 HydrophobicContact CG1-CD1 4.15Å; V370-L374 HydrophobicContact CG1-CG 4.33Å; V370-L374 WeakPolarHBondContact O-CG 3.19Å; V370-L374 PolarHBondContact O-N 3.15Å; G371-L374 PolarHBondContact O-N 3Å; L374-A376 VanDerWaalsContact C-N 3.31Å; L374-A376 PolarHBondContact O-N 2.97Å; L374-L377 PolarHBondContact O-N 3.1Å; L374-A378 PolarHBondContact O-N 3.02Å; L374-L593 HydrophobicContact CD2-CD2 4.25Å; L374-V600 HydrophobicContact CD1-CG2 4.47Å
375	A	97.8	Very high	96.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-35.3	174.5	0	0	0	0	0	112.4	F300 G371 M372 F373 A378 F379 M594 L659	F300-A375 HydrophobicContact CD2-CB 3.9Å; F300-A375 HydrophobicContact CE2-CB 3.64Å; G371-A375 PolarHBondContact O-N 3.11Å; M372-A375 PolarHBondContact O-N 2.9Å; F373-A375 PolarHBondContact O-N 3.18Å; A375-A378 WeakPolarHBondContact O-CB 3.3Å; A375-A378 PolarHBondContact O-N 3.23Å; A375-F379 PolarHBondContact O-N 3.41Å; A375-M594 HydrophobicContact CB-CE 3.93Å; A375-M594 HydrophobicContact CB-SD 3.75Å; A375-L659 HydrophobicContact CB-CD2 3.61Å
376	A	98	Very high	96.6	Very high	3 Å²	3	33.4 Å²	33.4	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-41.5	173.8	0	0	0	0	0	111.6	M372 F373 L374 A378 F379 V380 L659 V660	M372-A376 PolarHBondContact O-N 2.93Å; M372-A376 VanDerWaalsContact O-N 3.08Å; F373-A376 WeakPolarHBondContact O-CB 3.16Å; F373-A376 PolarHBondContact O-N 3.39Å; L374-A376 VanDerWaalsContact C-N 3.31Å; L374-A376 PolarHBondContact O-N 2.97Å; A376-A378 VanDerWaalsContact C-N 3.29Å; A376-A378 PolarHBondContact O-N 3.33Å; A376-F379 PolarHBondContact O-N 3.38Å; A376-V380 PolarHBondContact O-N 2.86Å; A376-V380 VanDerWaalsContact O-N 3.1Å; A376-L659 HydrophobicContact CB-CB 4.26Å; A376-L659 HydrophobicContact CB-CD2 4.16Å; A376-L659 HydrophobicContact CB-CG 4.26Å; A376-V660 HydrophobicContact CB-CG2 3.79Å
377	L	98.2	Very high	96.7	Very high	65 Å²	65	30.4 Å²	30.4	34%	0.34	16%	0.162	S	C	.	.	H	α-helix	trans	-63.7	-34	174	-69.3	178	0	0	0	112.7	F373 L374 F379 V380 A381 L593	F373-L377 HydrophobicContact CD1-CD1 4.04Å; F373-L377 HydrophobicContact CD1-CG 4.49Å; F373-L377 HydrophobicContact CE1-CD1 3.54Å; F373-L377 HydrophobicContact CE1-CG 4.11Å; F373-L377 HydrophobicContact CZ-CD1 4.07Å; F373-L377 HydrophobicContact CZ-CD2 4.35Å; F373-L377 HydrophobicContact CZ-CG 4.26Å; F373-L377 PolarHBondContact O-N 3.48Å; L374-L377 PolarHBondContact O-N 3.1Å; L377-F379 VanDerWaalsContact C-N 3.27Å; L377-F379 PolarHBondContact O-N 2.58Å; L377-V380 PolarHBondContact O-N 3.43Å; L377-A381 PolarHBondContact O-N 2.98Å; L377-L593 HydrophobicContact CB-CD1 4.14Å
378	A	98.3	Very high	96.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-39.7	174.1	0	0	0	0	0	111.8	W311 L374 A375 A376 A381 A382 Q590 L593 M594	W311-A378 HydrophobicContact CH2-CB 4.44Å; L374-A378 PolarHBondContact O-N 3.02Å; A375-A378 WeakPolarHBondContact O-CB 3.3Å; A375-A378 PolarHBondContact O-N 3.23Å; A376-A378 VanDerWaalsContact C-N 3.29Å; A376-A378 PolarHBondContact O-N 3.33Å; A378-A381 WeakPolarHBondContact O-CB 3.33Å; A378-A381 PolarHBondContact O-N 3.17Å; A378-A382 PolarHBondContact O-N 3.32Å; A378-Q590 WeakPolarHBondContact CB-O 3.25Å; A378-Q590 WeakPolarHBondContact O-CB 3.41Å; A378-L593 HydrophobicContact CB-CB 3.7Å; A378-M594 HydrophobicContact CB-CB 3.97Å; A378-M594 HydrophobicContact CB-CE 4.1Å
379	F	97.8	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-74.5	-30.8	177	-91.7	-114	0	0	0	113.2	L303 Q306 W311 A375 A376 L377 A381 A382 A383 M594 Y652 F655 A656	L303-F379 HydrophobicContact CB-CD2 3.96Å; L303-F379 HydrophobicContact CB-CE1 4.48Å; L303-F379 HydrophobicContact CB-CE2 3.43Å; L303-F379 VanDerWaalsContact CB-CE2 3.43Å; L303-F379 HydrophobicContact CB-CZ 3.73Å; L303-F379 HydrophobicContact CD2-CB 4.03Å; L303-F379 HydrophobicContact CD2-CD1 3.94Å; L303-F379 HydrophobicContact CD2-CD2 3.37Å; L303-F379 HydrophobicContact CD2-CE1 4.26Å; L303-F379 HydrophobicContact CD2-CE2 3.77Å; L303-F379 HydrophobicContact CD2-CG 3.47Å; L303-F379 VanDerWaalsContact CD2-CG 3.47Å; L303-F379 HydrophobicContact CD2-CZ 4.19Å; L303-F379 HydrophobicContact CG-CD1 4.05Å; L303-F379 HydrophobicContact CG-CD2 3.73Å; L303-F379 HydrophobicContact CG-CE1 3.86Å; L303-F379 HydrophobicContact CG-CE2 3.55Å; L303-F379 HydrophobicContact CG-CG 3.98Å; L303-F379 HydrophobicContact CG-CZ 3.61Å; L303-F379 VanDerWaalsContact O-CE2 3.32Å; L303-F379 WeakPolarHBondContact O-CE2 3.33Å; L303-F379 WeakPolarHBondContact O-CZ 3.36Å; Q306-F379 HydrophobicContact CB-CZ 4.01Å; Q306-F379 HydrophobicContact CG-CZ 4.24Å; Q306-F379 VanDerWaalsContact OE1-CE1 3.29Å; W311-F379 HydrophobicContact CZ2-CD2 4.13Å; W311-F379 AromaticContact CZ2-CE2 3.86Å; W311-F379 HydrophobicContact CZ2-CE2 3.86Å; A375-F379 PolarHBondContact O-N 3.41Å; A376-F379 PolarHBondContact O-N 3.38Å; L377-F379 VanDerWaalsContact C-N 3.27Å; L377-F379 PolarHBondContact O-N 2.58Å; F379-A381 VanDerWaalsContact C-N 3.34Å; F379-A382 PolarHBondContact O-N 3.31Å; F379-A383 WeakPolarHBondContact O-CB 3.38Å; F379-A383 PolarHBondContact O-N 2.91Å; F379-M594 HydrophobicContact CD2-CE 3.79Å; F379-M594 HydrophobicContact CE2-CE 3.56Å; F379-Y652 AromaticContact CD1-CD1 3.83Å; F379-Y652 HydrophobicContact CD1-CD1 3.83Å; F379-Y652 HydrophobicContact CD1-CG 4.48Å; F379-Y652 AromaticContact CE1-CD1 3.77Å; F379-Y652 HydrophobicContact CE1-CD1 3.77Å; F379-Y652 HydrophobicContact CE1-CE1 4.38Å; F379-F655 HydrophobicContact CD1-CB 3.61Å; F379-F655 HydrophobicContact CD1-CG 4.49Å; F379-F655 HydrophobicContact CE1-CB 3.75Å; F379-F655 HydrophobicContact CE1-CD2 4.29Å; F379-F655 HydrophobicContact CE1-CG 4.16Å; F379-A656 HydrophobicContact CB-CB 3.89Å
380	V	97.8	Very high	96.4	Very high	66 Å²	66	34.5 Å²	34.5	40%	0.4	18%	0.183	S	C	.	.	H	α-helix	trans	-62.1	-44.5	167.7	176.2	0	0	0	0	110.3	A376 L377 A382 A383 L384 A656	A376-V380 PolarHBondContact O-N 2.86Å; A376-V380 VanDerWaalsContact O-N 3.1Å; L377-V380 PolarHBondContact O-N 3.43Å; V380-A382 VanDerWaalsContact C-N 3.35Å; V380-A382 PolarHBondContact O-N 3.45Å; V380-A383 PolarHBondContact O-N 3.15Å; V380-L384 HydrophobicContact CG1-CD1 4.4Å; V380-L384 WeakPolarHBondContact O-CG 3.41Å; V380-L384 PolarHBondContact O-N 3.35Å; V380-A656 HydrophobicContact CG2-CB 4.03Å
381	A	97.8	Very high	96.1	Very high	21 Å²	21	35.6 Å²	35.6	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-42.5	175.1	0	0	0	0	0	111.8	L377 A378 F379 A383 L384 V385 Q590 L593	L377-A381 PolarHBondContact O-N 2.98Å; A378-A381 WeakPolarHBondContact O-CB 3.33Å; A378-A381 PolarHBondContact O-N 3.17Å; F379-A381 VanDerWaalsContact C-N 3.34Å; A381-A383 PolarHBondContact O-N 3.2Å; A381-L384 PolarHBondContact O-N 2.81Å; A381-V385 WeakPolarHBondContact O-CG2 3.36Å; A381-V385 PolarHBondContact O-N 3.48Å; A381-Q590 HydrophobicContact CB-CB 4.13Å; A381-L593 HydrophobicContact CB-CD1 4.39Å
382	A	97.2	Very high	95.5	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-39.6	175.8	0	0	0	0	0	113.5	W311 Q314 A378 F379 V380 V385 Q386 Q590 Y652	W311-A382 HydrophobicContact CZ2-CB 4.46Å; Q314-A382 PolarHBondContact NE2-O 3.3Å; A378-A382 PolarHBondContact O-N 3.32Å; F379-A382 PolarHBondContact O-N 3.31Å; V380-A382 VanDerWaalsContact C-N 3.35Å; V380-A382 PolarHBondContact O-N 3.45Å; A382-V385 PolarHBondContact O-N 3.11Å; A382-Q386 WeakPolarHBondContact O-CB 3.5Å; A382-Q386 PolarHBondContact O-N 3.34Å; A382-Q590 HydrophobicContact CB-CB 4.45Å; A382-Y652 HydrophobicContact CB-CD1 4.44Å; A382-Y652 HydrophobicContact CB-CD2 4.2Å; A382-Y652 HydrophobicContact CB-CE2 4.42Å; A382-Y652 HydrophobicContact CB-CG 4.23Å
383	A	96.8	Very high	94.9	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-42.3	173.6	0	0	0	0	0	112	F379 V380 A381 V385 Q386 L387 V653	F379-A383 WeakPolarHBondContact O-CB 3.38Å; F379-A383 PolarHBondContact O-N 2.91Å; V380-A383 PolarHBondContact O-N 3.15Å; A381-A383 PolarHBondContact O-N 3.2Å; A383-V385 PolarHBondContact O-N 3.05Å; A383-Q386 PolarHBondContact O-N 3.18Å; A383-L387 WeakPolarHBondContact O-CG 3.44Å; A383-L387 PolarHBondContact O-N 3.2Å; A383-V653 HydrophobicContact CB-CG2 3.73Å
384	L	96.8	Very high	94.3	Very high	105 Å²	105	36.2 Å²	36.2	55%	0.55	21%	0.21	S	C	.	.	H	α-helix	trans	-64.2	-39.8	177.5	-68.7	174	0	0	0	112.1	V380 A381 Q388	V380-L384 HydrophobicContact CG1-CD1 4.4Å; V380-L384 WeakPolarHBondContact O-CG 3.41Å; V380-L384 PolarHBondContact O-N 3.35Å; A381-L384 PolarHBondContact O-N 2.81Å; L384-Q388 WeakPolarHBondContact O-CG 3.49Å; L384-Q388 PolarHBondContact O-N 3.07Å
385	V	96.3	Very high	93.7	Very high	14 Å²	14	41.2 Å²	41.2	9%	0.085	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-44.9	173.8	173.6	0	0	0	0	110.3	M318 A381 A382 A383 L387 Q388 I389 W586	M318-V385 HydrophobicContact CE-CG1 3.8Å; A381-V385 WeakPolarHBondContact O-CG2 3.36Å; A381-V385 PolarHBondContact O-N 3.48Å; A382-V385 PolarHBondContact O-N 3.11Å; A383-V385 PolarHBondContact O-N 3.05Å; V385-L387 PolarHBondContact O-N 3.09Å; V385-Q388 PolarHBondContact O-N 3.44Å; V385-Q388 VanDerWaalsContact O-N 3.14Å; V385-I389 HydrophobicContact CG1-CD1 3.93Å; V385-I389 HydrophobicContact CG1-CG1 4.5Å; V385-I389 WeakPolarHBondContact O-CG1 3.48Å; V385-I389 PolarHBondContact O-N 2.92Å; V385-W586 HydrophobicContact CG2-CB 4.26Å; V385-W586 WeakPolarHBondContact CG2-O 3.28Å
386	Q	95.8	Very high	93.3	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-43.5	178.7	-167.7	62.1	43.3	0	0	112.1	Q314 A382 A383 Q388 I389 D390 Q648 W649 Y652	Q314-Q386 VanDerWaalsContact CG-OE1 3.31Å; A382-Q386 WeakPolarHBondContact O-CB 3.5Å; A382-Q386 PolarHBondContact O-N 3.34Å; A383-Q386 PolarHBondContact O-N 3.18Å; Q386-Q388 PolarHBondContact O-N 2.94Å; Q386-I389 WeakPolarHBondContact O-CB 3.34Å; Q386-I389 PolarHBondContact O-N 3.23Å; Q386-D390 PolarHBondContact NE2-OD1 2.96Å; Q386-D390 VanDerWaalsContact O-CG 3.23Å; Q386-D390 PolarHBondContact O-N 3.48Å; Q386-Q648 HydrophobicContact CG-CB 4.04Å; Q386-W649 HydrophobicContact CB-CB 3.85Å; Q386-W649 HydrophobicContact CG-CB 3.83Å; Q386-Y652 HydrophobicContact CB-CD2 4.15Å; Q386-Y652 HydrophobicContact CB-CE2 4.11Å; Q386-Y652 HydrophobicContact CG-CE2 4.3Å
387	L	94.3	Very high	92.8	Very high	72 Å²	72	45.2 Å²	45.2	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-57.8	-35.6	176.5	-75.7	169.7	0	0	0	112.9	A383 V385 A391 W649	A383-L387 WeakPolarHBondContact O-CG 3.44Å; A383-L387 PolarHBondContact O-N 3.2Å; V385-L387 PolarHBondContact O-N 3.09Å; L387-A391 WeakPolarHBondContact O-CB 3.45Å; L387-A391 PolarHBondContact O-N 2.86Å; L387-A391 VanDerWaalsContact O-N 3.13Å; L387-W649 HydrophobicContact CD2-CB 4.14Å; L387-W649 HydrophobicContact CD2-CD2 3.66Å; L387-W649 HydrophobicContact CD2-CE3 4.21Å; L387-W649 HydrophobicContact CD2-CG 3.59Å; L387-W649 HydrophobicContact CG-CB 4.06Å; L387-W649 HydrophobicContact CG-CD2 4.31Å; L387-W649 HydrophobicContact CG-CG 4.06Å
388	Q	94	Very high	92.3	Very high	119 Å²	119	44.4 Å²	44.4	56%	0.556	26%	0.256	S	S	*	.	H	α-helix	trans	-74.8	-33.6	176.5	-63.3	-60.1	-29.4	0	0	112.4	L384 V385 Q386 I582	L384-Q388 WeakPolarHBondContact O-CG 3.49Å; L384-Q388 PolarHBondContact O-N 3.07Å; V385-Q388 PolarHBondContact O-N 3.44Å; V385-Q388 VanDerWaalsContact O-N 3.14Å; Q386-Q388 PolarHBondContact O-N 2.94Å; Q388-I582 HydrophobicContact CB-CD1 3.98Å; Q388-I582 HydrophobicContact CB-CG1 4.3Å
389	I	92.3	Very high	91.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.6	-51.3	173.3	-66.9	168	0	0	0	109.3	Q314 T317 M318 V385 Q386 A391 S392 L393 I582	Q314-I389 HydrophobicContact CG-CD1 3.68Å; T317-I389 WeakPolarHBondContact OG1-CG2 3.07Å; M318-I389 HydrophobicContact CE-CD1 4.25Å; M318-I389 HydrophobicContact CG-CD1 3.68Å; M318-I389 HydrophobicContact CG-CG1 4.32Å; M318-I389 HydrophobicContact SD-CD1 3.97Å; V385-I389 HydrophobicContact CG1-CD1 3.93Å; V385-I389 HydrophobicContact CG1-CG1 4.5Å; V385-I389 WeakPolarHBondContact O-CG1 3.48Å; V385-I389 PolarHBondContact O-N 2.92Å; Q386-I389 WeakPolarHBondContact O-CB 3.34Å; Q386-I389 PolarHBondContact O-N 3.23Å; I389-A391 VanDerWaalsContact C-N 3.29Å; I389-A391 PolarHBondContact O-N 3.32Å; I389-S392 WeakPolarHBondContact O-CA 3.1Å; I389-S392 WeakPolarHBondContact O-CB 3.34Å; I389-S392 PolarHBondContact O-N 3.48Å; I389-S392 PolarHBondContact O-OG 3.35Å; I389-L393 HydrophobicContact CG2-CD1 4.27Å; I389-L393 HydrophobicContact CG2-CG 4.42Å; I389-L393 PolarHBondContact O-N 3.14Å; I389-I582 HydrophobicContact CG1-CB 4.11Å; I389-I582 HydrophobicContact CG1-CG1 4.1Å; I389-I582 HydrophobicContact CG1-CG2 4.27Å
390	D	90.4	Very high	91.4	Very high	49 Å²	49	53.6 Å²	53.6	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-60	-40.1	-177.6	-63.7	-13.6	0	0	0	111.1	Q386 S392 L393	Q386-D390 PolarHBondContact NE2-OD1 2.96Å; Q386-D390 VanDerWaalsContact O-CG 3.23Å; Q386-D390 PolarHBondContact O-N 3.48Å; D390-S392 PolarHBondContact O-N 3.29Å; D390-S392 VanDerWaalsContact O-N 3.13Å; D390-L393 PolarHBondContact O-N 3.4Å; D390-L393 VanDerWaalsContact O-N 3.15Å
391	A	88.6	Confident	91.1	Very high	82 Å²	82	53.1 Å²	53.1	68%	0.678	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-17.1	174.2	0	0	0	0	0	114.4	L387 I389	L387-A391 WeakPolarHBondContact O-CB 3.45Å; L387-A391 PolarHBondContact O-N 2.86Å; L387-A391 VanDerWaalsContact O-N 3.13Å; I389-A391 VanDerWaalsContact C-N 3.29Å; I389-A391 PolarHBondContact O-N 3.32Å
392	S	84.9	Confident	90.9	Very high	30 Å²	30	52.2 Å²	52.2	21%	0.21	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-12.7	177.9	77.3	0	0	0	0	113.8	I389 D390	I389-S392 WeakPolarHBondContact O-CA 3.1Å; I389-S392 WeakPolarHBondContact O-CB 3.34Å; I389-S392 PolarHBondContact O-N 3.48Å; I389-S392 PolarHBondContact O-OG 3.35Å; D390-S392 PolarHBondContact O-N 3.29Å; D390-S392 VanDerWaalsContact O-N 3.13Å
393	L	84.9	Confident	90.7	Very high	55 Å²	55	52.7 Å²	52.7	29%	0.288	30%	0.304	S	S	.	.	S	Bend	trans	-78.5	146.4	179.8	-70.5	175.3	0	0	0	110.9	I389 D390 K483	I389-L393 HydrophobicContact CG2-CD1 4.27Å; I389-L393 HydrophobicContact CG2-CG 4.42Å; I389-L393 PolarHBondContact O-N 3.14Å; D390-L393 PolarHBondContact O-N 3.4Å; D390-L393 VanDerWaalsContact O-N 3.15Å; L393-K483 HydrophobicContact CD2-CD 3.9Å
394	P	84.2	Confident	90.6	Very high	33 Å²	33	52.4 Å²	52.4	21%	0.214	30%	0.302	C	S	.	.			trans	-72.5	140.2	174.9	30.7	-34.8	0	0	0	111.1	F396 I577	P394-F396 HydrophobicContact CG-CD2 4.45Å; P394-F396 HydrophobicContact CG-CE1 4.29Å; P394-F396 HydrophobicContact CG-CE2 3.69Å; P394-F396 HydrophobicContact CG-CZ 3.59Å; P394-F396 WeakPolarHBondContact O-CD2 3.49Å; P394-F396 PolarHBondContact O-N 2.96Å; P394-I577 HydrophobicContact CG-CG1 4.41Å; P394-I577 HydrophobicContact CG-CG2 3.98Å
395	D	86.1	Confident	90.6	Very high	143 Å²	143	47.5 Å²	47.5	77%	0.765	28%	0.276	S	S	*	.			trans	-74.3	107	171.3	-64.8	-42.7	0	0	0	109.9	Q403	D395-Q403 PolarHBondContact O-NE2 2.72Å; D395-Q403 PolarHBondContact O-OE1 3.03Å
396	F	88.3	Confident	90.6	Very high	70 Å²	70	46.8 Å²	46.8	31%	0.307	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-80.5	150.7	175	-67.8	-73.7	0	0	0	111.2	P394 V481 I577	P394-F396 HydrophobicContact CG-CD2 4.45Å; P394-F396 HydrophobicContact CG-CE1 4.29Å; P394-F396 HydrophobicContact CG-CE2 3.69Å; P394-F396 HydrophobicContact CG-CZ 3.59Å; P394-F396 WeakPolarHBondContact O-CD2 3.49Å; P394-F396 PolarHBondContact O-N 2.96Å; F396-V481 VanDerWaalsContact CD1-C 3.44Å; F396-V481 WeakPolarHBondContact CD1-O 3.48Å; F396-V481 VanDerWaalsContact CE1-O 3.31Å; F396-V481 WeakPolarHBondContact CE1-O 3.38Å; F396-V481 WeakPolarHBondContact CG-O 3.41Å; F396-I577 HydrophobicContact CE1-CD1 4.22Å; F396-I577 HydrophobicContact CZ-CD1 4.11Å
397	P	88.9	Confident	90.6	Very high	17 Å²	17	46.7 Å²	46.7	11%	0.11	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-67.2	140.8	179.9	28	-31.8	0	0	0	110.6	E401 Q403 R460	P397-E401 HydrophobicContact CB-CB 4.04Å; P397-Q403 HydrophobicContact CB-CB 4.46Å; P397-Q403 HydrophobicContact CB-CG 4.08Å; P397-Q403 HydrophobicContact CG-CB 4.41Å; P397-Q403 HydrophobicContact CG-CG 4.41Å; P397-R460 HydrophobicContact CG-CG 4.03Å
398	S	87.9	Confident	90.7	Very high	48 Å²	48	43.2 Å²	43.2	34%	0.336	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-66.9	170.7	167.7	66.2	0	0	0	0	111.7	T400 E401 G458	S398-T400 PolarHBondContact O-N 3.26Å; S398-T400 PolarHBondContact OG-OG1 2.81Å; S398-E401 VanDerWaalsContact CB-OE2 3.28Å; S398-E401 WeakPolarHBondContact CB-OE2 3.28Å; S398-E401 PolarHBondContact N-OE2 3.37Å; S398-E401 PolarHBondContact O-N 2.88Å; S398-E401 VanDerWaalsContact OG-CG 3.24Å; S398-E401 WeakPolarHBondContact OG-CG 3.46Å; S398-E401 PolarHBondContact OG-OE2 3Å; S398-G458 WeakPolarHBondContact O-CA 3.34Å
399	S	87	Confident	90.7	Very high	103 Å²	103	38.1 Å²	38.1	72%	0.72	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-8.7	-179.9	60.9	0	0	0	0	115	D457	S399-D457 WeakPolarHBondContact O-CB 3.33Å
400	T	89.1	Confident	90.7	Very high	91 Å²	91	38.3 Å²	38.3	56%	0.558	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-3.6	179.3	51.9	0	0	0	0	113.2	S398	S398-T400 PolarHBondContact O-N 3.26Å; S398-T400 PolarHBondContact OG-OG1 2.81Å
401	E	92.1	Very high	90.7	Very high	56 Å²	56	41.7 Å²	41.7	26%	0.262	25%	0.249	S	C	.	.			trans	-106.6	153.4	-179.2	-73.5	166.1	152.4	0	0	110	P397 S398 T436 G458	P397-E401 HydrophobicContact CB-CB 4.04Å; S398-E401 VanDerWaalsContact CB-OE2 3.28Å; S398-E401 WeakPolarHBondContact CB-OE2 3.28Å; S398-E401 PolarHBondContact N-OE2 3.37Å; S398-E401 PolarHBondContact O-N 2.88Å; S398-E401 VanDerWaalsContact OG-CG 3.24Å; S398-E401 WeakPolarHBondContact OG-CG 3.46Å; S398-E401 PolarHBondContact OG-OE2 3Å; E401-T436 HydrophobicContact CB-CG2 3.91Å; E401-T436 HydrophobicContact CG-CG2 3.99Å; E401-G458 PolarHBondContact O-N 2.97Å
402	Q	92.3	Very high	90.9	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.5	171.4	51.7	173.8	3.2	0	0	109	T436 Y437 R439 L455	Q402-T436 CarbonylContact O-C 3.59Å; Q402-T436 WeakPolarHBondContact O-CA 3.2Å; Q402-Y437 WeakPolarHBondContact CG-O 3.42Å; Q402-Y437 PolarHBondContact N-O 2.71Å; Q402-Y437 PolarHBondContact O-N 3.29Å; Q402-R439 PolarHBondContact NE2-O 2.73Å; Q402-L455 HydrophobicContact CB-CB 4.15Å; Q402-L455 VanDerWaalsContact OE1-CA 3.25Å; Q402-L455 PolarHBondContact OE1-O 3.21Å
403	Q	94.6	Very high	91.4	Very high	9 Å²	9	43.5 Å²	43.5	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.4	179.4	-89.4	-176.8	-2.1	0	0	111.7	D395 P397 Y434 Y435 T436 T459 R460 N461	D395-Q403 PolarHBondContact O-NE2 2.72Å; D395-Q403 PolarHBondContact O-OE1 3.03Å; P397-Q403 HydrophobicContact CB-CB 4.46Å; P397-Q403 HydrophobicContact CB-CG 4.08Å; P397-Q403 HydrophobicContact CG-CB 4.41Å; P397-Q403 HydrophobicContact CG-CG 4.41Å; Q403-Y434 HydrophobicContact CB-CD1 4.18Å; Q403-Y435 CarbonylContact C-O 3.56Å; Q403-Y435 VanDerWaalsContact CA-O 3.3Å; Q403-Y435 WeakPolarHBondContact CA-O 3.28Å; Q403-T436 HydrophobicContact CG-CG2 4.25Å; Q403-T436 WeakPolarHBondContact CG-OG1 3.5Å; Q403-T436 PolarHBondContact NE2-OG1 2.84Å; Q403-T436 VanDerWaalsContact NE2-OG1 3.14Å; Q403-T459 PolarHBondContact N-O 3.48Å; Q403-R460 HydrophobicContact CB-CG 3.84Å; Q403-R460 VanDerWaalsContact OE1-CG 3.29Å; Q403-N461 PolarHBondContact O-N 3.31Å
404	A	95	Very high	91.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.2	-179.6	0	0	0	0	0	112.5	F406 Y435 Y437 F441 L455 N461 L463	A404-F406 HydrophobicContact CB-CE2 3.91Å; A404-F406 HydrophobicContact CB-CZ 3.96Å; A404-Y435 PolarHBondContact N-O 3.29Å; A404-Y435 PolarHBondContact O-N 2.91Å; A404-Y437 HydrophobicContact CB-CE2 3.96Å; A404-F441 HydrophobicContact CB-CE1 4.33Å; A404-F441 HydrophobicContact CB-CZ 4.06Å; A404-L455 HydrophobicContact CB-CD1 4.03Å; A404-N461 CarbonylContact C-O 3.59Å; A404-N461 VanDerWaalsContact CA-O 3.25Å; A404-N461 WeakPolarHBondContact CA-O 3.1Å; A404-L463 HydrophobicContact CB-CD1 3.67Å
405	K	95.3	Very high	92.3	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	151	163.2	-177	178.7	-91.9	-177.4	0	109.1	N431 Y434 N461 T462 L463 V574 E575 D576	K405-N431 WeakPolarHBondContact CG-OD1 3.35Å; K405-Y434 HydrophobicContact CB-CD1 3.88Å; K405-Y434 HydrophobicContact CB-CD2 4.18Å; K405-Y434 HydrophobicContact CB-CE1 3.66Å; K405-Y434 HydrophobicContact CB-CE2 3.95Å; K405-Y434 HydrophobicContact CB-CG 4.15Å; K405-Y434 HydrophobicContact CD-CD2 4.4Å; K405-Y434 HydrophobicContact CD-CE2 3.76Å; K405-Y434 HydrophobicContact CG-CE2 4.37Å; K405-N461 PolarHBondContact N-O 3.23Å; K405-T462 CarbonylContact O-C 3.6Å; K405-T462 WeakPolarHBondContact O-CA 3.32Å; K405-L463 PolarHBondContact O-N 3.24Å; K405-V574 HydrophobicContact CD-CG1 3.9Å; K405-E575 PolarHBondContact NZ-O 3.41Å; K405-D576 IonicContact NZ-OD1 3.34Å; K405-D576 PolarHBondContact NZ-OD1 3.11Å
406	F	96.3	Very high	92.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.3	-176.1	-60.8	-91.3	0	0	0	110.1	A404 I416 A418 F423 L425 S430 N431 Y435 F441 L443 L463 I465	A404-F406 HydrophobicContact CB-CE2 3.91Å; A404-F406 HydrophobicContact CB-CZ 3.96Å; F406-I416 HydrophobicContact CB-CD1 4.34Å; F406-A418 HydrophobicContact CE1-CB 4.21Å; F406-A418 HydrophobicContact CE2-CB 4.04Å; F406-A418 HydrophobicContact CZ-CB 3.57Å; F406-F423 HydrophobicContact CB-CE2 4.33Å; F406-F423 HydrophobicContact CB-CZ 4.25Å; F406-F423 HydrophobicContact CD2-CE2 4.45Å; F406-F423 AromaticContact CD2-CZ 3.66Å; F406-F423 HydrophobicContact CD2-CZ 3.66Å; F406-F423 HydrophobicContact CE2-CZ 4.22Å; F406-F423 AromaticContact CG-CZ 3.98Å; F406-F423 HydrophobicContact CG-CZ 3.98Å; F406-L425 HydrophobicContact CB-CD1 3.83Å; F406-S430 WeakPolarHBondContact O-CA 3.32Å; F406-S430 WeakPolarHBondContact O-CB 3.39Å; F406-N431 PolarHBondContact N-OD1 3.45Å; F406-N431 PolarHBondContact O-N 3.32Å; F406-N431 PolarHBondContact O-OD1 3.46Å; F406-N431 VanDerWaalsContact O-OD1 3.08Å; F406-Y435 HydrophobicContact CD2-CD2 4.21Å; F406-Y435 AromaticContact CE2-CD2 3.98Å; F406-Y435 HydrophobicContact CE2-CD2 3.98Å; F406-F441 HydrophobicContact CE1-CE2 4.4Å; F406-F441 AromaticContact CZ-CE2 3.88Å; F406-F441 HydrophobicContact CZ-CE2 3.88Å; F406-F441 AromaticContact CZ-CZ 3.98Å; F406-F441 HydrophobicContact CZ-CZ 3.98Å; F406-L443 HydrophobicContact CD1-CD1 4.34Å; F406-L443 HydrophobicContact CE1-CD1 3.69Å; F406-L443 HydrophobicContact CE1-CD2 4.26Å; F406-L443 HydrophobicContact CZ-CD1 4.4Å; F406-L463 WeakPolarHBondContact CA-O 3.35Å; F406-L463 HydrophobicContact CD1-CB 3.86Å; F406-L463 HydrophobicContact CD1-CD1 4.28Å; F406-L463 HydrophobicContact CE1-CB 4.07Å; F406-L463 HydrophobicContact CE1-CD1 3.72Å; F406-L463 HydrophobicContact CE1-CG 4.37Å; F406-L463 HydrophobicContact CZ-CD1 4.02Å; F406-I465 HydrophobicContact CD1-CD1 4.46Å
407	I	96.4	Very high	93	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.1	174.4	-64.4	178.2	0	0	0	108.5	M409 T462 L463 V464 I465 M518 T554 I556 V574	I407-M409 HydrophobicContact CG2-CG 4.14Å; I407-M409 HydrophobicContact CG2-SD 4.13Å; I407-T462 HydrophobicContact CD1-CG2 3.46Å; I407-T462 VanDerWaalsContact CD1-CG2 3.46Å; I407-T462 HydrophobicContact CG1-CG2 3.73Å; I407-L463 PolarHBondContact N-O 2.9Å; I407-V464 HydrophobicContact CB-CG1 4.48Å; I407-V464 HydrophobicContact CB-CG2 4.3Å; I407-V464 HydrophobicContact CD1-CG2 4.42Å; I407-V464 HydrophobicContact CG2-CG1 4.44Å; I407-I465 PolarHBondContact O-N 3.39Å; I407-M518 HydrophobicContact CD1-CE 4.2Å; I407-T554 HydrophobicContact CD1-CG2 4.39Å; I407-I556 HydrophobicContact CD1-CD1 4.21Å; I407-I556 HydrophobicContact CG2-CD1 3.5Å; I407-I556 VanDerWaalsContact CG2-CD1 3.5Å; I407-I556 HydrophobicContact CG2-CG1 4.38Å; I407-V574 HydrophobicContact CD1-CG2 4.37Å
408	N	95.4	Very high	93.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	111.9	173.2	179.1	16.2	0	0	0	110.4	V410 R412 I414 L425 E426 F428 Q429	N408-V410 WeakPolarHBondContact OD1-CA 3.44Å; N408-V410 VanDerWaalsContact OD1-CB 3.23Å; N408-V410 WeakPolarHBondContact OD1-CB 3.47Å; N408-V410 WeakPolarHBondContact OD1-CG2 3.15Å; N408-V410 PolarHBondContact OD1-N 3.48Å; N408-R412 PolarHBondContact ND2-O 3.15Å; N408-I414 HydrophobicContact CB-CD1 3.88Å; N408-I414 HydrophobicContact CB-CG1 4.16Å; N408-I414 WeakPolarHBondContact OD1-CD1 3.37Å; N408-L425 HydrophobicContact CB-CB 3.76Å; N408-L425 HydrophobicContact CB-CD1 4.13Å; N408-L425 PolarHBondContact ND2-O 3.48Å; N408-E426 WeakPolarHBondContact CB-O 3.27Å; N408-E426 PolarHBondContact ND2-O 2.72Å; N408-F428 WeakPolarHBondContact O-CA 3.4Å; N408-F428 PolarHBondContact O-N 3.29Å; N408-Q429 PolarHBondContact N-O 3.2Å
409	M	94.2	Very high	93.4	Very high	12 Å²	12	34.1 Å²	34.1	6%	0.059	20%	0.197	C	C	.	.			trans	-100.5	6.3	172.8	-68.6	-61.6	-53.2	0	0	113.3	I407 F428 V464 I465 L466 F494 I556	I407-M409 HydrophobicContact CG2-CG 4.14Å; I407-M409 HydrophobicContact CG2-SD 4.13Å; M409-F428 HydrophobicContact CE-CD1 3.83Å; M409-F428 HydrophobicContact CE-CE1 4.19Å; M409-F428 WeakPolarHBondContact O-CE1 3.47Å; M409-F428 HydrophobicContact SD-CD1 4.22Å; M409-V464 HydrophobicContact CB-CG1 4.29Å; M409-V464 HydrophobicContact CG-CG1 3.42Å; M409-V464 VanDerWaalsContact CG-CG1 3.42Å; M409-I465 WeakPolarHBondContact CA-O 3.23Å; M409-I465 WeakPolarHBondContact CB-O 3.36Å; M409-I465 PolarHBondContact N-O 2.98Å; M409-L466 HydrophobicContact CB-CD2 3.53Å; M409-L466 HydrophobicContact CB-CG 4.21Å; M409-L466 HydrophobicContact CG-CD2 3.97Å; M409-F494 HydrophobicContact CE-CD1 4.04Å; M409-F494 HydrophobicContact CE-CE1 3.77Å; M409-F494 HydrophobicContact CG-CD1 4.23Å; M409-F494 HydrophobicContact CG-CE1 3.67Å; M409-F494 HydrophobicContact CG-CZ 4.26Å; M409-F494 HydrophobicContact SD-CD1 3.83Å; M409-F494 HydrophobicContact SD-CE1 3.78Å; M409-I556 HydrophobicContact CE-CG2 3.84Å; M409-I556 HydrophobicContact SD-CG2 3.36Å; M409-I556 WeakPolarHBondContact SD-CG2 3.31Å
410	V	92.1	Very high	93.6	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.024	20%	0.204	C	C	.	.	S	Bend	trans	-78.4	147.3	171.4	-166.1	0	0	0	0	108.6	N408 R412 I414 A427 I465 E467	N408-V410 WeakPolarHBondContact OD1-CA 3.44Å; N408-V410 VanDerWaalsContact OD1-CB 3.23Å; N408-V410 WeakPolarHBondContact OD1-CB 3.47Å; N408-V410 WeakPolarHBondContact OD1-CG2 3.15Å; N408-V410 PolarHBondContact OD1-N 3.48Å; V410-R412 HydrophobicContact CG1-CG 3.85Å; V410-R412 PolarHBondContact O-N 2.94Å; V410-R412 VanDerWaalsContact O-N 3.15Å; V410-I414 HydrophobicContact CB-CG2 4.39Å; V410-I414 HydrophobicContact CG2-CG2 4.49Å; V410-A427 WeakPolarHBondContact O-CA 3.05Å; V410-A427 VanDerWaalsContact O-CB 3.28Å; V410-A427 WeakPolarHBondContact O-CB 3.46Å; V410-I465 HydrophobicContact CG2-CG2 4.39Å; V410-E467 HydrophobicContact CG1-CB 4.41Å; V410-E467 HydrophobicContact CG2-CB 4.27Å
411	D	90.8	Very high	93.8	Very high	120 Å²	120	36.8 Å²	36.8	64%	0.642	19%	0.194	S	C	*	.	S	Bend	trans	-77.2	12	-177.8	66	-12.7	0	0	0	114.5	F428	D411-F428 HydrophobicContact CB-CZ 4.17Å
412	R	92.8	Very high	93.9	Very high	92 Å²	92	39 Å²	39	35%	0.347	21%	0.211	S	C	.	.	S	Bend	trans	-138.3	160.2	177.9	66.3	-179.4	174.4	-86.3	2	111.2	N408 V410 E467	N408-R412 PolarHBondContact ND2-O 3.15Å; V410-R412 HydrophobicContact CG1-CG 3.85Å; V410-R412 PolarHBondContact O-N 2.94Å; V410-R412 VanDerWaalsContact O-N 3.15Å; R412-E467 IonicContact CZ-OE2 3.27Å; R412-E467 IonicContact NH1-OE1 3.85Å; R412-E467 IonicContact NH1-OE2 3.47Å; R412-E467 PolarHBondContact NH1-OE2 3.41Å; R412-E467 IonicContact NH2-OE1 3.56Å; R412-E467 IonicContact NH2-OE2 3.97Å; R412-E467 PolarHBondContact NH2-OE2 3.23Å
413	P	94.9	Very high	94	Very high	57 Å²	57	40.3 Å²	40.3	37%	0.37	22%	0.217	S	C	.	.			trans	-61.1	140.8	169.7	-18.8	31.5	0	0	0	111.1	Q424 L425 E426	P413-Q424 HydrophobicContact CB-CG 4.33Å; P413-L425 VanDerWaalsContact CA-O 3.26Å; P413-L425 WeakPolarHBondContact CA-O 3.47Å; P413-E426 WeakPolarHBondContact CG-OE2 3.3Å
414	I	94.6	Very high	94.1	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.9	176.1	62.7	177.7	0	0	0	110.8	N408 V410 I416 Q424 L425 I445 I465	N408-I414 HydrophobicContact CB-CD1 3.88Å; N408-I414 HydrophobicContact CB-CG1 4.16Å; N408-I414 WeakPolarHBondContact OD1-CD1 3.37Å; V410-I414 HydrophobicContact CB-CG2 4.39Å; V410-I414 HydrophobicContact CG2-CG2 4.49Å; I414-I416 HydrophobicContact CD1-CD1 3.89Å; I414-I416 HydrophobicContact CD1-CG1 4.1Å; I414-I416 HydrophobicContact CG1-CD1 4.15Å; I414-I416 HydrophobicContact CG1-CG1 4.1Å; I414-Q424 WeakPolarHBondContact O-CA 3.45Å; I414-L425 HydrophobicContact CG1-CB 4.15Å; I414-L425 PolarHBondContact N-O 3.44Å; I414-L425 PolarHBondContact O-N 3.35Å; I414-I445 HydrophobicContact CB-CG2 4.25Å; I414-I445 HydrophobicContact CD1-CG2 4.13Å; I414-I465 HydrophobicContact CD1-CB 4.11Å; I414-I465 HydrophobicContact CD1-CD1 3.74Å; I414-I465 HydrophobicContact CD1-CG2 3.72Å
415	D	94.6	Very high	94	Very high	86 Å²	86	45.8 Å²	45.8	46%	0.46	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.2	173.6	-70	-31.2	0	0	0	109.5	Q424 I445 D446	D415-Q424 WeakPolarHBondContact OD1-CG 3.32Å; D415-I445 CarbonylContact O-C 3.57Å; D415-I445 WeakPolarHBondContact O-CA 3.39Å; D415-D446 PolarHBondContact N-OD1 2.81Å; D415-D446 PolarHBondContact O-N 3.49Å
416	I	94.6	Very high	94	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.3	-178.4	-60.8	172.8	0	0	0	109.4	F406 I414 A418 T422 F423 L425 L443 I465	F406-I416 HydrophobicContact CB-CD1 4.34Å; I414-I416 HydrophobicContact CD1-CD1 3.89Å; I414-I416 HydrophobicContact CD1-CG1 4.1Å; I414-I416 HydrophobicContact CG1-CD1 4.15Å; I414-I416 HydrophobicContact CG1-CG1 4.1Å; I416-A418 HydrophobicContact CG2-CB 4.19Å; I416-T422 VanDerWaalsContact O-CA 3.3Å; I416-T422 WeakPolarHBondContact O-CA 3.41Å; I416-F423 HydrophobicContact CB-CD2 4.45Å; I416-F423 HydrophobicContact CB-CE1 4.25Å; I416-F423 HydrophobicContact CB-CE2 3.99Å; I416-F423 HydrophobicContact CB-CZ 3.86Å; I416-F423 HydrophobicContact CD1-CE2 3.87Å; I416-F423 HydrophobicContact CD1-CZ 4.19Å; I416-F423 HydrophobicContact CG1-CE2 4.49Å; I416-F423 HydrophobicContact CG2-CE1 3.96Å; I416-F423 HydrophobicContact CG2-CE2 4.24Å; I416-F423 HydrophobicContact CG2-CZ 3.62Å; I416-F423 PolarHBondContact N-O 3.08Å; I416-F423 PolarHBondContact O-N 3.24Å; I416-L425 HydrophobicContact CD1-CB 4.37Å; I416-L425 HydrophobicContact CD1-CD1 3.43Å; I416-L425 VanDerWaalsContact CD1-CD1 3.43Å; I416-L425 HydrophobicContact CD1-CG 3.81Å; I416-L443 HydrophobicContact CG2-CD1 3.6Å; I416-I465 HydrophobicContact CD1-CD1 3.29Å; I416-I465 HydrophobicContact CG1-CD1 4.06Å
417	T	94.5	Very high	93.8	Very high	51 Å²	51	51.1 Å²	51.1	31%	0.313	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.3	164.8	-54.3	0	0	0	0	108.3	Y421 L443 K444	T417-Y421 CarbonylContact C-O 3.55Å; T417-Y421 WeakPolarHBondContact CA-O 3.36Å; T417-L443 CarbonylContact O-C 3.6Å; T417-L443 WeakPolarHBondContact O-CA 3.45Å; T417-K444 PolarHBondContact N-O 3.37Å; T417-K444 PolarHBondContact O-N 2.88Å
418	A	93.4	Very high	93.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	94.5	-179.8	0	0	0	0	0	109.7	F406 I416 N420 Y421 F423 Y437 F441 E442 L443	F406-A418 HydrophobicContact CE1-CB 4.21Å; F406-A418 HydrophobicContact CE2-CB 4.04Å; F406-A418 HydrophobicContact CZ-CB 3.57Å; I416-A418 HydrophobicContact CG2-CB 4.19Å; A418-N420 PolarHBondContact O-N 3.06Å; A418-Y421 PolarHBondContact N-O 3.23Å; A418-Y421 PolarHBondContact O-N 3.04Å; A418-Y421 VanDerWaalsContact O-N 3.12Å; A418-F423 HydrophobicContact CB-CE1 4.44Å; A418-Y437 VanDerWaalsContact CB-OH 3.3Å; A418-Y437 WeakPolarHBondContact CB-OH 3.31Å; A418-Y437 WeakPolarHBondContact O-CE1 3.12Å; A418-Y437 PolarHBondContact O-OH 3.48Å; A418-F441 HydrophobicContact CB-CD2 4.15Å; A418-F441 HydrophobicContact CB-CE2 4Å; A418-E442 CarbonylContact C-O 3.57Å; A418-E442 WeakPolarHBondContact CA-O 3.35Å; A418-L443 HydrophobicContact CB-CD1 3.91Å
419	G	91.6	Very high	93.5	Very high	31 Å²	31	57.1 Å²	57.1	32%	0.32	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	-116.2	-170.7	0	0	0	0	0	111	E442	G419-E442 PolarHBondContact N-O 3.45Å
420	N	91.6	Very high	93.5	Very high	161 Å²	161	57.9 Å²	57.9	86%	0.861	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-8.4	-179.5	-64.4	-16.9	0	0	0	113.7	A418	A418-N420 PolarHBondContact O-N 3.06Å
421	Y	93.5	Very high	93.6	Very high	89 Å²	89	58 Å²	58	35%	0.349	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	125.2	-176.3	-58.7	-81	0	0	0	110.1	T417 A418 Y435 Y437	T417-Y421 CarbonylContact C-O 3.55Å; T417-Y421 WeakPolarHBondContact CA-O 3.36Å; A418-Y421 PolarHBondContact N-O 3.23Å; A418-Y421 PolarHBondContact O-N 3.04Å; A418-Y421 VanDerWaalsContact O-N 3.12Å; Y421-Y435 AromaticContact CD1-CD1 3.68Å; Y421-Y435 HydrophobicContact CD1-CD1 3.68Å; Y421-Y435 AromaticContact CD1-CE1 3.84Å; Y421-Y435 HydrophobicContact CD1-CE1 3.84Å; Y421-Y435 HydrophobicContact CD1-CG 4.07Å; Y421-Y435 HydrophobicContact CD2-CD1 4.31Å; Y421-Y435 HydrophobicContact CD2-CD2 4.35Å; Y421-Y435 AromaticContact CD2-CG 3.92Å; Y421-Y435 HydrophobicContact CD2-CG 3.92Å; Y421-Y435 AromaticContact CE1-CD1 3.74Å; Y421-Y435 HydrophobicContact CE1-CD1 3.74Å; Y421-Y435 HydrophobicContact CE1-CE1 4.18Å; Y421-Y435 HydrophobicContact CE1-CG 4.32Å; Y421-Y435 HydrophobicContact CE2-CD1 4.36Å; Y421-Y435 HydrophobicContact CE2-CG 4.17Å; Y421-Y435 AromaticContact CG-CD1 3.97Å; Y421-Y435 HydrophobicContact CG-CD1 3.97Å; Y421-Y435 HydrophobicContact CG-CD2 4.09Å; Y421-Y435 HydrophobicContact CG-CE1 4.32Å; Y421-Y435 HydrophobicContact CG-CE2 4.45Å; Y421-Y435 AromaticContact CG-CG 3.86Å; Y421-Y435 HydrophobicContact CG-CG 3.86Å; Y421-Y437 AromaticContact CD2-CE1 3.77Å; Y421-Y437 HydrophobicContact CD2-CE1 3.77Å; Y421-Y437 AromaticContact CD2-CZ 3.76Å; Y421-Y437 WeakPolarHBondContact CD2-OH 3.49Å; Y421-Y437 AromaticContact CE2-CE1 3.96Å; Y421-Y437 HydrophobicContact CE2-CE1 3.96Å
422	T	93.8	Very high	93.5	Very high	103 Å²	103	59.9 Å²	59.9	63%	0.632	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	126	172.2	-56.9	0	0	0	0	109.4	I416	I416-T422 VanDerWaalsContact O-CA 3.3Å; I416-T422 WeakPolarHBondContact O-CA 3.41Å
423	F	94.6	Very high	93.4	Very high	30 Å²	30	59.7 Å²	59.7	13%	0.132	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	158.4	-174.9	56.2	-81.5	0	0	0	110.4	F406 I416 A418 L425 N431 Y435	F406-F423 HydrophobicContact CB-CE2 4.33Å; F406-F423 HydrophobicContact CB-CZ 4.25Å; F406-F423 HydrophobicContact CD2-CE2 4.45Å; F406-F423 AromaticContact CD2-CZ 3.66Å; F406-F423 HydrophobicContact CD2-CZ 3.66Å; F406-F423 HydrophobicContact CE2-CZ 4.22Å; F406-F423 AromaticContact CG-CZ 3.98Å; F406-F423 HydrophobicContact CG-CZ 3.98Å; I416-F423 HydrophobicContact CB-CD2 4.45Å; I416-F423 HydrophobicContact CB-CE1 4.25Å; I416-F423 HydrophobicContact CB-CE2 3.99Å; I416-F423 HydrophobicContact CB-CZ 3.86Å; I416-F423 HydrophobicContact CD1-CE2 3.87Å; I416-F423 HydrophobicContact CD1-CZ 4.19Å; I416-F423 HydrophobicContact CG1-CE2 4.49Å; I416-F423 HydrophobicContact CG2-CE1 3.96Å; I416-F423 HydrophobicContact CG2-CE2 4.24Å; I416-F423 HydrophobicContact CG2-CZ 3.62Å; I416-F423 PolarHBondContact N-O 3.08Å; I416-F423 PolarHBondContact O-N 3.24Å; A418-F423 HydrophobicContact CB-CE1 4.44Å; F423-L425 HydrophobicContact CD2-CD2 3.83Å; F423-L425 HydrophobicContact CD2-CG 3.86Å; F423-L425 HydrophobicContact CE2-CD1 3.96Å; F423-L425 HydrophobicContact CE2-CD2 3.87Å; F423-L425 HydrophobicContact CE2-CG 3.68Å; F423-N431 HydrophobicContact CD2-CB 4.39Å; F423-N431 HydrophobicContact CE2-CB 4.12Å; F423-Y435 AromaticContact CD1-CE2 3.65Å; F423-Y435 HydrophobicContact CD1-CE2 3.65Å; F423-Y435 AromaticContact CE1-CD2 3.97Å; F423-Y435 HydrophobicContact CE1-CD2 3.97Å; F423-Y435 AromaticContact CE1-CE2 3.3Å; F423-Y435 HydrophobicContact CE1-CE2 3.3Å; F423-Y435 HydrophobicContact CE2-CE2 4.33Å; F423-Y435 HydrophobicContact CG-CE2 4.35Å; F423-Y435 HydrophobicContact CZ-CD2 4.33Å; F423-Y435 AromaticContact CZ-CE2 3.68Å; F423-Y435 HydrophobicContact CZ-CE2 3.68Å
424	Q	95.3	Very high	93.3	Very high	116 Å²	116	58.2 Å²	58.2	54%	0.542	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	135.7	175.7	-170.2	176	24.7	0	0	109.4	P413 I414 D415	P413-Q424 HydrophobicContact CB-CG 4.33Å; I414-Q424 WeakPolarHBondContact O-CA 3.45Å; D415-Q424 WeakPolarHBondContact OD1-CG 3.32Å
425	L	94.6	Very high	93.3	Very high	7 Å²	7	60.5 Å²	60.5	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.8	173.8	-71	-171.3	0	0	0	111.3	F406 N408 P413 I414 I416 F423 N431	F406-L425 HydrophobicContact CB-CD1 3.83Å; N408-L425 HydrophobicContact CB-CB 3.76Å; N408-L425 HydrophobicContact CB-CD1 4.13Å; N408-L425 PolarHBondContact ND2-O 3.48Å; P413-L425 VanDerWaalsContact CA-O 3.26Å; P413-L425 WeakPolarHBondContact CA-O 3.47Å; I414-L425 HydrophobicContact CG1-CB 4.15Å; I414-L425 PolarHBondContact N-O 3.44Å; I414-L425 PolarHBondContact O-N 3.35Å; I416-L425 HydrophobicContact CD1-CB 4.37Å; I416-L425 HydrophobicContact CD1-CD1 3.43Å; I416-L425 VanDerWaalsContact CD1-CD1 3.43Å; I416-L425 HydrophobicContact CD1-CG 3.81Å; F423-L425 HydrophobicContact CD2-CD2 3.83Å; F423-L425 HydrophobicContact CD2-CG 3.86Å; F423-L425 HydrophobicContact CE2-CD1 3.96Å; F423-L425 HydrophobicContact CE2-CD2 3.87Å; F423-L425 HydrophobicContact CE2-CG 3.68Å; L425-N431 HydrophobicContact CD2-CB 4.01Å
426	E	94.9	Very high	93.2	Very high	90 Å²	90	58.6 Å²	58.6	42%	0.421	30%	0.302	S	S	.	.			trans	-64.7	159	170.2	-66.9	-60.7	149.1	0	0	112.1	N408 P413 F428 Q429	N408-E426 WeakPolarHBondContact CB-O 3.27Å; N408-E426 PolarHBondContact ND2-O 2.72Å; P413-E426 WeakPolarHBondContact CG-OE2 3.3Å; E426-F428 PolarHBondContact O-N 3.46Å; E426-Q429 HydrophobicContact CB-CB 4.31Å; E426-Q429 HydrophobicContact CB-CG 4.17Å; E426-Q429 PolarHBondContact O-N 2.81Å
427	A	92.3	Very high	93.2	Very high	24 Å²	24	59.4 Å²	59.4	20%	0.198	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	132.6	179	0	0	0	0	0	111.9	V410 Q429	V410-A427 WeakPolarHBondContact O-CA 3.05Å; V410-A427 VanDerWaalsContact O-CB 3.28Å; V410-A427 WeakPolarHBondContact O-CB 3.46Å; A427-Q429 VanDerWaalsContact C-N 3.26Å; A427-Q429 PolarHBondContact O-N 2.87Å
428	F	91.9	Very high	93	Very high	30 Å²	30	62.4 Å²	62.4	13%	0.132	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	29.8	179.4	-43.1	-64	0	0	0	114.5	N408 M409 D411 E426 P558 P559 K572	N408-F428 WeakPolarHBondContact O-CA 3.4Å; N408-F428 PolarHBondContact O-N 3.29Å; M409-F428 HydrophobicContact CE-CD1 3.83Å; M409-F428 HydrophobicContact CE-CE1 4.19Å; M409-F428 WeakPolarHBondContact O-CE1 3.47Å; M409-F428 HydrophobicContact SD-CD1 4.22Å; D411-F428 HydrophobicContact CB-CZ 4.17Å; E426-F428 PolarHBondContact O-N 3.46Å; F428-P558 HydrophobicContact CD1-CB 3.94Å; F428-P558 HydrophobicContact CD2-CB 4.33Å; F428-P558 HydrophobicContact CE1-CB 4.2Å; F428-P558 HydrophobicContact CG-CB 4.01Å; F428-P558 HydrophobicContact CZ-CB 4.49Å; F428-P559 HydrophobicContact CE1-CG 4.14Å; F428-K572 HydrophobicContact CB-CG 4.27Å
429	Q	93.2	Very high	92.9	Very high	96 Å²	96	72 Å²	72	45%	0.449	36%	0.356	S	S	.	.			trans	-124.8	164.9	178.4	-64.3	-173.4	23	0	0	112.1	N408 E426 A427	N408-Q429 PolarHBondContact N-O 3.2Å; E426-Q429 HydrophobicContact CB-CB 4.31Å; E426-Q429 HydrophobicContact CB-CG 4.17Å; E426-Q429 PolarHBondContact O-N 2.81Å; A427-Q429 VanDerWaalsContact C-N 3.26Å; A427-Q429 PolarHBondContact O-N 2.87Å
430	S	94.2	Very high	92.9	Very high	28 Å²	28	73.7 Å²	73.7	20%	0.196	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-112.7	162.9	173	77.2	0	0	0	0	111.9	F406 V574	F406-S430 WeakPolarHBondContact O-CA 3.32Å; F406-S430 WeakPolarHBondContact O-CB 3.39Å; S430-V574 VanDerWaalsContact OG-CG1 3.29Å; S430-V574 WeakPolarHBondContact OG-CG1 3.12Å
431	N	94.1	Very high	93	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.037	32%	0.322	C	S	.	.			trans	-66	155.7	159.6	62.8	-43.2	0	0	0	110	K405 F406 F423 L425 D433 Y435	K405-N431 WeakPolarHBondContact CG-OD1 3.35Å; F406-N431 PolarHBondContact N-OD1 3.45Å; F406-N431 PolarHBondContact O-N 3.32Å; F406-N431 PolarHBondContact O-OD1 3.46Å; F406-N431 VanDerWaalsContact O-OD1 3.08Å; F423-N431 HydrophobicContact CD2-CB 4.39Å; F423-N431 HydrophobicContact CE2-CB 4.12Å; L425-N431 HydrophobicContact CD2-CB 4.01Å; N431-D433 PolarHBondContact ND2-O 2.79Å; N431-Y435 HydrophobicContact CB-CE2 4.35Å; N431-Y435 WeakPolarHBondContact ND2-CE2 3.47Å
432	K	88.6	Confident	93	Very high	159 Å²	159	68 Å²	68	69%	0.691	33%	0.333	S	S	*	.	S	Bend	trans	-70.2	-53.3	-172.6	-171.1	-179.2	-179.5	-179.2	0	112.6
433	D	90.2	Very high	93.1	Very high	87 Å²	87	63.2 Å²	63.2	47%	0.465	30%	0.303	S	S	.	.	S	Bend	trans	-113.5	158.3	-172.6	-53.7	-58.3	0	0	0	110.6	N431	N431-D433 PolarHBondContact ND2-O 2.79Å
434	Y	92.9	Very high	93	Very high	27 Å²	27	66 Å²	66	11%	0.106	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-74.5	141	173.7	-78.8	-113.9	0	0	0	109.8	Q403 K405 R460 D479 D576	Q403-Y434 HydrophobicContact CB-CD1 4.18Å; K405-Y434 HydrophobicContact CB-CD1 3.88Å; K405-Y434 HydrophobicContact CB-CD2 4.18Å; K405-Y434 HydrophobicContact CB-CE1 3.66Å; K405-Y434 HydrophobicContact CB-CE2 3.95Å; K405-Y434 HydrophobicContact CB-CG 4.15Å; K405-Y434 HydrophobicContact CD-CD2 4.4Å; K405-Y434 HydrophobicContact CD-CE2 3.76Å; K405-Y434 HydrophobicContact CG-CE2 4.37Å; Y434-R460 HydrophobicContact CD1-CB 4.28Å; Y434-R460 HydrophobicContact CD1-CG 4.3Å; Y434-R460 HydrophobicContact CE1-CB 3.94Å; Y434-R460 HydrophobicContact CE1-CG 4.37Å; Y434-R460 VanDerWaalsContact CZ-NH2 3.32Å; Y434-D479 HydrophobicContact CE1-CB 4.44Å; Y434-D479 VanDerWaalsContact CE1-OD2 3.22Å; Y434-D479 WeakPolarHBondContact CE1-OD2 3.47Å; Y434-D479 PolarHBondContact OH-OD2 2.72Å; Y434-D576 HydrophobicContact CE2-CB 4.48Å; Y434-D576 PolarHBondContact OH-OD1 3.01Å
435	Y	94.3	Very high	92.8	Very high	49 Å²	49	61.4 Å²	61.4	19%	0.192	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.8	173.4	-62.5	-41.8	0	0	0	110.2	Q403 A404 F406 Y421 F423 N431 Y437	Q403-Y435 CarbonylContact C-O 3.56Å; Q403-Y435 VanDerWaalsContact CA-O 3.3Å; Q403-Y435 WeakPolarHBondContact CA-O 3.28Å; A404-Y435 PolarHBondContact N-O 3.29Å; A404-Y435 PolarHBondContact O-N 2.91Å; F406-Y435 HydrophobicContact CD2-CD2 4.21Å; F406-Y435 AromaticContact CE2-CD2 3.98Å; F406-Y435 HydrophobicContact CE2-CD2 3.98Å; Y421-Y435 AromaticContact CD1-CD1 3.68Å; Y421-Y435 HydrophobicContact CD1-CD1 3.68Å; Y421-Y435 AromaticContact CD1-CE1 3.84Å; Y421-Y435 HydrophobicContact CD1-CE1 3.84Å; Y421-Y435 HydrophobicContact CD1-CG 4.07Å; Y421-Y435 HydrophobicContact CD2-CD1 4.31Å; Y421-Y435 HydrophobicContact CD2-CD2 4.35Å; Y421-Y435 AromaticContact CD2-CG 3.92Å; Y421-Y435 HydrophobicContact CD2-CG 3.92Å; Y421-Y435 AromaticContact CE1-CD1 3.74Å; Y421-Y435 HydrophobicContact CE1-CD1 3.74Å; Y421-Y435 HydrophobicContact CE1-CE1 4.18Å; Y421-Y435 HydrophobicContact CE1-CG 4.32Å; Y421-Y435 HydrophobicContact CE2-CD1 4.36Å; Y421-Y435 HydrophobicContact CE2-CG 4.17Å; Y421-Y435 AromaticContact CG-CD1 3.97Å; Y421-Y435 HydrophobicContact CG-CD1 3.97Å; Y421-Y435 HydrophobicContact CG-CD2 4.09Å; Y421-Y435 HydrophobicContact CG-CE1 4.32Å; Y421-Y435 HydrophobicContact CG-CE2 4.45Å; Y421-Y435 AromaticContact CG-CG 3.86Å; Y421-Y435 HydrophobicContact CG-CG 3.86Å; F423-Y435 AromaticContact CD1-CE2 3.65Å; F423-Y435 HydrophobicContact CD1-CE2 3.65Å; F423-Y435 AromaticContact CE1-CD2 3.97Å; F423-Y435 HydrophobicContact CE1-CD2 3.97Å; F423-Y435 AromaticContact CE1-CE2 3.3Å; F423-Y435 HydrophobicContact CE1-CE2 3.3Å; F423-Y435 HydrophobicContact CE2-CE2 4.33Å; F423-Y435 HydrophobicContact CG-CE2 4.35Å; F423-Y435 HydrophobicContact CZ-CD2 4.33Å; F423-Y435 AromaticContact CZ-CE2 3.68Å; F423-Y435 HydrophobicContact CZ-CE2 3.68Å; N431-Y435 HydrophobicContact CB-CE2 4.35Å; N431-Y435 WeakPolarHBondContact ND2-CE2 3.47Å; Y435-Y437 WeakPolarHBondContact O-CD2 3.16Å; Y435-Y437 VanDerWaalsContact O-CE2 3.31Å; Y435-Y437 WeakPolarHBondContact O-CE2 3.32Å
436	T	94.1	Very high	92.6	Very high	45 Å²	45	63.5 Å²	63.5	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.8	-178.6	-52.4	0	0	0	0	110.8	E401 Q402 Q403	E401-T436 HydrophobicContact CB-CG2 3.91Å; E401-T436 HydrophobicContact CG-CG2 3.99Å; Q402-T436 CarbonylContact O-C 3.59Å; Q402-T436 WeakPolarHBondContact O-CA 3.2Å; Q403-T436 HydrophobicContact CG-CG2 4.25Å; Q403-T436 WeakPolarHBondContact CG-OG1 3.5Å; Q403-T436 PolarHBondContact NE2-OG1 2.84Å; Q403-T436 VanDerWaalsContact NE2-OG1 3.14Å
437	Y	93.4	Very high	92	Very high	17 Å²	17	66 Å²	66	7%	0.067	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	138.7	178.4	-52.7	-94.2	0	0	0	110.6	Q402 A404 A418 Y421 Y435 F441	Q402-Y437 WeakPolarHBondContact CG-O 3.42Å; Q402-Y437 PolarHBondContact N-O 2.71Å; Q402-Y437 PolarHBondContact O-N 3.29Å; A404-Y437 HydrophobicContact CB-CE2 3.96Å; A418-Y437 VanDerWaalsContact CB-OH 3.3Å; A418-Y437 WeakPolarHBondContact CB-OH 3.31Å; A418-Y437 WeakPolarHBondContact O-CE1 3.12Å; A418-Y437 PolarHBondContact O-OH 3.48Å; Y421-Y437 AromaticContact CD2-CE1 3.77Å; Y421-Y437 HydrophobicContact CD2-CE1 3.77Å; Y421-Y437 AromaticContact CD2-CZ 3.76Å; Y421-Y437 WeakPolarHBondContact CD2-OH 3.49Å; Y421-Y437 AromaticContact CE2-CE1 3.96Å; Y421-Y437 HydrophobicContact CE2-CE1 3.96Å; Y435-Y437 WeakPolarHBondContact O-CD2 3.16Å; Y435-Y437 VanDerWaalsContact O-CE2 3.31Å; Y435-Y437 WeakPolarHBondContact O-CE2 3.32Å; Y437-F441 HydrophobicContact CD1-CB 3.67Å; Y437-F441 AromaticContact CD1-CD1 3.69Å; Y437-F441 HydrophobicContact CD1-CD1 3.69Å; Y437-F441 HydrophobicContact CD1-CE1 4.49Å; Y437-F441 AromaticContact CD1-CG 3.74Å; Y437-F441 HydrophobicContact CD1-CG 3.74Å; Y437-F441 AromaticContact CD2-CD1 3.68Å; Y437-F441 HydrophobicContact CD2-CD1 3.68Å; Y437-F441 AromaticContact CD2-CE1 3.72Å; Y437-F441 HydrophobicContact CD2-CE1 3.72Å; Y437-F441 HydrophobicContact CD2-CG 4.42Å; Y437-F441 HydrophobicContact CD2-CZ 4.49Å; Y437-F441 HydrophobicContact CE1-CB 3.84Å; Y437-F441 AromaticContact CE1-CD1 3.93Å; Y437-F441 HydrophobicContact CE1-CD1 3.93Å; Y437-F441 HydrophobicContact CE1-CD2 4.09Å; Y437-F441 AromaticContact CE1-CG 3.69Å; Y437-F441 HydrophobicContact CE1-CG 3.69Å; Y437-F441 AromaticContact CE2-CD1 3.94Å; Y437-F441 HydrophobicContact CE2-CD1 3.94Å; Y437-F441 AromaticContact CE2-CE1 3.78Å; Y437-F441 HydrophobicContact CE2-CE1 3.78Å; Y437-F441 HydrophobicContact CE2-CG 4.4Å; Y437-F441 HydrophobicContact CE2-CZ 4.1Å; Y437-F441 HydrophobicContact CG-CB 4.34Å; Y437-F441 AromaticContact CG-CD1 3.55Å; Y437-F441 HydrophobicContact CG-CD1 3.55Å; Y437-F441 HydrophobicContact CG-CE1 4.1Å; Y437-F441 HydrophobicContact CG-CG 4.11Å
438	D	91.6	Very high	91.5	Very high	114 Å²	114	66.5 Å²	66.5	61%	0.61	34%	0.335	S	S	*	.	S	Bend	trans	-87.9	-13.6	176.5	-53.7	-41.3	0	0	0	113.4
439	R	90	Very high	91.3	Very high	201 Å²	201	70 Å²	70	76%	0.758	36%	0.363	S	S	*	.	S	Bend	trans	-147.3	160.1	-173.4	-65	-174	-175.2	-178	1.9	109.9	Q402 F441	Q402-R439 PolarHBondContact NE2-O 2.73Å; R439-F441 PolarHBondContact O-N 3.24Å
440	P	91.9	Very high	91.1	Very high	67 Å²	67	68.9 Å²	68.9	44%	0.435	36%	0.364	S	S	.	.			trans	-48	135.5	168.3	-28.2	36	0	0	0	111.4	L452 I453	P440-L452 HydrophobicContact CB-CD1 3.98Å; P440-L452 HydrophobicContact CB-CG 4.25Å; P440-I453 CarbonylContact C-O 3.58Å; P440-I453 VanDerWaalsContact CA-O 3.23Å; P440-I453 WeakPolarHBondContact CA-O 3.45Å; P440-I453 WeakPolarHBondContact CB-O 3.27Å
441	F	93.6	Very high	90.9	Very high	10 Å²	10	71.2 Å²	71.2	4%	0.044	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	151.5	-174.2	63.2	-91.2	0	0	0	111	A404 F406 A418 Y437 R439 L443 I453 L455 L463	A404-F441 HydrophobicContact CB-CE1 4.33Å; A404-F441 HydrophobicContact CB-CZ 4.06Å; F406-F441 HydrophobicContact CE1-CE2 4.4Å; F406-F441 AromaticContact CZ-CE2 3.88Å; F406-F441 HydrophobicContact CZ-CE2 3.88Å; F406-F441 AromaticContact CZ-CZ 3.98Å; F406-F441 HydrophobicContact CZ-CZ 3.98Å; A418-F441 HydrophobicContact CB-CD2 4.15Å; A418-F441 HydrophobicContact CB-CE2 4Å; Y437-F441 HydrophobicContact CD1-CB 3.67Å; Y437-F441 AromaticContact CD1-CD1 3.69Å; Y437-F441 HydrophobicContact CD1-CD1 3.69Å; Y437-F441 HydrophobicContact CD1-CE1 4.49Å; Y437-F441 AromaticContact CD1-CG 3.74Å; Y437-F441 HydrophobicContact CD1-CG 3.74Å; Y437-F441 AromaticContact CD2-CD1 3.68Å; Y437-F441 HydrophobicContact CD2-CD1 3.68Å; Y437-F441 AromaticContact CD2-CE1 3.72Å; Y437-F441 HydrophobicContact CD2-CE1 3.72Å; Y437-F441 HydrophobicContact CD2-CG 4.42Å; Y437-F441 HydrophobicContact CD2-CZ 4.49Å; Y437-F441 HydrophobicContact CE1-CB 3.84Å; Y437-F441 AromaticContact CE1-CD1 3.93Å; Y437-F441 HydrophobicContact CE1-CD1 3.93Å; Y437-F441 HydrophobicContact CE1-CD2 4.09Å; Y437-F441 AromaticContact CE1-CG 3.69Å; Y437-F441 HydrophobicContact CE1-CG 3.69Å; Y437-F441 AromaticContact CE2-CD1 3.94Å; Y437-F441 HydrophobicContact CE2-CD1 3.94Å; Y437-F441 AromaticContact CE2-CE1 3.78Å; Y437-F441 HydrophobicContact CE2-CE1 3.78Å; Y437-F441 HydrophobicContact CE2-CG 4.4Å; Y437-F441 HydrophobicContact CE2-CZ 4.1Å; Y437-F441 HydrophobicContact CG-CB 4.34Å; Y437-F441 AromaticContact CG-CD1 3.55Å; Y437-F441 HydrophobicContact CG-CD1 3.55Å; Y437-F441 HydrophobicContact CG-CE1 4.1Å; Y437-F441 HydrophobicContact CG-CG 4.11Å; R439-F441 PolarHBondContact O-N 3.24Å; F441-L443 HydrophobicContact CE2-CB 4.34Å; F441-I453 HydrophobicContact CD2-CB 4.31Å; F441-I453 HydrophobicContact CE1-CB 4.17Å; F441-I453 HydrophobicContact CE1-CG2 3.89Å; F441-I453 HydrophobicContact CE2-CB 3.89Å; F441-I453 HydrophobicContact CE2-CG1 4.18Å; F441-I453 HydrophobicContact CE2-CG2 4.19Å; F441-I453 HydrophobicContact CZ-CB 3.83Å; F441-I453 HydrophobicContact CZ-CG1 4.44Å; F441-I453 HydrophobicContact CZ-CG2 3.62Å; F441-I453 PolarHBondContact N-O 3.3Å; F441-I453 PolarHBondContact O-N 3.45Å; F441-L455 HydrophobicContact CE1-CD1 4.22Å; F441-L463 HydrophobicContact CZ-CD1 4.28Å
442	E	94.3	Very high	90.9	Very high	121 Å²	121	76.5 Å²	76.5	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	127.2	173.6	-67.2	-173.8	176.4	0	0	110.1	A418 G419 P450 L452	A418-E442 CarbonylContact C-O 3.57Å; A418-E442 WeakPolarHBondContact CA-O 3.35Å; G419-E442 PolarHBondContact N-O 3.45Å; E442-P450 HydrophobicContact CB-CB 4.28Å; E442-L452 HydrophobicContact CG-CD1 4.35Å
443	L	94.1	Very high	91.1	Very high	3 Å²	3	69 Å²	69	2%	0.016	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.5	173.4	179	64.1	0	0	0	109.3	F406 I416 T417 A418 F441 I445 P450 V451 I453 L463 N474	F406-L443 HydrophobicContact CD1-CD1 4.34Å; F406-L443 HydrophobicContact CE1-CD1 3.69Å; F406-L443 HydrophobicContact CE1-CD2 4.26Å; F406-L443 HydrophobicContact CZ-CD1 4.4Å; I416-L443 HydrophobicContact CG2-CD1 3.6Å; T417-L443 CarbonylContact O-C 3.6Å; T417-L443 WeakPolarHBondContact O-CA 3.45Å; A418-L443 HydrophobicContact CB-CD1 3.91Å; F441-L443 HydrophobicContact CE2-CB 4.34Å; L443-I445 HydrophobicContact CD1-CG1 4.42Å; L443-I445 HydrophobicContact CD2-CD1 4.32Å; L443-I445 HydrophobicContact CG-CD1 4.47Å; L443-I445 HydrophobicContact CG-CG1 4.25Å; L443-P450 WeakPolarHBondContact O-CA 3.23Å; L443-V451 PolarHBondContact N-O 3.39Å; L443-V451 PolarHBondContact O-N 2.94Å; L443-I453 HydrophobicContact CB-CD1 4.46Å; L443-I453 HydrophobicContact CB-CG1 3.61Å; L443-I453 HydrophobicContact CD2-CD1 4.25Å; L443-I453 HydrophobicContact CD2-CG1 4.02Å; L443-I453 HydrophobicContact CG-CG1 4.48Å; L443-L463 HydrophobicContact CD2-CD2 4.49Å; L443-N474 HydrophobicContact CD2-CB 4.5Å
444	K	93.3	Very high	91.2	Very high	88 Å²	88	68.3 Å²	68.3	38%	0.383	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.4	172.4	-174.7	-177.2	176.9	-172.7	0	108.9	T417 D446 G448 P450	T417-K444 PolarHBondContact N-O 3.37Å; T417-K444 PolarHBondContact O-N 2.88Å; K444-D446 WeakPolarHBondContact CE-O 3.21Å; K444-G448 VanDerWaalsContact CE-O 3.3Å; K444-G448 WeakPolarHBondContact CE-O 3.42Å; K444-G448 WeakPolarHBondContact CG-O 3.19Å; K444-P450 HydrophobicContact CB-CB 4.39Å
445	I	91.9	Very high	91.2	Very high	20 Å²	20	67.4 Å²	67.4	10%	0.103	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.5	178.7	-53.4	166.4	0	0	0	107.4	I414 D415 L443 T447 G448 I465 I472	I414-I445 HydrophobicContact CB-CG2 4.25Å; I414-I445 HydrophobicContact CD1-CG2 4.13Å; D415-I445 CarbonylContact O-C 3.57Å; D415-I445 WeakPolarHBondContact O-CA 3.39Å; L443-I445 HydrophobicContact CD1-CG1 4.42Å; L443-I445 HydrophobicContact CD2-CD1 4.32Å; L443-I445 HydrophobicContact CG-CD1 4.47Å; L443-I445 HydrophobicContact CG-CG1 4.25Å; I445-T447 PolarHBondContact O-N 3.45Å; I445-G448 WeakPolarHBondContact O-CA 3.4Å; I445-G448 PolarHBondContact O-N 3.29Å; I445-I465 HydrophobicContact CD1-CD1 3.88Å; I445-I465 HydrophobicContact CD1-CG1 3.97Å; I445-I465 HydrophobicContact CD1-CG2 3.84Å; I445-I465 HydrophobicContact CG1-CD1 4.33Å; I445-I472 HydrophobicContact CB-CG2 4.44Å; I445-I472 HydrophobicContact CD1-CG2 3.71Å; I445-I472 HydrophobicContact CG2-CD1 4Å; I445-I472 HydrophobicContact CG2-CG2 4.14Å
446	D	89.4	Confident	91	Very high	51 Å²	51	69 Å²	69	27%	0.273	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	-130	-173.3	-60.2	-34.1	0	0	0	112.2	D415 K444 G448	D415-D446 PolarHBondContact N-OD1 2.81Å; D415-D446 PolarHBondContact O-N 3.49Å; K444-D446 WeakPolarHBondContact CE-O 3.21Å; D446-G448 VanDerWaalsContact C-N 3.25Å; D446-G448 PolarHBondContact O-N 3.25Å
447	T	82.3	Confident	90.8	Very high	143 Å²	143	71.5 Å²	71.5	88%	0.877	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	9.6	175.7	58.7	0	0	0	0	113.4	I445	I445-T447 PolarHBondContact O-N 3.45Å
448	G	83.1	Confident	90.6	Very high	34 Å²	34	72 Å²	72	35%	0.351	41%	0.408	S	S	.	.	S	Bend	trans	-65	165.3	179.5	0	0	0	0	0	113.5	K444 I445 D446	K444-G448 VanDerWaalsContact CE-O 3.3Å; K444-G448 WeakPolarHBondContact CE-O 3.42Å; K444-G448 WeakPolarHBondContact CG-O 3.19Å; I445-G448 WeakPolarHBondContact O-CA 3.4Å; I445-G448 PolarHBondContact O-N 3.29Å; D446-G448 VanDerWaalsContact C-N 3.25Å; D446-G448 PolarHBondContact O-N 3.25Å
449	S	86.5	Confident	90.6	Very high	104 Å²	104	68.3 Å²	68.3	73%	0.727	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-73.4	141.8	171.2	-58.1	0	0	0	0	110.7
450	P	89.3	Confident	90.8	Very high	72 Å²	72	59.1 Å²	59.1	47%	0.468	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-64.2	138.1	176.2	26.1	-32.6	0	0	0	111	E442 L443 K444	E442-P450 HydrophobicContact CB-CB 4.28Å; L443-P450 WeakPolarHBondContact O-CA 3.23Å; K444-P450 HydrophobicContact CB-CB 4.39Å
451	V	90.9	Very high	90.9	Very high	76 Å²	76	56.7 Å²	56.7	46%	0.461	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.7	177.2	-179.8	0	0	0	0	108.9	L443 I453	L443-V451 PolarHBondContact N-O 3.39Å; L443-V451 PolarHBondContact O-N 2.94Å; V451-I453 HydrophobicContact CG1-CD1 4.31Å; V451-I453 PolarHBondContact O-N 3.37Å
452	L	93.1	Very high	91.1	Very high	118 Å²	118	56.2 Å²	56.2	62%	0.618	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	120.3	176.7	-171.4	67.9	0	0	0	110.7	P440 E442	P440-L452 HydrophobicContact CB-CD1 3.98Å; P440-L452 HydrophobicContact CB-CG 4.25Å; E442-L452 HydrophobicContact CG-CD1 4.35Å
453	I	93.3	Very high	91.1	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.015	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120.3	176	-58.8	-60.3	0	0	0	109.3	P440 F441 L443 V451 L455 L463	P440-I453 CarbonylContact C-O 3.58Å; P440-I453 VanDerWaalsContact CA-O 3.23Å; P440-I453 WeakPolarHBondContact CA-O 3.45Å; P440-I453 WeakPolarHBondContact CB-O 3.27Å; F441-I453 HydrophobicContact CD2-CB 4.31Å; F441-I453 HydrophobicContact CE1-CB 4.17Å; F441-I453 HydrophobicContact CE1-CG2 3.89Å; F441-I453 HydrophobicContact CE2-CB 3.89Å; F441-I453 HydrophobicContact CE2-CG1 4.18Å; F441-I453 HydrophobicContact CE2-CG2 4.19Å; F441-I453 HydrophobicContact CZ-CB 3.83Å; F441-I453 HydrophobicContact CZ-CG1 4.44Å; F441-I453 HydrophobicContact CZ-CG2 3.62Å; F441-I453 PolarHBondContact N-O 3.3Å; F441-I453 PolarHBondContact O-N 3.45Å; L443-I453 HydrophobicContact CB-CD1 4.46Å; L443-I453 HydrophobicContact CB-CG1 3.61Å; L443-I453 HydrophobicContact CD2-CD1 4.25Å; L443-I453 HydrophobicContact CD2-CG1 4.02Å; L443-I453 HydrophobicContact CG-CG1 4.48Å; V451-I453 HydrophobicContact CG1-CD1 4.31Å; V451-I453 PolarHBondContact O-N 3.37Å; I453-L455 HydrophobicContact CG2-CD2 4.06Å; I453-L455 HydrophobicContact CG2-CG 4.13Å; I453-L463 HydrophobicContact CD1-CD2 4.22Å; I453-L463 HydrophobicContact CG1-CD2 4.44Å; I453-L463 HydrophobicContact CG2-CD2 4.09Å
454	S	91.5	Very high	91.2	Very high	71 Å²	71	50.3 Å²	50.3	50%	0.497	31%	0.309	S	S	.	.			trans	-112.4	132	166.3	173.8	0	0	0	0	109	K476	S454-K476 PolarHBondContact O-NZ 3.36Å
455	L	92.3	Very high	91.3	Very high	9 Å²	9	46.1 Å²	46.1	5%	0.047	29%	0.291	C	S	.	.			trans	-118.9	161.8	171	-48	166.8	0	0	0	108	Q402 A404 F441 I453 N461 K476	Q402-L455 HydrophobicContact CB-CB 4.15Å; Q402-L455 VanDerWaalsContact OE1-CA 3.25Å; Q402-L455 PolarHBondContact OE1-O 3.21Å; A404-L455 HydrophobicContact CB-CD1 4.03Å; F441-L455 HydrophobicContact CE1-CD1 4.22Å; I453-L455 HydrophobicContact CG2-CD2 4.06Å; I453-L455 HydrophobicContact CG2-CG 4.13Å; L455-N461 HydrophobicContact CD1-CB 4.07Å; L455-N461 HydrophobicContact CD2-CB 3.99Å; L455-K476 HydrophobicContact CD2-CD 3.84Å; L455-K476 HydrophobicContact CD2-CG 4.39Å
456	P	90.1	Very high	91.3	Very high	81 Å²	81	45.7 Å²	45.7	53%	0.526	29%	0.289	S	S	.	.			trans	-69.4	141.5	174.1	-16	30.1	0	0	0	111.9	T459	P456-T459 HydrophobicContact CB-CG2 3.86Å; P456-T459 HydrophobicContact CG-CG2 4.42Å; P456-T459 PolarHBondContact O-N 3.17Å; P456-T459 PolarHBondContact O-OG1 3.32Å
457	D	90.6	Very high	91.2	Very high	99 Å²	99	46.8 Å²	46.8	53%	0.529	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	146.8	174	-56.1	-23.2	0	0	0	110.8	S399 T459	S399-D457 WeakPolarHBondContact O-CB 3.33Å; D457-T459 VanDerWaalsContact C-N 3.25Å; D457-T459 PolarHBondContact O-N 3.03Å
458	G	89.4	Confident	91.2	Very high	26 Å²	26	43.2 Å²	43.2	27%	0.268	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	13	-176.1	0	0	0	0	0	114.6	S398 E401	S398-G458 WeakPolarHBondContact O-CA 3.34Å; E401-G458 PolarHBondContact O-N 2.97Å
459	T	91.8	Very high	91.1	Very high	38 Å²	38	47 Å²	47	23%	0.233	29%	0.294	C	S	.	.			trans	-118	149.4	-178.4	71.3	0	0	0	0	113.7	Q403 P456 D457 N461	Q403-T459 PolarHBondContact N-O 3.48Å; P456-T459 HydrophobicContact CB-CG2 3.86Å; P456-T459 HydrophobicContact CG-CG2 4.42Å; P456-T459 PolarHBondContact O-N 3.17Å; P456-T459 PolarHBondContact O-OG1 3.32Å; D457-T459 VanDerWaalsContact C-N 3.25Å; D457-T459 PolarHBondContact O-N 3.03Å; T459-N461 PolarHBondContact OG1-ND2 3.22Å
460	R	94.2	Very high	90.6	Very high	8 Å²	8	45 Å²	45	3%	0.03	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.3	167.7	-71.8	178.8	69.7	179.8	-0.2	108.6	P397 Q403 Y434 D479 V481 D576	P397-R460 HydrophobicContact CG-CG 4.03Å; Q403-R460 HydrophobicContact CB-CG 3.84Å; Q403-R460 VanDerWaalsContact OE1-CG 3.29Å; Y434-R460 HydrophobicContact CD1-CB 4.28Å; Y434-R460 HydrophobicContact CD1-CG 4.3Å; Y434-R460 HydrophobicContact CE1-CB 3.94Å; Y434-R460 HydrophobicContact CE1-CG 4.37Å; Y434-R460 VanDerWaalsContact CZ-NH2 3.32Å; R460-D479 HydrophobicContact CB-CB 3.85Å; R460-D479 PolarHBondContact O-N 3.28Å; R460-V481 HydrophobicContact CB-CG1 4.38Å; R460-V481 HydrophobicContact CG-CG1 4.45Å; R460-D576 PolarHBondContact NH2-O 3Å
461	N	95.1	Very high	90.3	Very high	15 Å²	15	47.2 Å²	47.2	8%	0.08	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.3	179.1	-58.9	-100.6	0	0	0	111.9	Q403 A404 K405 L455 T459 F477 D479	Q403-N461 PolarHBondContact O-N 3.31Å; A404-N461 CarbonylContact C-O 3.59Å; A404-N461 VanDerWaalsContact CA-O 3.25Å; A404-N461 WeakPolarHBondContact CA-O 3.1Å; K405-N461 PolarHBondContact N-O 3.23Å; L455-N461 HydrophobicContact CD1-CB 4.07Å; L455-N461 HydrophobicContact CD2-CB 3.99Å; T459-N461 PolarHBondContact OG1-ND2 3.22Å; N461-F477 CarbonylContact C-O 3.44Å; N461-F477 WeakPolarHBondContact CA-O 3.32Å; N461-F477 WeakPolarHBondContact CB-O 3.25Å; N461-D479 VanDerWaalsContact CA-OD2 3.29Å; N461-D479 WeakPolarHBondContact CA-OD2 3.38Å; N461-D479 PolarHBondContact N-OD2 3.47Å
462	T	95.8	Very high	90.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.7	171.9	-67	0	0	0	0	109.1	K405 I407 V464 F477 D479 R492 M518	K405-T462 CarbonylContact O-C 3.6Å; K405-T462 WeakPolarHBondContact O-CA 3.32Å; I407-T462 HydrophobicContact CD1-CG2 3.46Å; I407-T462 VanDerWaalsContact CD1-CG2 3.46Å; I407-T462 HydrophobicContact CG1-CG2 3.73Å; T462-V464 HydrophobicContact CG2-CG2 4.23Å; T462-F477 PolarHBondContact N-O 3.08Å; T462-F477 PolarHBondContact O-N 2.86Å; T462-D479 PolarHBondContact N-OD2 2.99Å; T462-D479 PolarHBondContact OG1-OD1 3.35Å; T462-D479 PolarHBondContact OG1-OD2 3.34Å; T462-R492 PolarHBondContact OG1-NH2 2.62Å; T462-R492 VanDerWaalsContact OG1-NH2 3.17Å; T462-M518 HydrophobicContact CG2-CE 3.91Å
463	L	95.9	Very high	89.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	110.5	172.5	-71.7	118	0	0	0	109.5	A404 K405 F406 I407 F441 L443 I453 N474 I475 K476	A404-L463 HydrophobicContact CB-CD1 3.67Å; K405-L463 PolarHBondContact O-N 3.24Å; F406-L463 WeakPolarHBondContact CA-O 3.35Å; F406-L463 HydrophobicContact CD1-CB 3.86Å; F406-L463 HydrophobicContact CD1-CD1 4.28Å; F406-L463 HydrophobicContact CE1-CB 4.07Å; F406-L463 HydrophobicContact CE1-CD1 3.72Å; F406-L463 HydrophobicContact CE1-CG 4.37Å; F406-L463 HydrophobicContact CZ-CD1 4.02Å; I407-L463 PolarHBondContact N-O 2.9Å; F441-L463 HydrophobicContact CZ-CD1 4.28Å; L443-L463 HydrophobicContact CD2-CD2 4.49Å; I453-L463 HydrophobicContact CD1-CD2 4.22Å; I453-L463 HydrophobicContact CG1-CD2 4.44Å; I453-L463 HydrophobicContact CG2-CD2 4.09Å; L463-N474 HydrophobicContact CD2-CB 4.29Å; L463-I475 CarbonylContact C-O 3.59Å; L463-I475 WeakPolarHBondContact CA-O 3.21Å; L463-K476 HydrophobicContact CD2-CG 3.89Å; L463-K476 HydrophobicContact CG-CG 4.31Å
464	V	95.6	Very high	89.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.7	176.1	-173.8	0	0	0	0	109.3	I407 M409 T462 L466 N474 I475 F477 F494 M518	I407-V464 HydrophobicContact CB-CG1 4.48Å; I407-V464 HydrophobicContact CB-CG2 4.3Å; I407-V464 HydrophobicContact CD1-CG2 4.42Å; I407-V464 HydrophobicContact CG2-CG1 4.44Å; M409-V464 HydrophobicContact CB-CG1 4.29Å; M409-V464 HydrophobicContact CG-CG1 3.42Å; M409-V464 VanDerWaalsContact CG-CG1 3.42Å; T462-V464 HydrophobicContact CG2-CG2 4.23Å; V464-L466 HydrophobicContact CG1-CD1 4.15Å; V464-L466 HydrophobicContact CG1-CD2 4.3Å; V464-L466 HydrophobicContact CG1-CG 4.03Å; V464-N474 CarbonylContact O-C 3.55Å; V464-N474 VanDerWaalsContact O-CA 3.28Å; V464-N474 WeakPolarHBondContact O-CA 3.19Å; V464-I475 PolarHBondContact N-O 3.47Å; V464-I475 PolarHBondContact O-N 2.94Å; V464-F477 HydrophobicContact CB-CE2 4.18Å; V464-F477 HydrophobicContact CG2-CD2 3.7Å; V464-F477 HydrophobicContact CG2-CE2 3.68Å; V464-F494 HydrophobicContact CB-CE2 4.3Å; V464-F494 HydrophobicContact CG1-CD2 4.49Å; V464-F494 HydrophobicContact CG1-CE1 4.18Å; V464-F494 HydrophobicContact CG1-CE2 3.87Å; V464-F494 HydrophobicContact CG1-CZ 3.7Å; V464-F494 HydrophobicContact CG2-CD2 4.18Å; V464-F494 HydrophobicContact CG2-CE2 4.06Å; V464-M518 HydrophobicContact CG2-CE 3.62Å
465	I	94.7	Very high	89.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123	-178.9	-61.6	166.7	0	0	0	108.9	F406 I407 M409 V410 I414 I416 I445 I472 R473	F406-I465 HydrophobicContact CD1-CD1 4.46Å; I407-I465 PolarHBondContact O-N 3.39Å; M409-I465 WeakPolarHBondContact CA-O 3.23Å; M409-I465 WeakPolarHBondContact CB-O 3.36Å; M409-I465 PolarHBondContact N-O 2.98Å; V410-I465 HydrophobicContact CG2-CG2 4.39Å; I414-I465 HydrophobicContact CD1-CB 4.11Å; I414-I465 HydrophobicContact CD1-CD1 3.74Å; I414-I465 HydrophobicContact CD1-CG2 3.72Å; I416-I465 HydrophobicContact CD1-CD1 3.29Å; I416-I465 HydrophobicContact CG1-CD1 4.06Å; I445-I465 HydrophobicContact CD1-CD1 3.88Å; I445-I465 HydrophobicContact CD1-CG1 3.97Å; I445-I465 HydrophobicContact CD1-CG2 3.84Å; I445-I465 HydrophobicContact CG1-CD1 4.33Å; I465-I472 HydrophobicContact CG2-CG2 3.45Å; I465-I472 VanDerWaalsContact CG2-CG2 3.45Å; I465-R473 WeakPolarHBondContact CA-O 3.5Å
466	L	91.8	Very high	89.8	Confident	12 Å²	12	52.3 Å²	52.3	6%	0.063	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.2	-172.6	-63.8	145.2	0	0	0	109.8	M409 V464 I472 R473 I475 F494 K516	M409-L466 HydrophobicContact CB-CD2 3.53Å; M409-L466 HydrophobicContact CB-CG 4.21Å; M409-L466 HydrophobicContact CG-CD2 3.97Å; V464-L466 HydrophobicContact CG1-CD1 4.15Å; V464-L466 HydrophobicContact CG1-CD2 4.3Å; V464-L466 HydrophobicContact CG1-CG 4.03Å; L466-I472 CarbonylContact O-C 3.52Å; L466-I472 WeakPolarHBondContact O-CA 3.17Å; L466-R473 PolarHBondContact N-O 3.3Å; L466-R473 PolarHBondContact O-N 3.3Å; L466-I475 HydrophobicContact CD1-CB 4.46Å; L466-I475 HydrophobicContact CD1-CD1 3.34Å; L466-I475 HydrophobicContact CD1-CG1 3.76Å; L466-F494 HydrophobicContact CD2-CE1 4.44Å; L466-F494 HydrophobicContact CD2-CZ 4.07Å; L466-K516 HydrophobicContact CD2-CG 4.41Å
467	E	88	Confident	90	Very high	73 Å²	73	49.7 Å²	49.7	34%	0.341	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.3	170.2	-173.5	164	-159	0	0	110	V410 R412	V410-E467 HydrophobicContact CG1-CB 4.41Å; V410-E467 HydrophobicContact CG2-CB 4.27Å; R412-E467 IonicContact CZ-OE2 3.27Å; R412-E467 IonicContact NH1-OE1 3.85Å; R412-E467 IonicContact NH1-OE2 3.47Å; R412-E467 PolarHBondContact NH1-OE2 3.41Å; R412-E467 IonicContact NH2-OE1 3.56Å; R412-E467 IonicContact NH2-OE2 3.97Å; R412-E467 PolarHBondContact NH2-OE2 3.23Å
468	E	82.2	Confident	90.2	Very high	68 Å²	68	47.4 Å²	47.4	32%	0.318	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122.6	175.8	-65.1	-160	137.1	0	0	110.2	G470 Q471 R473 K516	E468-G470 PolarHBondContact O-N 2.9Å; E468-G470 VanDerWaalsContact O-N 3.15Å; E468-Q471 PolarHBondContact N-O 3.15Å; E468-Q471 PolarHBondContact O-N 3.12Å; E468-R473 IonicContact OE2-NH1 2.79Å; E468-K516 WeakPolarHBondContact OE1-CD 3.32Å; E468-K516 IonicContact OE1-NZ 3.31Å; E468-K516 PolarHBondContact OE1-NZ 3.01Å
469	A	80.6	Confident	90.4	Very high	115 Å²	115	46.9 Å²	46.9	95%	0.95	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	35.8	-179.7	0	0	0	0	0	113.7	Q471	A469-Q471 VanDerWaalsContact C-N 3.31Å; A469-Q471 PolarHBondContact O-N 3.08Å
470	G	77.4	Confident	90.4	Very high	60 Å²	60	46.6 Å²	46.6	62%	0.619	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	9.4	-178.9	0	0	0	0	0	115	E468	E468-G470 PolarHBondContact O-N 2.9Å; E468-G470 VanDerWaalsContact O-N 3.15Å
471	Q	83.1	Confident	90.2	Very high	119 Å²	119	49.9 Å²	49.9	56%	0.556	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	133	172.3	-68.7	-173.8	-15.8	0	0	110.9	E468 A469	E468-Q471 PolarHBondContact N-O 3.15Å; E468-Q471 PolarHBondContact O-N 3.12Å; A469-Q471 VanDerWaalsContact C-N 3.31Å; A469-Q471 PolarHBondContact O-N 3.08Å
472	I	86	Confident	89.8	Confident	56 Å²	56	52 Å²	52	29%	0.287	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	129.4	172.9	-59.7	178.5	0	0	0	109.1	I445 I465 L466	I445-I472 HydrophobicContact CB-CG2 4.44Å; I445-I472 HydrophobicContact CD1-CG2 3.71Å; I445-I472 HydrophobicContact CG2-CD1 4Å; I445-I472 HydrophobicContact CG2-CG2 4.14Å; I465-I472 HydrophobicContact CG2-CG2 3.45Å; I465-I472 VanDerWaalsContact CG2-CG2 3.45Å; L466-I472 CarbonylContact O-C 3.52Å; L466-I472 WeakPolarHBondContact O-CA 3.17Å
473	R	87.8	Confident	89.5	Confident	132 Å²	132	53.7 Å²	53.7	50%	0.498	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	159.2	176.9	-66	-175.2	173.9	-166.1	-3.5	110.2	I465 L466 E468	I465-R473 WeakPolarHBondContact CA-O 3.5Å; L466-R473 PolarHBondContact N-O 3.3Å; L466-R473 PolarHBondContact O-N 3.3Å; E468-R473 IonicContact OE2-NH1 2.79Å
474	N	89.8	Confident	89.3	Confident	45 Å²	45	54.6 Å²	54.6	24%	0.241	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	141.7	171.3	63.7	90.8	0	0	0	110.6	L443 L463 V464	L443-N474 HydrophobicContact CD2-CB 4.5Å; L463-N474 HydrophobicContact CD2-CB 4.29Å; V464-N474 CarbonylContact O-C 3.55Å; V464-N474 VanDerWaalsContact O-CA 3.28Å; V464-N474 WeakPolarHBondContact O-CA 3.19Å
475	I	92.6	Very high	88.9	Confident	60 Å²	60	58.8 Å²	58.8	31%	0.308	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.1	171.4	-54.8	178.6	0	0	0	107.7	L463 V464 L466 F477	L463-I475 CarbonylContact C-O 3.59Å; L463-I475 WeakPolarHBondContact CA-O 3.21Å; V464-I475 PolarHBondContact N-O 3.47Å; V464-I475 PolarHBondContact O-N 2.94Å; L466-I475 HydrophobicContact CD1-CB 4.46Å; L466-I475 HydrophobicContact CD1-CD1 3.34Å; L466-I475 HydrophobicContact CD1-CG1 3.76Å; I475-F477 HydrophobicContact CB-CE2 3.95Å; I475-F477 HydrophobicContact CB-CZ 4.27Å; I475-F477 HydrophobicContact CG2-CD2 4.36Å; I475-F477 HydrophobicContact CG2-CE1 4.2Å; I475-F477 HydrophobicContact CG2-CE2 3.55Å; I475-F477 HydrophobicContact CG2-CZ 3.46Å; I475-F477 VanDerWaalsContact CG2-CZ 3.46Å
476	K	93.6	Very high	88.3	Confident	91 Å²	91	62.5 Å²	62.5	40%	0.396	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.6	-176.5	-58.1	172.7	-178.4	-178.4	0	110.1	S454 L455 L463	S454-K476 PolarHBondContact O-NZ 3.36Å; L455-K476 HydrophobicContact CD2-CD 3.84Å; L455-K476 HydrophobicContact CD2-CG 4.39Å; L463-K476 HydrophobicContact CD2-CG 3.89Å; L463-K476 HydrophobicContact CG-CG 4.31Å
477	F	94.6	Very high	87.9	Confident	26 Å²	26	62.1 Å²	62.1	11%	0.114	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.7	174	-62.8	-77.9	0	0	0	109.9	N461 T462 V464 I475 F494 N517 M518	N461-F477 CarbonylContact C-O 3.44Å; N461-F477 WeakPolarHBondContact CA-O 3.32Å; N461-F477 WeakPolarHBondContact CB-O 3.25Å; T462-F477 PolarHBondContact N-O 3.08Å; T462-F477 PolarHBondContact O-N 2.86Å; V464-F477 HydrophobicContact CB-CE2 4.18Å; V464-F477 HydrophobicContact CG2-CD2 3.7Å; V464-F477 HydrophobicContact CG2-CE2 3.68Å; I475-F477 HydrophobicContact CB-CE2 3.95Å; I475-F477 HydrophobicContact CB-CZ 4.27Å; I475-F477 HydrophobicContact CG2-CD2 4.36Å; I475-F477 HydrophobicContact CG2-CE1 4.2Å; I475-F477 HydrophobicContact CG2-CE2 3.55Å; I475-F477 HydrophobicContact CG2-CZ 3.46Å; I475-F477 VanDerWaalsContact CG2-CZ 3.46Å; F477-F494 HydrophobicContact CE2-CD2 4.36Å; F477-F494 HydrophobicContact CE2-CE2 4.02Å; F477-F494 HydrophobicContact CZ-CE2 4.23Å; F477-N517 WeakPolarHBondContact CE1-OD1 3.32Å; F477-M518 HydrophobicContact CB-CE 4.22Å; F477-M518 HydrophobicContact CB-CG 4.45Å; F477-M518 HydrophobicContact CB-SD 3.51Å; F477-M518 VanDerWaalsContact CB-SD 3.51Å; F477-M518 HydrophobicContact CD1-CB 3.84Å; F477-M518 HydrophobicContact CD1-CG 3.79Å; F477-M518 HydrophobicContact CD1-SD 3.99Å; F477-M518 HydrophobicContact CD2-CE 3.67Å; F477-M518 HydrophobicContact CD2-CG 3.94Å; F477-M518 HydrophobicContact CD2-SD 3.72Å; F477-M518 HydrophobicContact CE1-CB 4.01Å; F477-M518 HydrophobicContact CE1-CG 3.99Å; F477-M518 HydrophobicContact CE2-CE 4.29Å; F477-M518 HydrophobicContact CE2-CG 4.09Å; F477-M518 HydrophobicContact CE2-SD 4.44Å; F477-M518 HydrophobicContact CG-CB 4.29Å; F477-M518 HydrophobicContact CG-CE 4.03Å; F477-M518 HydrophobicContact CG-CG 3.77Å; F477-M518 HydrophobicContact CG-SD 3.44Å; F477-M518 WeakPolarHBondContact CG-SD 3.42Å; F477-M518 HydrophobicContact CZ-CG 4.11Å
478	G	93.5	Very high	88	Confident	51 Å²	51	59.5 Å²	59.5	53%	0.526	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.1	173.7	0	0	0	0	0	111.1	R492	G478-R492 PolarHBondContact O-NH1 3.38Å
479	D	93.5	Very high	88.6	Confident	15 Å²	15	56.3 Å²	56.3	8%	0.08	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	164.7	179.6	-53	-35.4	0	0	0	110.8	Y434 R460 N461 T462 V481 R492	Y434-D479 HydrophobicContact CE1-CB 4.44Å; Y434-D479 VanDerWaalsContact CE1-OD2 3.22Å; Y434-D479 WeakPolarHBondContact CE1-OD2 3.47Å; Y434-D479 PolarHBondContact OH-OD2 2.72Å; R460-D479 HydrophobicContact CB-CB 3.85Å; R460-D479 PolarHBondContact O-N 3.28Å; N461-D479 VanDerWaalsContact CA-OD2 3.29Å; N461-D479 WeakPolarHBondContact CA-OD2 3.38Å; N461-D479 PolarHBondContact N-OD2 3.47Å; T462-D479 PolarHBondContact N-OD2 2.99Å; T462-D479 PolarHBondContact OG1-OD1 3.35Å; T462-D479 PolarHBondContact OG1-OD2 3.34Å; D479-V481 PolarHBondContact O-N 2.79Å; D479-R492 IonicContact OD1-CZ 3.34Å; D479-R492 IonicContact OD1-NH1 2.73Å; D479-R492 PolarHBondContact OD1-NH1 3.21Å; D479-R492 IonicContact OD1-NH2 3.18Å; D479-R492 PolarHBondContact OD1-NH2 3.29Å
480	V	91.7	Very high	89.3	Confident	33 Å²	33	50.9 Å²	50.9	20%	0.2	29%	0.288	C	S	.	.			trans	-64.3	132.3	175.7	-70.4	0	0	0	0	111.5	A490 Y521 I577	V480-A490 HydrophobicContact CG1-CB 4.44Å; V480-Y521 HydrophobicContact CG1-CD1 4.33Å; V480-Y521 HydrophobicContact CG1-CD2 3.95Å; V480-Y521 HydrophobicContact CG1-CE1 4.27Å; V480-Y521 HydrophobicContact CG1-CE2 3.89Å; V480-Y521 HydrophobicContact CG1-CG 4.15Å; V480-I577 HydrophobicContact CG2-CD1 3.69Å
481	V	89.9	Confident	90.2	Very high	76 Å²	76	48 Å²	48	46%	0.461	26%	0.259	S	S	.	.	S	Bend	trans	-103.2	7.2	179.7	-63.1	0	0	0	0	113.2	F396 R460 D479	F396-V481 VanDerWaalsContact CD1-C 3.44Å; F396-V481 WeakPolarHBondContact CD1-O 3.48Å; F396-V481 VanDerWaalsContact CE1-O 3.31Å; F396-V481 WeakPolarHBondContact CE1-O 3.38Å; F396-V481 WeakPolarHBondContact CG-O 3.41Å; R460-V481 HydrophobicContact CB-CG1 4.38Å; R460-V481 HydrophobicContact CG-CG1 4.45Å; D479-V481 PolarHBondContact O-N 2.79Å
482	A	88.2	Confident	90.8	Very high	60 Å²	60	42.6 Å²	42.6	50%	0.496	23%	0.233	S	C	.	.	S	Bend	trans	-141.6	156.2	173.7	0	0	0	0	0	109.2
483	K	89.6	Confident	91.3	Very high	35 Å²	35	39.9 Å²	39.9	15%	0.152	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-69.3	139.6	172.4	-163.3	166	-162.1	164.6	0	108.9	L393 E485 G550 I577 K578 N580	L393-K483 HydrophobicContact CD2-CD 3.9Å; K483-E485 PolarHBondContact O-N 3.26Å; K483-G550 WeakPolarHBondContact CE-O 3.49Å; K483-G550 WeakPolarHBondContact CG-O 3.41Å; K483-I577 HydrophobicContact CD-CG2 4.49Å; K483-I577 HydrophobicContact CG-CG2 4.23Å; K483-K578 PolarHBondContact NZ-O 3.38Å; K483-N580 WeakPolarHBondContact CE-OD1 3.45Å; K483-N580 PolarHBondContact NZ-OD1 2.94Å
484	P	90.4	Very high	91.7	Very high	19 Å²	19	33.6 Å²	33.6	12%	0.123	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-56.2	139.3	177.8	-26.5	35.8	0	0	0	112	A488 A490 S551	P484-A488 WeakPolarHBondContact CB-O 3.45Å; P484-A490 HydrophobicContact CB-CB 4.45Å; P484-A490 HydrophobicContact CG-CB 3.61Å; P484-S551 WeakPolarHBondContact CG-O 3.46Å
485	E	86.9	Confident	91.9	Very high	88 Å²	88	31.5 Å²	31.5	41%	0.411	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-73.6	159.1	-176.8	-65.7	-172.3	162.2	0	0	111.4	Y50 K53 K483 G487 A488	Y50-E485 HydrophobicContact CD1-CB 4.29Å; Y50-E485 HydrophobicContact CD1-CG 4.5Å; Y50-E485 WeakPolarHBondContact CD1-OE2 3Å; Y50-E485 HydrophobicContact CE1-CB 3.78Å; Y50-E485 HydrophobicContact CE1-CG 4.04Å; K53-E485 IonicContact NZ-OE2 2.75Å; K53-E485 PolarHBondContact NZ-OE2 3.24Å; K483-E485 PolarHBondContact O-N 3.26Å; E485-G487 PolarHBondContact O-N 3.06Å; E485-A488 WeakPolarHBondContact O-CB 3.41Å; E485-A488 PolarHBondContact O-N 2.88Å
486	E	83.3	Confident	91.9	Very high	78 Å²	78	29 Å²	29	36%	0.364	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	58.2	19	170.6	-56.1	179.5	-154	0	0	115.6	Y50 Q203 A488	Y50-E486 HydrophobicContact CD1-CG 4.05Å; Y50-E486 HydrophobicContact CD2-CG 3.86Å; Y50-E486 HydrophobicContact CE1-CG 3.86Å; Y50-E486 HydrophobicContact CE2-CG 3.61Å; Y50-E486 HydrophobicContact CG-CG 4.06Å; Q203-E486 PolarHBondContact NE2-OE2 2.94Å; Q203-E486 PolarHBondContact OE1-OE2 3.44Å; E486-A488 PolarHBondContact O-N 2.93Å
487	G	83.1	Confident	91.6	Very high	5 Å²	5	26 Å²	26	5%	0.052	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	75.1	8.8	-177.8	0	0	0	0	0	114.3	E485 F549 G550	E485-G487 PolarHBondContact O-N 3.06Å; G487-F549 WeakPolarHBondContact O-CA 3.3Å; G487-G550 PolarHBondContact O-N 3.35Å; G487-G550 VanDerWaalsContact O-N 3.11Å
488	A	90.4	Very high	91.2	Very high	18 Å²	18	28 Å²	28	15%	0.149	19%	0.189	C	C	.	.			trans	-62.8	168.7	171.5	0	0	0	0	0	111.6	P484 E485 E486 D523 G550	P484-A488 WeakPolarHBondContact CB-O 3.45Å; E485-A488 WeakPolarHBondContact O-CB 3.41Å; E485-A488 PolarHBondContact O-N 2.88Å; E486-A488 PolarHBondContact O-N 2.93Å; A488-D523 HydrophobicContact CB-CB 4.09Å; A488-G550 WeakPolarHBondContact O-CA 3.48Å; A488-G550 PolarHBondContact O-N 3.23Å; A488-G550 VanDerWaalsContact O-N 3.07Å
489	N	94.2	Very high	91.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	118.2	179.4	-56.1	-77	0	0	0	109.7	I491 V524 F547 G548 G550 S551	N489-I491 HydrophobicContact CB-CD1 4.17Å; N489-I491 PolarHBondContact O-N 3.31Å; N489-V524 WeakPolarHBondContact CB-O 3.35Å; N489-V524 PolarHBondContact N-O 2.91Å; N489-V524 PolarHBondContact ND2-O 3.47Å; N489-V524 PolarHBondContact O-N 3.41Å; N489-F547 HydrophobicContact CB-CB 4.33Å; N489-F547 HydrophobicContact CB-CG 4.4Å; N489-F547 WeakPolarHBondContact ND2-CB 3.14Å; N489-G548 PolarHBondContact ND2-O 2.67Å; N489-G548 PolarHBondContact OD1-O 2.94Å; N489-G548 VanDerWaalsContact OD1-O 3.08Å; N489-G550 PolarHBondContact OD1-N 2.83Å; N489-S551 CarbonylContact C-O 3.56Å; N489-S551 WeakPolarHBondContact CA-O 3.08Å; N489-S551 WeakPolarHBondContact OD1-CB 3.2Å; N489-S551 PolarHBondContact OD1-N 3.42Å; N489-S551 PolarHBondContact OD1-OG 3.32Å
490	A	95.3	Very high	91	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.017	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	108.1	-179.4	0	0	0	0	0	109.6	V480 P484 Y521 S551 S552 Y553	V480-A490 HydrophobicContact CG1-CB 4.44Å; P484-A490 HydrophobicContact CB-CB 4.45Å; P484-A490 HydrophobicContact CG-CB 3.61Å; A490-Y521 HydrophobicContact CB-CD1 3.82Å; A490-Y521 HydrophobicContact CB-CE1 4.37Å; A490-S551 PolarHBondContact N-O 3.49Å; A490-S552 VanDerWaalsContact O-CA 3.24Å; A490-S552 WeakPolarHBondContact O-CA 3.41Å; A490-S552 PolarHBondContact O-OG 2.92Å; A490-Y553 PolarHBondContact O-N 3.26Å
491	I	96.5	Very high	91	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.1	-177	-53.4	-54.7	0	0	0	109.7	N489 F493 F510 Y521 V522 V524 F531 F547 Y553 F555	N489-I491 HydrophobicContact CB-CD1 4.17Å; N489-I491 PolarHBondContact O-N 3.31Å; I491-F493 HydrophobicContact CG2-CD2 4.41Å; I491-F493 HydrophobicContact CG2-CE2 3.83Å; I491-F493 HydrophobicContact CG2-CZ 4.46Å; I491-F510 HydrophobicContact CB-CE1 4.09Å; I491-F510 HydrophobicContact CB-CZ 4.14Å; I491-F510 HydrophobicContact CG2-CE1 4Å; I491-F510 HydrophobicContact CG2-CZ 4.02Å; I491-F510 WeakPolarHBondContact O-CE1 3.42Å; I491-Y521 CarbonylContact O-C 3.51Å; I491-Y521 VanDerWaalsContact O-CA 3.3Å; I491-Y521 WeakPolarHBondContact O-CA 3.38Å; I491-V522 PolarHBondContact N-O 3.33Å; I491-V522 PolarHBondContact O-N 2.99Å; I491-V524 HydrophobicContact CB-CG2 4.05Å; I491-V524 HydrophobicContact CG1-CB 3.9Å; I491-V524 HydrophobicContact CG1-CG2 3.56Å; I491-F531 HydrophobicContact CG1-CZ 4.42Å; I491-F531 HydrophobicContact CG2-CE1 4.14Å; I491-F531 HydrophobicContact CG2-CZ 4.11Å; I491-F547 HydrophobicContact CD1-CD1 4.06Å; I491-F547 HydrophobicContact CD1-CE1 3.45Å; I491-F547 VanDerWaalsContact CD1-CE1 3.45Å; I491-F547 HydrophobicContact CD1-CE2 4.27Å; I491-F547 HydrophobicContact CD1-CZ 3.58Å; I491-F547 HydrophobicContact CG1-CE1 4.44Å; I491-F547 HydrophobicContact CG1-CE2 4.46Å; I491-F547 HydrophobicContact CG1-CZ 4.11Å; I491-Y553 HydrophobicContact CD1-CD2 4.03Å; I491-Y553 HydrophobicContact CD1-CG 4.47Å; I491-F555 HydrophobicContact CD1-CE2 4.35Å; I491-F555 HydrophobicContact CG2-CD2 3.63Å; I491-F555 HydrophobicContact CG2-CE2 3.56Å
492	R	95.9	Very high	91.2	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.015	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	162.2	165.6	66.5	170.8	-177.3	-165.5	-3.3	111.6	T462 G478 D479 M518 S519 Y521 Y553 T554 F555 D576	T462-R492 PolarHBondContact OG1-NH2 2.62Å; T462-R492 VanDerWaalsContact OG1-NH2 3.17Å; G478-R492 PolarHBondContact O-NH1 3.38Å; D479-R492 IonicContact OD1-CZ 3.34Å; D479-R492 IonicContact OD1-NH1 2.73Å; D479-R492 PolarHBondContact OD1-NH1 3.21Å; D479-R492 IonicContact OD1-NH2 3.18Å; D479-R492 PolarHBondContact OD1-NH2 3.29Å; R492-M518 PolarHBondContact NH1-SD 3.44Å; R492-M518 VanDerWaalsContact NH1-SD 3.43Å; R492-S519 WeakPolarHBondContact CA-OG 3.4Å; R492-Y521 HydrophobicContact CB-CD1 3.92Å; R492-Y521 HydrophobicContact CB-CE1 4.07Å; R492-Y521 HydrophobicContact CB-CG 4.35Å; R492-Y521 VanDerWaalsContact CD-CZ 3.43Å; R492-Y521 HydrophobicContact CG-CD1 4.03Å; R492-Y521 HydrophobicContact CG-CE1 3.63Å; R492-Y521 PolarHBondContact NE-OH 3.08Å; R492-Y521 PolarHBondContact NH1-OH 3.32Å; R492-Y553 PolarHBondContact N-O 3.17Å; R492-T554 HydrophobicContact CG-CG2 4.14Å; R492-T554 PolarHBondContact NE-OG1 3.43Å; R492-T554 PolarHBondContact NH2-OG1 2.95Å; R492-T554 VanDerWaalsContact NH2-OG1 3.09Å; R492-T554 CarbonylContact O-C 3.51Å; R492-T554 WeakPolarHBondContact O-CA 3.41Å; R492-F555 PolarHBondContact O-N 3.37Å; R492-D576 IonicContact NH2-OD2 2.72Å
493	F	96.3	Very high	91.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.2	178.9	-71.5	-99.1	0	0	0	111.1	I491 I503 F510 I513 M518 S519 F531 F555 I557	I491-F493 HydrophobicContact CG2-CD2 4.41Å; I491-F493 HydrophobicContact CG2-CE2 3.83Å; I491-F493 HydrophobicContact CG2-CZ 4.46Å; F493-I503 HydrophobicContact CB-CD1 3.78Å; F493-I503 HydrophobicContact CD1-CD1 3.53Å; F493-I503 HydrophobicContact CD2-CD1 3.97Å; F493-I503 HydrophobicContact CD2-CG2 4.2Å; F493-I503 HydrophobicContact CE1-CD1 4.09Å; F493-I503 HydrophobicContact CE2-CD1 4.48Å; F493-I503 HydrophobicContact CE2-CG2 3.89Å; F493-I503 HydrophobicContact CG-CD1 3.48Å; F493-I503 VanDerWaalsContact CG-CD1 3.48Å; F493-I503 HydrophobicContact CZ-CG2 4.08Å; F493-F510 AromaticContact CD2-CD1 3.83Å; F493-F510 HydrophobicContact CD2-CD1 3.83Å; F493-F510 HydrophobicContact CD2-CD2 4.49Å; F493-F510 AromaticContact CD2-CE1 3.85Å; F493-F510 HydrophobicContact CD2-CE1 3.85Å; F493-F510 HydrophobicContact CD2-CG 4.17Å; F493-F510 HydrophobicContact CD2-CZ 4.23Å; F493-F510 HydrophobicContact CE2-CD1 4.22Å; F493-F510 HydrophobicContact CE2-CD2 4.36Å; F493-F510 AromaticContact CE2-CE1 3.86Å; F493-F510 HydrophobicContact CE2-CE1 3.86Å; F493-F510 HydrophobicContact CE2-CE2 4.03Å; F493-F510 HydrophobicContact CE2-CG 4.46Å; F493-F510 AromaticContact CE2-CZ 3.78Å; F493-F510 HydrophobicContact CE2-CZ 3.78Å; F493-I513 HydrophobicContact CB-CD1 3.76Å; F493-M518 CarbonylContact O-C 3.57Å; F493-M518 VanDerWaalsContact O-CA 3.3Å; F493-M518 WeakPolarHBondContact O-CA 3.48Å; F493-S519 PolarHBondContact N-OG 3.06Å; F493-S519 PolarHBondContact O-N 3.2Å; F493-F531 AromaticContact CE2-CD1 3.85Å; F493-F531 HydrophobicContact CE2-CD1 3.85Å; F493-F531 HydrophobicContact CE2-CE1 4.02Å; F493-F531 HydrophobicContact CE2-CG 4.46Å; F493-F531 HydrophobicContact CZ-CB 4.29Å; F493-F531 AromaticContact CZ-CD1 3.72Å; F493-F531 HydrophobicContact CZ-CD1 3.72Å; F493-F531 HydrophobicContact CZ-CD2 4.38Å; F493-F531 HydrophobicContact CZ-CE1 4.12Å; F493-F531 AromaticContact CZ-CG 3.87Å; F493-F531 HydrophobicContact CZ-CG 3.87Å; F493-F555 CarbonylContact C-O 3.6Å; F493-F555 VanDerWaalsContact CA-O 3.29Å; F493-F555 WeakPolarHBondContact CA-O 3.43Å; F493-F555 HydrophobicContact CD1-CB 3.42Å; F493-F555 VanDerWaalsContact CD1-CB 3.42Å; F493-F555 HydrophobicContact CD1-CD2 4.39Å; F493-F555 HydrophobicContact CD1-CG 4.29Å; F493-F555 HydrophobicContact CE1-CB 3.45Å; F493-F555 VanDerWaalsContact CE1-CB 3.45Å; F493-F555 AromaticContact CE1-CD2 3.81Å; F493-F555 HydrophobicContact CE1-CD2 3.81Å; F493-F555 AromaticContact CE1-CG 3.85Å; F493-F555 HydrophobicContact CE1-CG 3.85Å; F493-F555 HydrophobicContact CE2-CD2 4.1Å; F493-F555 HydrophobicContact CG-CB 4.12Å; F493-F555 HydrophobicContact CZ-CB 4.17Å; F493-F555 AromaticContact CZ-CD2 3.64Å; F493-F555 HydrophobicContact CZ-CD2 3.64Å; F493-F555 HydrophobicContact CZ-CE2 4.42Å; F493-F555 HydrophobicContact CZ-CG 4.17Å; F493-I557 HydrophobicContact CD1-CD1 4.13Å; F493-I557 HydrophobicContact CD1-CG1 4.38Å
494	F	96	Very high	91.7	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.8	165.5	-178.6	-93.1	0	0	0	109.5	M409 V464 L466 F477 G496 K516 M518 F555 I557	M409-F494 HydrophobicContact CE-CD1 4.04Å; M409-F494 HydrophobicContact CE-CE1 3.77Å; M409-F494 HydrophobicContact CG-CD1 4.23Å; M409-F494 HydrophobicContact CG-CE1 3.67Å; M409-F494 HydrophobicContact CG-CZ 4.26Å; M409-F494 HydrophobicContact SD-CD1 3.83Å; M409-F494 HydrophobicContact SD-CE1 3.78Å; V464-F494 HydrophobicContact CB-CE2 4.3Å; V464-F494 HydrophobicContact CG1-CD2 4.49Å; V464-F494 HydrophobicContact CG1-CE1 4.18Å; V464-F494 HydrophobicContact CG1-CE2 3.87Å; V464-F494 HydrophobicContact CG1-CZ 3.7Å; V464-F494 HydrophobicContact CG2-CD2 4.18Å; V464-F494 HydrophobicContact CG2-CE2 4.06Å; L466-F494 HydrophobicContact CD2-CE1 4.44Å; L466-F494 HydrophobicContact CD2-CZ 4.07Å; F477-F494 HydrophobicContact CE2-CD2 4.36Å; F477-F494 HydrophobicContact CE2-CE2 4.02Å; F477-F494 HydrophobicContact CZ-CE2 4.23Å; F494-G496 PolarHBondContact O-N 2.82Å; F494-K516 HydrophobicContact CZ-CB 4.47Å; F494-M518 HydrophobicContact CB-CE 4.37Å; F494-M518 HydrophobicContact CB-CG 4.18Å; F494-M518 HydrophobicContact CD2-CE 4.03Å; F494-M518 HydrophobicContact CD2-CG 3.6Å; F494-M518 HydrophobicContact CG-CG 4.39Å; F494-F555 PolarHBondContact N-O 3.21Å; F494-I557 PolarHBondContact O-N 2.96Å
495	N	94.8	Very high	91.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	93.5	-179	-178.2	12.7	0	0	0	111.4	F497 M499 L501 I513 S515 K516 N517	N495-F497 VanDerWaalsContact C-N 3.31Å; N495-F497 WeakPolarHBondContact OD1-CA 3.33Å; N495-F497 WeakPolarHBondContact OD1-CB 3.44Å; N495-F497 PolarHBondContact OD1-N 2.71Å; N495-F497 PolarHBondContact OD1-O 3.32Å; N495-M499 PolarHBondContact ND2-O 3.25Å; N495-L501 WeakPolarHBondContact OD1-CD1 3.48Å; N495-I513 HydrophobicContact CB-CB 4.1Å; N495-I513 HydrophobicContact CB-CG2 3.49Å; N495-I513 VanDerWaalsContact CB-CG2 3.49Å; N495-I513 PolarHBondContact ND2-O 3.23Å; N495-S515 CarbonylContact O-C 3.57Å; N495-K516 WeakPolarHBondContact O-CA 3.37Å; N495-K516 PolarHBondContact O-N 3.47Å; N495-N517 PolarHBondContact N-O 3.5Å
496	G	91.4	Very high	91.8	Very high	9 Å²	9	26.3 Å²	26.3	9%	0.093	18%	0.179	C	C	.	.			trans	-83.5	-3.6	167.8	0	0	0	0	0	114	F494 I557 P559	F494-G496 PolarHBondContact O-N 2.82Å; G496-I557 CarbonylContact C-O 3.53Å; G496-I557 WeakPolarHBondContact CA-O 3.44Å; G496-I557 PolarHBondContact N-O 3.32Å; G496-P559 WeakPolarHBondContact O-CA 3.38Å
497	F	88.3	Confident	91.8	Very high	28 Å²	28	32 Å²	32	12%	0.123	21%	0.206	C	C	.	.	S	Bend	trans	-71.5	144.2	177.9	-173.3	-116.4	0	0	0	110.3	N495 M499 L501 S515 I557 F561 L563	N495-F497 VanDerWaalsContact C-N 3.31Å; N495-F497 WeakPolarHBondContact OD1-CA 3.33Å; N495-F497 WeakPolarHBondContact OD1-CB 3.44Å; N495-F497 PolarHBondContact OD1-N 2.71Å; N495-F497 PolarHBondContact OD1-O 3.32Å; F497-M499 HydrophobicContact CD1-CB 3.95Å; F497-M499 HydrophobicContact CE1-CB 3.81Å; F497-M499 HydrophobicContact CE1-CE 3.41Å; F497-M499 VanDerWaalsContact CE1-CE 3.41Å; F497-M499 HydrophobicContact CE1-CG 4.23Å; F497-M499 HydrophobicContact CZ-CE 3.58Å; F497-M499 PolarHBondContact O-N 2.93Å; F497-L501 HydrophobicContact CB-CD1 3.94Å; F497-L501 HydrophobicContact CB-CG 4.47Å; F497-L501 HydrophobicContact CD1-CD1 4.19Å; F497-L501 HydrophobicContact CD1-CD2 3.67Å; F497-L501 HydrophobicContact CD1-CG 3.97Å; F497-L501 HydrophobicContact CE1-CD2 4.01Å; F497-L501 HydrophobicContact CG-CD1 4.39Å; F497-S515 VanDerWaalsContact O-CB 3.26Å; F497-S515 WeakPolarHBondContact O-CB 3.23Å; F497-S515 PolarHBondContact O-OG 3.07Å; F497-I557 HydrophobicContact CB-CG2 4.1Å; F497-F561 HydrophobicContact CD2-CB 4.34Å; F497-F561 HydrophobicContact CD2-CD1 4.14Å; F497-F561 HydrophobicContact CE2-CD1 4.44Å; F497-F561 WeakPolarHBondContact CE2-O 3.49Å; F497-L563 HydrophobicContact CE1-CD1 4.13Å; F497-L563 HydrophobicContact CZ-CD1 3.99Å
498	G	86.7	Confident	91.9	Very high	68 Å²	68	37.2 Å²	37.2	70%	0.701	23%	0.228	S	C	*	.	S	Bend	trans	-68.8	-1.6	-173.9	0	0	0	0	0	115.6
499	M	89.9	Confident	91.8	Very high	84 Å²	84	38.2 Å²	38.2	41%	0.414	24%	0.241	S	C	.	.	S	Bend	trans	-129.3	163.6	179.7	-59.8	-169.9	-68.9	0	0	111.2	N495 F497 N535	N495-M499 PolarHBondContact ND2-O 3.25Å; F497-M499 HydrophobicContact CD1-CB 3.95Å; F497-M499 HydrophobicContact CE1-CB 3.81Å; F497-M499 HydrophobicContact CE1-CE 3.41Å; F497-M499 VanDerWaalsContact CE1-CE 3.41Å; F497-M499 HydrophobicContact CE1-CG 4.23Å; F497-M499 HydrophobicContact CZ-CE 3.58Å; F497-M499 PolarHBondContact O-N 2.93Å; M499-N535 HydrophobicContact CE-CB 4.34Å
500	V	92.1	Very high	91.7	Very high	59 Å²	59	38.5 Å²	38.5	36%	0.358	24%	0.242	S	C	.	.			trans	-65.5	133.7	173.6	-176.6	0	0	0	0	109.9	N512 I513 I514	V500-N512 HydrophobicContact CG1-CB 3.86Å; V500-I513 WeakPolarHBondContact CA-O 3.48Å; V500-I514 HydrophobicContact CG2-CG2 4.26Å
501	L	92.7	Very high	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.5	175.5	-65.5	178.3	0	0	0	110.1	N495 F497 I503 I513 I533 K534 N535 I557	N495-L501 WeakPolarHBondContact OD1-CD1 3.48Å; F497-L501 HydrophobicContact CB-CD1 3.94Å; F497-L501 HydrophobicContact CB-CG 4.47Å; F497-L501 HydrophobicContact CD1-CD1 4.19Å; F497-L501 HydrophobicContact CD1-CD2 3.67Å; F497-L501 HydrophobicContact CD1-CG 3.97Å; F497-L501 HydrophobicContact CE1-CD2 4.01Å; F497-L501 HydrophobicContact CG-CD1 4.39Å; L501-I503 HydrophobicContact CB-CG1 4.5Å; L501-I513 PolarHBondContact N-O 3.18Å; L501-I513 PolarHBondContact O-N 2.98Å; L501-I533 HydrophobicContact CD1-CG2 4.21Å; L501-I533 HydrophobicContact CD2-CG2 4.14Å; L501-K534 CarbonylContact C-O 3.51Å; L501-K534 WeakPolarHBondContact CA-O 3.41Å; L501-N535 HydrophobicContact CD2-CB 4.13Å; L501-I557 HydrophobicContact CD1-CD1 3.52Å; L501-I557 HydrophobicContact CD1-CG2 4.02Å
502	N	93.5	Very high	90.9	Very high	63 Å²	63	45.8 Å²	45.8	34%	0.337	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.9	169.8	-175.5	-7.8	0	0	0	107.8	K534	N502-K534 PolarHBondContact N-O 3Å; N502-K534 PolarHBondContact O-N 3.24Å
503	I	93.8	Very high	90.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134	-176.8	-52.4	-176.9	0	0	0	108.4	F493 L501 F510 I513 F531 L532 I533 I557	F493-I503 HydrophobicContact CB-CD1 3.78Å; F493-I503 HydrophobicContact CD1-CD1 3.53Å; F493-I503 HydrophobicContact CD2-CD1 3.97Å; F493-I503 HydrophobicContact CD2-CG2 4.2Å; F493-I503 HydrophobicContact CE1-CD1 4.09Å; F493-I503 HydrophobicContact CE2-CD1 4.48Å; F493-I503 HydrophobicContact CE2-CG2 3.89Å; F493-I503 HydrophobicContact CG-CD1 3.48Å; F493-I503 VanDerWaalsContact CG-CD1 3.48Å; F493-I503 HydrophobicContact CZ-CG2 4.08Å; L501-I503 HydrophobicContact CB-CG1 4.5Å; I503-F510 HydrophobicContact CB-CB 4.16Å; I503-F510 HydrophobicContact CB-CD2 4.07Å; I503-F510 HydrophobicContact CB-CG 4.35Å; I503-F510 HydrophobicContact CG2-CD2 3.8Å; I503-F510 HydrophobicContact CG2-CE2 4.27Å; I503-F510 HydrophobicContact CG2-CG 4.42Å; I503-F510 WeakPolarHBondContact O-CD2 3.5Å; I503-F510 PolarHBondContact O-N 2.81Å; I503-I513 HydrophobicContact CB-CD1 4.44Å; I503-I513 HydrophobicContact CD1-CD1 3.6Å; I503-I513 HydrophobicContact CG1-CD1 3.95Å; I503-F531 HydrophobicContact CG2-CB 4.37Å; I503-F531 HydrophobicContact CG2-CD1 4.49Å; I503-L532 WeakPolarHBondContact CA-O 3.42Å; I503-I533 HydrophobicContact CD1-CG1 4.23Å; I503-I533 HydrophobicContact CG1-CB 4.47Å; I503-I533 HydrophobicContact CG1-CG1 4.11Å; I503-I533 HydrophobicContact CG1-CG2 4.22Å; I503-I533 HydrophobicContact CG2-CG1 4.19Å; I503-I557 HydrophobicContact CD1-CD1 3.77Å
504	T	93.5	Very high	90.6	Very high	41 Å²	41	50.1 Å²	50.1	25%	0.252	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.9	178.1	58.1	0	0	0	0	111.1	E508 F531 L532	T504-E508 CarbonylContact C-O 3.48Å; T504-E508 VanDerWaalsContact CA-O 3.25Å; T504-E508 WeakPolarHBondContact CA-O 3.27Å; T504-E508 WeakPolarHBondContact CB-O 3.45Å; T504-F531 WeakPolarHBondContact O-CA 3.47Å; T504-L532 PolarHBondContact N-O 3.35Å; T504-L532 PolarHBondContact O-N 2.83Å
505	V	93.1	Very high	90.4	Very high	19 Å²	19	52.2 Å²	52.2	12%	0.115	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	108.8	172.8	60.6	0	0	0	0	108.7	E507 E508 F510 V522 V524 A529 F531	V505-E507 PolarHBondContact O-N 3.16Å; V505-E507 VanDerWaalsContact O-N 3.17Å; V505-E508 HydrophobicContact CG1-CB 4.03Å; V505-E508 PolarHBondContact N-O 2.95Å; V505-E508 PolarHBondContact O-N 2.92Å; V505-F510 HydrophobicContact CB-CE2 4.12Å; V505-F510 HydrophobicContact CG1-CE2 3.63Å; V505-F510 HydrophobicContact CG1-CZ 4.11Å; V505-V522 HydrophobicContact CG1-CG1 4.4Å; V505-V524 HydrophobicContact CG1-CG2 3.98Å; V505-V524 HydrophobicContact CG2-CG1 4.27Å; V505-V524 HydrophobicContact CG2-CG2 4.48Å; V505-A529 HydrophobicContact CG2-CB 4.11Å; V505-F531 HydrophobicContact CB-CD1 3.79Å; V505-F531 HydrophobicContact CB-CE1 3.83Å; V505-F531 HydrophobicContact CG1-CE1 4.27Å; V505-F531 HydrophobicContact CG2-CD1 4.15Å; V505-F531 HydrophobicContact CG2-CE1 3.94Å; V505-F531 HydrophobicContact CG2-CZ 4.48Å
506	G	87.2	Confident	90.2	Very high	74 Å²	74	55.8 Å²	55.8	76%	0.763	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-119.2	-169.5	0	0	0	0	0	111.8
507	E	82.6	Confident	90.4	Very high	199 Å²	199	58.1 Å²	58.1	93%	0.93	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-12.9	177.5	-62.3	-175.1	167.6	0	0	113.3	V505	V505-E507 PolarHBondContact O-N 3.16Å; V505-E507 VanDerWaalsContact O-N 3.17Å
508	E	86.1	Confident	90.6	Very high	114 Å²	114	57.6 Å²	57.6	53%	0.533	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	141.3	-177.5	-64.2	-63.5	157.8	0	0	111.4	T504 V505 V522	T504-E508 CarbonylContact C-O 3.48Å; T504-E508 VanDerWaalsContact CA-O 3.25Å; T504-E508 WeakPolarHBondContact CA-O 3.27Å; T504-E508 WeakPolarHBondContact CB-O 3.45Å; V505-E508 HydrophobicContact CG1-CB 4.03Å; V505-E508 PolarHBondContact N-O 2.95Å; V505-E508 PolarHBondContact O-N 2.92Å; E508-V522 HydrophobicContact CB-CG1 3.85Å; E508-V522 HydrophobicContact CG-CG1 4.37Å
509	G	88.7	Confident	91	Very high	39 Å²	39	55 Å²	55	40%	0.402	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.5	-179.2	0	0	0	0	0	112.6	G511	G509-G511 PolarHBondContact O-N 3.2Å
510	F	91.8	Very high	91.1	Very high	5 Å²	5	55.8 Å²	55.8	2%	0.022	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	6.1	175.2	-67.6	-96.1	0	0	0	112.9	I491 F493 I503 V505 I513 V522 F531	I491-F510 HydrophobicContact CB-CE1 4.09Å; I491-F510 HydrophobicContact CB-CZ 4.14Å; I491-F510 HydrophobicContact CG2-CE1 4Å; I491-F510 HydrophobicContact CG2-CZ 4.02Å; I491-F510 WeakPolarHBondContact O-CE1 3.42Å; F493-F510 AromaticContact CD2-CD1 3.83Å; F493-F510 HydrophobicContact CD2-CD1 3.83Å; F493-F510 HydrophobicContact CD2-CD2 4.49Å; F493-F510 AromaticContact CD2-CE1 3.85Å; F493-F510 HydrophobicContact CD2-CE1 3.85Å; F493-F510 HydrophobicContact CD2-CG 4.17Å; F493-F510 HydrophobicContact CD2-CZ 4.23Å; F493-F510 HydrophobicContact CE2-CD1 4.22Å; F493-F510 HydrophobicContact CE2-CD2 4.36Å; F493-F510 AromaticContact CE2-CE1 3.86Å; F493-F510 HydrophobicContact CE2-CE1 3.86Å; F493-F510 HydrophobicContact CE2-CE2 4.03Å; F493-F510 HydrophobicContact CE2-CG 4.46Å; F493-F510 AromaticContact CE2-CZ 3.78Å; F493-F510 HydrophobicContact CE2-CZ 3.78Å; I503-F510 HydrophobicContact CB-CB 4.16Å; I503-F510 HydrophobicContact CB-CD2 4.07Å; I503-F510 HydrophobicContact CB-CG 4.35Å; I503-F510 HydrophobicContact CG2-CD2 3.8Å; I503-F510 HydrophobicContact CG2-CE2 4.27Å; I503-F510 HydrophobicContact CG2-CG 4.42Å; I503-F510 WeakPolarHBondContact O-CD2 3.5Å; I503-F510 PolarHBondContact O-N 2.81Å; V505-F510 HydrophobicContact CB-CE2 4.12Å; V505-F510 HydrophobicContact CG1-CE2 3.63Å; V505-F510 HydrophobicContact CG1-CZ 4.11Å; F510-I513 HydrophobicContact CB-CD1 4.3Å; F510-V522 HydrophobicContact CD1-CB 4.04Å; F510-V522 HydrophobicContact CD1-CG2 3.56Å; F510-V522 HydrophobicContact CD2-CG2 4.41Å; F510-V522 HydrophobicContact CE1-CB 3.57Å; F510-V522 HydrophobicContact CE1-CG2 3.66Å; F510-V522 HydrophobicContact CE2-CB 4.41Å; F510-V522 HydrophobicContact CE2-CG2 4.48Å; F510-V522 HydrophobicContact CG-CG2 3.97Å; F510-V522 HydrophobicContact CZ-CB 3.76Å; F510-V522 HydrophobicContact CZ-CG1 4.29Å; F510-V522 HydrophobicContact CZ-CG2 4.11Å; F510-F531 AromaticContact CE2-CD1 3.91Å; F510-F531 HydrophobicContact CE2-CD1 3.91Å; F510-F531 AromaticContact CE2-CE1 3.9Å; F510-F531 HydrophobicContact CE2-CE1 3.9Å; F510-F531 HydrophobicContact CZ-CD1 4.21Å; F510-F531 AromaticContact CZ-CE1 3.77Å; F510-F531 HydrophobicContact CZ-CE1 3.77Å
511	G	84.9	Confident	91.2	Very high	39 Å²	39	55.7 Å²	55.7	40%	0.402	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	72.8	-175.6	-173	0	0	0	0	0	113.7	G509 I513	G509-G511 PolarHBondContact O-N 3.2Å; G511-I513 PolarHBondContact O-N 3.45Å
512	N	89.3	Confident	91.2	Very high	116 Å²	116	56.4 Å²	56.4	62%	0.62	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	101.8	174.6	-71.9	-41	0	0	0	109.5	V500 I514	V500-N512 HydrophobicContact CG1-CB 3.86Å; N512-I514 PolarHBondContact O-N 2.9Å
513	I	92.9	Very high	91.1	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	109.5	-177.1	-43.2	170.8	0	0	0	108.5	F493 N495 V500 L501 I503 F510 G511	F493-I513 HydrophobicContact CB-CD1 3.76Å; N495-I513 HydrophobicContact CB-CB 4.1Å; N495-I513 HydrophobicContact CB-CG2 3.49Å; N495-I513 VanDerWaalsContact CB-CG2 3.49Å; N495-I513 PolarHBondContact ND2-O 3.23Å; V500-I513 WeakPolarHBondContact CA-O 3.48Å; L501-I513 PolarHBondContact N-O 3.18Å; L501-I513 PolarHBondContact O-N 2.98Å; I503-I513 HydrophobicContact CB-CD1 4.44Å; I503-I513 HydrophobicContact CD1-CD1 3.6Å; I503-I513 HydrophobicContact CG1-CD1 3.95Å; F510-I513 HydrophobicContact CB-CD1 4.3Å; G511-I513 PolarHBondContact O-N 3.45Å
514	I	92.9	Very high	91.1	Very high	91 Å²	91	58.4 Å²	58.4	47%	0.467	34%	0.34	S	S	.	.			trans	-70.3	158.4	175.6	64.4	176.4	0	0	0	111.3	V500 N512 N517	V500-I514 HydrophobicContact CG2-CG2 4.26Å; N512-I514 PolarHBondContact O-N 2.9Å; I514-N517 HydrophobicContact CD1-CB 4.17Å; I514-N517 WeakPolarHBondContact CD1-ND2 3.17Å; I514-N517 HydrophobicContact CG1-CB 3.47Å; I514-N517 VanDerWaalsContact CG1-CB 3.47Å; I514-N517 WeakPolarHBondContact CG1-ND2 3.47Å; I514-N517 WeakPolarHBondContact O-CB 3.47Å; I514-N517 PolarHBondContact O-N 3.33Å
515	S	91.6	Very high	90.9	Very high	43 Å²	43	60.6 Å²	60.6	30%	0.301	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	141.9	178.5	-168.1	0	0	0	0	111.7	N495 F497 N517	N495-S515 CarbonylContact O-C 3.57Å; F497-S515 VanDerWaalsContact O-CB 3.26Å; F497-S515 WeakPolarHBondContact O-CB 3.23Å; F497-S515 PolarHBondContact O-OG 3.07Å; S515-N517 VanDerWaalsContact C-N 3.28Å; S515-N517 PolarHBondContact O-N 3.31Å
516	K	92.2	Very high	90.7	Very high	76 Å²	76	62.6 Å²	62.6	33%	0.33	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	31	-176.2	-50	-179	-169.2	-179.3	0	114.4	L466 E468 F494 N495	L466-K516 HydrophobicContact CD2-CG 4.41Å; E468-K516 WeakPolarHBondContact OE1-CD 3.32Å; E468-K516 IonicContact OE1-NZ 3.31Å; E468-K516 PolarHBondContact OE1-NZ 3.01Å; F494-K516 HydrophobicContact CZ-CB 4.47Å; N495-K516 WeakPolarHBondContact O-CA 3.37Å; N495-K516 PolarHBondContact O-N 3.47Å
517	N	94.3	Very high	90.8	Very high	57 Å²	57	60.3 Å²	60.3	31%	0.305	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	161.6	-179.3	-159.4	5.8	0	0	0	111.9	F477 N495 I514 S515	F477-N517 WeakPolarHBondContact CE1-OD1 3.32Å; N495-N517 PolarHBondContact N-O 3.5Å; I514-N517 HydrophobicContact CD1-CB 4.17Å; I514-N517 WeakPolarHBondContact CD1-ND2 3.17Å; I514-N517 HydrophobicContact CG1-CB 3.47Å; I514-N517 VanDerWaalsContact CG1-CB 3.47Å; I514-N517 WeakPolarHBondContact CG1-ND2 3.47Å; I514-N517 WeakPolarHBondContact O-CB 3.47Å; I514-N517 PolarHBondContact O-N 3.33Å; S515-N517 VanDerWaalsContact C-N 3.28Å; S515-N517 PolarHBondContact O-N 3.31Å
518	M	94	Very high	91.3	Very high	17 Å²	17	55.5 Å²	55.5	8%	0.084	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	150.2	174	-68	-168.6	176.3	0	0	112.1	I407 T462 V464 F477 R492 F493 F494 T554	I407-M518 HydrophobicContact CD1-CE 4.2Å; T462-M518 HydrophobicContact CG2-CE 3.91Å; V464-M518 HydrophobicContact CG2-CE 3.62Å; F477-M518 HydrophobicContact CB-CE 4.22Å; F477-M518 HydrophobicContact CB-CG 4.45Å; F477-M518 HydrophobicContact CB-SD 3.51Å; F477-M518 VanDerWaalsContact CB-SD 3.51Å; F477-M518 HydrophobicContact CD1-CB 3.84Å; F477-M518 HydrophobicContact CD1-CG 3.79Å; F477-M518 HydrophobicContact CD1-SD 3.99Å; F477-M518 HydrophobicContact CD2-CE 3.67Å; F477-M518 HydrophobicContact CD2-CG 3.94Å; F477-M518 HydrophobicContact CD2-SD 3.72Å; F477-M518 HydrophobicContact CE1-CB 4.01Å; F477-M518 HydrophobicContact CE1-CG 3.99Å; F477-M518 HydrophobicContact CE2-CE 4.29Å; F477-M518 HydrophobicContact CE2-CG 4.09Å; F477-M518 HydrophobicContact CE2-SD 4.44Å; F477-M518 HydrophobicContact CG-CB 4.29Å; F477-M518 HydrophobicContact CG-CE 4.03Å; F477-M518 HydrophobicContact CG-CG 3.77Å; F477-M518 HydrophobicContact CG-SD 3.44Å; F477-M518 WeakPolarHBondContact CG-SD 3.42Å; F477-M518 HydrophobicContact CZ-CG 4.11Å; R492-M518 PolarHBondContact NH1-SD 3.44Å; R492-M518 VanDerWaalsContact NH1-SD 3.43Å; F493-M518 CarbonylContact O-C 3.57Å; F493-M518 VanDerWaalsContact O-CA 3.3Å; F493-M518 WeakPolarHBondContact O-CA 3.48Å; F494-M518 HydrophobicContact CB-CE 4.37Å; F494-M518 HydrophobicContact CB-CG 4.18Å; F494-M518 HydrophobicContact CD2-CE 4.03Å; F494-M518 HydrophobicContact CD2-CG 3.6Å; F494-M518 HydrophobicContact CG-CG 4.39Å; M518-T554 HydrophobicContact CE-CG2 4.18Å
519	S	94.9	Very high	91.6	Very high	15 Å²	15	50.6 Å²	50.6	11%	0.105	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-72.7	167.3	163.9	71.1	0	0	0	0	111.6	R492 F493	R492-S519 WeakPolarHBondContact CA-OG 3.4Å; F493-S519 PolarHBondContact N-OG 3.06Å; F493-S519 PolarHBondContact O-N 3.2Å
520	T	91.8	Very high	91.9	Very high	99 Å²	99	54.5 Å²	54.5	61%	0.607	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-65	159.7	159.5	52.1	0	0	0	0	110.3
521	Y	93.1	Very high	92	Very high	58 Å²	58	54.3 Å²	54.3	23%	0.227	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-70.4	140.7	168.4	-75.9	-81.2	0	0	0	110.1	V480 A490 I491 R492	V480-Y521 HydrophobicContact CG1-CD1 4.33Å; V480-Y521 HydrophobicContact CG1-CD2 3.95Å; V480-Y521 HydrophobicContact CG1-CE1 4.27Å; V480-Y521 HydrophobicContact CG1-CE2 3.89Å; V480-Y521 HydrophobicContact CG1-CG 4.15Å; A490-Y521 HydrophobicContact CB-CD1 3.82Å; A490-Y521 HydrophobicContact CB-CE1 4.37Å; I491-Y521 CarbonylContact O-C 3.51Å; I491-Y521 VanDerWaalsContact O-CA 3.3Å; I491-Y521 WeakPolarHBondContact O-CA 3.38Å; R492-Y521 HydrophobicContact CB-CD1 3.92Å; R492-Y521 HydrophobicContact CB-CE1 4.07Å; R492-Y521 HydrophobicContact CB-CG 4.35Å; R492-Y521 VanDerWaalsContact CD-CZ 3.43Å; R492-Y521 HydrophobicContact CG-CD1 4.03Å; R492-Y521 HydrophobicContact CG-CE1 3.63Å; R492-Y521 PolarHBondContact NE-OH 3.08Å; R492-Y521 PolarHBondContact NH1-OH 3.32Å
522	V	93.4	Very high	92.4	Very high	15 Å²	15	54.5 Å²	54.5	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131.2	172	178.7	0	0	0	0	107.5	I491 V505 E508 F510 V524	I491-V522 PolarHBondContact N-O 3.33Å; I491-V522 PolarHBondContact O-N 2.99Å; V505-V522 HydrophobicContact CG1-CG1 4.4Å; E508-V522 HydrophobicContact CB-CG1 3.85Å; E508-V522 HydrophobicContact CG-CG1 4.37Å; F510-V522 HydrophobicContact CD1-CB 4.04Å; F510-V522 HydrophobicContact CD1-CG2 3.56Å; F510-V522 HydrophobicContact CD2-CG2 4.41Å; F510-V522 HydrophobicContact CE1-CB 3.57Å; F510-V522 HydrophobicContact CE1-CG2 3.66Å; F510-V522 HydrophobicContact CE2-CB 4.41Å; F510-V522 HydrophobicContact CE2-CG2 4.48Å; F510-V522 HydrophobicContact CG-CG2 3.97Å; F510-V522 HydrophobicContact CZ-CB 3.76Å; F510-V522 HydrophobicContact CZ-CG1 4.29Å; F510-V522 HydrophobicContact CZ-CG2 4.11Å; V522-V524 PolarHBondContact O-N 3.16Å
523	D	91.9	Very high	92.6	Very high	103 Å²	103	49 Å²	49	55%	0.551	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	118	178.5	-74.4	-27	0	0	0	110.5	A488	A488-D523 HydrophobicContact CB-CB 4.09Å
524	V	92.4	Very high	92.5	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.1	-179.3	-177.9	0	0	0	0	108.9	N489 I491 V505 V522 A529 F531 F547	N489-V524 WeakPolarHBondContact CB-O 3.35Å; N489-V524 PolarHBondContact N-O 2.91Å; N489-V524 PolarHBondContact ND2-O 3.47Å; N489-V524 PolarHBondContact O-N 3.41Å; I491-V524 HydrophobicContact CB-CG2 4.05Å; I491-V524 HydrophobicContact CG1-CB 3.9Å; I491-V524 HydrophobicContact CG1-CG2 3.56Å; V505-V524 HydrophobicContact CG1-CG2 3.98Å; V505-V524 HydrophobicContact CG2-CG1 4.27Å; V505-V524 HydrophobicContact CG2-CG2 4.48Å; V522-V524 PolarHBondContact O-N 3.16Å; V524-A529 HydrophobicContact CG1-CB 3.61Å; V524-F531 HydrophobicContact CG2-CE1 4.28Å; V524-F531 HydrophobicContact CG2-CZ 4.4Å; V524-F547 HydrophobicContact CG1-CD2 4.17Å; V524-F547 HydrophobicContact CG1-CE2 4.26Å
525	P	89.3	Confident	92.4	Very high	87 Å²	87	49 Å²	49	57%	0.565	27%	0.269	S	S	*	.			trans	-63.6	160.4	178.2	27.7	-35	0	0	0	111.8
526	Q	89.5	Confident	92	Very high	61 Å²	61	51.5 Å²	51.5	29%	0.285	29%	0.292	S	S	.	.	S	Bend	trans	-59.6	155.5	171.9	70.2	-79	6.2	0	0	112.3	G548 F549	Q526-G548 WeakPolarHBondContact CB-O 3.35Å; Q526-F549 HydrophobicContact CB-CD1 4.37Å; Q526-F549 HydrophobicContact CB-CD2 4.47Å; Q526-F549 HydrophobicContact CB-CE1 4.19Å; Q526-F549 HydrophobicContact CB-CE2 4.24Å; Q526-F549 HydrophobicContact CB-CZ 4.13Å; Q526-F549 HydrophobicContact CG-CD1 4.35Å; Q526-F549 HydrophobicContact CG-CE1 3.71Å; Q526-F549 HydrophobicContact CG-CE2 4.2Å; Q526-F549 HydrophobicContact CG-CZ 3.63Å
527	G	89.4	Confident	91.5	Very high	26 Å²	26	51.5 Å²	51.5	27%	0.268	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.7	-164.8	-177.5	0	0	0	0	0	112.9	A529 E546 F547	G527-A529 PolarHBondContact O-N 3.41Å; G527-E546 CarbonylContact O-C 3.55Å; G527-E546 WeakPolarHBondContact O-CA 3.49Å; G527-F547 PolarHBondContact N-O 3.22Å; G527-F547 PolarHBondContact O-N 3.06Å
528	T	92.4	Very high	90.8	Very high	99 Å²	99	51.5 Å²	51.5	61%	0.607	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	120.2	-179	-56.5	0	0	0	0	110.6
529	A	93.6	Very high	90.5	Very high	10 Å²	10	55 Å²	55	8%	0.083	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.4	172.7	0	0	0	0	0	110.4	V505 V524 G527 F531 S544 R545 F547	V505-A529 HydrophobicContact CG2-CB 4.11Å; V524-A529 HydrophobicContact CG1-CB 3.61Å; G527-A529 PolarHBondContact O-N 3.41Å; A529-F531 HydrophobicContact CB-CE2 4.07Å; A529-F531 HydrophobicContact CB-CZ 4.15Å; A529-S544 VanDerWaalsContact O-CA 3.31Å; A529-S544 WeakPolarHBondContact O-CA 3.42Å; A529-R545 PolarHBondContact N-O 3.32Å; A529-R545 PolarHBondContact O-N 3.07Å; A529-F547 HydrophobicContact CB-CD2 3.97Å; A529-F547 HydrophobicContact CB-CE2 3.81Å
530	E	94.4	Very high	90.3	Very high	122 Å²	122	59.8 Å²	59.8	57%	0.57	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.4	176.3	-56.7	-166.8	149.2	0	0	109.6	V542	E530-V542 HydrophobicContact CB-CG1 4.21Å
531	F	94.3	Very high	90.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.3	178.7	-59.7	-83.5	0	0	0	109.9	I491 F493 I503 T504 V505 F510 V524 A529 V542 F543 R545 F547 F555	I491-F531 HydrophobicContact CG1-CZ 4.42Å; I491-F531 HydrophobicContact CG2-CE1 4.14Å; I491-F531 HydrophobicContact CG2-CZ 4.11Å; F493-F531 AromaticContact CE2-CD1 3.85Å; F493-F531 HydrophobicContact CE2-CD1 3.85Å; F493-F531 HydrophobicContact CE2-CE1 4.02Å; F493-F531 HydrophobicContact CE2-CG 4.46Å; F493-F531 HydrophobicContact CZ-CB 4.29Å; F493-F531 AromaticContact CZ-CD1 3.72Å; F493-F531 HydrophobicContact CZ-CD1 3.72Å; F493-F531 HydrophobicContact CZ-CD2 4.38Å; F493-F531 HydrophobicContact CZ-CE1 4.12Å; F493-F531 AromaticContact CZ-CG 3.87Å; F493-F531 HydrophobicContact CZ-CG 3.87Å; I503-F531 HydrophobicContact CG2-CB 4.37Å; I503-F531 HydrophobicContact CG2-CD1 4.49Å; T504-F531 WeakPolarHBondContact O-CA 3.47Å; V505-F531 HydrophobicContact CB-CD1 3.79Å; V505-F531 HydrophobicContact CB-CE1 3.83Å; V505-F531 HydrophobicContact CG1-CE1 4.27Å; V505-F531 HydrophobicContact CG2-CD1 4.15Å; V505-F531 HydrophobicContact CG2-CE1 3.94Å; V505-F531 HydrophobicContact CG2-CZ 4.48Å; F510-F531 AromaticContact CE2-CD1 3.91Å; F510-F531 HydrophobicContact CE2-CD1 3.91Å; F510-F531 AromaticContact CE2-CE1 3.9Å; F510-F531 HydrophobicContact CE2-CE1 3.9Å; F510-F531 HydrophobicContact CZ-CD1 4.21Å; F510-F531 AromaticContact CZ-CE1 3.77Å; F510-F531 HydrophobicContact CZ-CE1 3.77Å; V524-F531 HydrophobicContact CG2-CE1 4.28Å; V524-F531 HydrophobicContact CG2-CZ 4.4Å; A529-F531 HydrophobicContact CB-CE2 4.07Å; A529-F531 HydrophobicContact CB-CZ 4.15Å; F531-V542 CarbonylContact O-C 3.56Å; F531-V542 WeakPolarHBondContact O-CA 3.36Å; F531-F543 HydrophobicContact CB-CB 4.42Å; F531-F543 HydrophobicContact CB-CD1 4.2Å; F531-F543 AromaticContact CD2-CD1 3.57Å; F531-F543 HydrophobicContact CD2-CD1 3.57Å; F531-F543 AromaticContact CD2-CE1 3.94Å; F531-F543 HydrophobicContact CD2-CE1 3.94Å; F531-F543 WeakPolarHBondContact CD2-O 3.5Å; F531-F543 HydrophobicContact CE2-CD1 4.34Å; F531-F543 HydrophobicContact CE2-CE1 4.26Å; F531-F543 HydrophobicContact CG-CD1 4.2Å; F531-F543 PolarHBondContact N-O 3.03Å; F531-F543 PolarHBondContact O-N 3.46Å; F531-R545 HydrophobicContact CE2-CB 4.48Å; F531-F547 AromaticContact CE2-CE2 3.67Å; F531-F547 HydrophobicContact CE2-CE2 3.67Å; F531-F547 AromaticContact CE2-CZ 3.86Å; F531-F547 HydrophobicContact CE2-CZ 3.86Å; F531-F547 AromaticContact CZ-CE2 3.64Å; F531-F547 HydrophobicContact CZ-CE2 3.64Å; F531-F547 AromaticContact CZ-CZ 3.86Å; F531-F547 HydrophobicContact CZ-CZ 3.86Å; F531-F555 HydrophobicContact CE2-CE2 4.45Å; F531-F555 HydrophobicContact CZ-CE2 4.49Å
532	L	93.2	Very high	90.1	Very high	44 Å²	44	56.3 Å²	56.3	23%	0.23	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	113.9	174.9	179.2	63.2	0	0	0	109.3	I503 T504 K534 Q540 V542	I503-L532 WeakPolarHBondContact CA-O 3.42Å; T504-L532 PolarHBondContact N-O 3.35Å; T504-L532 PolarHBondContact O-N 2.83Å; L532-K534 HydrophobicContact CD2-CD 4.45Å; L532-K534 HydrophobicContact CG-CD 4.48Å; L532-K534 HydrophobicContact CG-CG 4.28Å; L532-Q540 HydrophobicContact CD1-CB 4.13Å; L532-V542 HydrophobicContact CD1-CG2 4.03Å
533	I	92.8	Very high	90	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.2	-178.9	-55.9	174.9	0	0	0	108.4	L501 I503 Q540 C541 F543 I557 F561 L563 I571	L501-I533 HydrophobicContact CD1-CG2 4.21Å; L501-I533 HydrophobicContact CD2-CG2 4.14Å; I503-I533 HydrophobicContact CD1-CG1 4.23Å; I503-I533 HydrophobicContact CG1-CB 4.47Å; I503-I533 HydrophobicContact CG1-CG1 4.11Å; I503-I533 HydrophobicContact CG1-CG2 4.22Å; I503-I533 HydrophobicContact CG2-CG1 4.19Å; I533-Q540 CarbonylContact O-C 3.53Å; I533-Q540 VanDerWaalsContact O-CA 3.23Å; I533-Q540 WeakPolarHBondContact O-CA 3.41Å; I533-C541 PolarHBondContact N-O 3.43Å; I533-C541 PolarHBondContact O-N 2.77Å; I533-F543 HydrophobicContact CD1-CB 4.47Å; I533-I557 HydrophobicContact CD1-CD1 4.34Å; I533-F561 HydrophobicContact CD1-CZ 4.27Å; I533-F561 HydrophobicContact CG2-CE1 4.47Å; I533-F561 HydrophobicContact CG2-CZ 4.47Å; I533-L563 HydrophobicContact CG2-CD2 4.36Å; I533-I571 HydrophobicContact CD1-CD1 3.64Å
534	K	91.7	Very high	90.1	Very high	81 Å²	81	54.6 Å²	54.6	35%	0.352	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.2	-179.8	-67	-178.4	176.3	167.5	0	111.5	L501 N502 L532 N539 Q540	L501-K534 CarbonylContact C-O 3.51Å; L501-K534 WeakPolarHBondContact CA-O 3.41Å; N502-K534 PolarHBondContact N-O 3Å; N502-K534 PolarHBondContact O-N 3.24Å; L532-K534 HydrophobicContact CD2-CD 4.45Å; L532-K534 HydrophobicContact CG-CD 4.48Å; L532-K534 HydrophobicContact CG-CG 4.28Å; K534-N539 WeakPolarHBondContact CA-O 3.25Å; K534-Q540 VanDerWaalsContact CE-OE1 3.3Å; K534-Q540 HydrophobicContact CG-CB 3.86Å
535	N	89.8	Confident	90.1	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.08	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	171.6	168.2	74.6	5.1	0	0	0	111.7	M499 L501 A537 G538 N539 L563	M499-N535 HydrophobicContact CE-CB 4.34Å; L501-N535 HydrophobicContact CD2-CB 4.13Å; N535-A537 PolarHBondContact O-N 3.45Å; N535-A537 WeakPolarHBondContact OD1-CA 3.39Å; N535-A537 WeakPolarHBondContact OD1-CB 3.4Å; N535-A537 PolarHBondContact OD1-N 3.44Å; N535-G538 PolarHBondContact O-N 2.97Å; N535-G538 VanDerWaalsContact O-N 3.16Å; N535-G538 PolarHBondContact OD1-N 3.3Å; N535-N539 PolarHBondContact N-O 2.97Å; N535-N539 PolarHBondContact OD1-N 3.5Å; N535-N539 PolarHBondContact OD1-O 3.32Å; N535-L563 HydrophobicContact CB-CD1 3.79Å; N535-L563 VanDerWaalsContact ND2-CD1 3.35Å; N535-L563 WeakPolarHBondContact ND2-CD1 3.44Å
536	A	82.9	Confident	90.3	Very high	95 Å²	95	60 Å²	60	79%	0.785	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.1	176.6	0	0	0	0	0	114.3	G538	A536-G538 VanDerWaalsContact C-N 3.33Å
537	A	82.6	Confident	90.5	Very high	77 Å²	77	57.5 Å²	57.5	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.7	178.2	0	0	0	0	0	113.3	N535	N535-A537 PolarHBondContact O-N 3.45Å; N535-A537 WeakPolarHBondContact OD1-CA 3.39Å; N535-A537 WeakPolarHBondContact OD1-CB 3.4Å; N535-A537 PolarHBondContact OD1-N 3.44Å
538	G	80.5	Confident	90.5	Very high	57 Å²	57	57.8 Å²	57.8	59%	0.588	34%	0.344	S	S	*	.	S	Bend	trans	87.9	2.2	180	0	0	0	0	0	115.1	N535 A536	N535-G538 PolarHBondContact O-N 2.97Å; N535-G538 VanDerWaalsContact O-N 3.16Å; N535-G538 PolarHBondContact OD1-N 3.3Å; A536-G538 VanDerWaalsContact C-N 3.33Å
539	N	87.1	Confident	90.5	Very high	89 Å²	89	53.9 Å²	53.9	48%	0.476	32%	0.318	S	S	.	.			trans	-71.5	139.5	171.6	-60.4	-16.7	0	0	0	109.1	K534 N535 L563	K534-N539 WeakPolarHBondContact CA-O 3.25Å; N535-N539 PolarHBondContact N-O 2.97Å; N535-N539 PolarHBondContact OD1-N 3.5Å; N535-N539 PolarHBondContact OD1-O 3.32Å; N539-L563 HydrophobicContact CB-CB 4.06Å; N539-L563 HydrophobicContact CB-CD1 4.2Å
540	Q	89.8	Confident	90.4	Very high	116 Å²	116	53.4 Å²	53.4	54%	0.542	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150	-175.8	68.5	-175.4	-2.1	0	0	111.8	L532 I533 K534	L532-Q540 HydrophobicContact CD1-CB 4.13Å; I533-Q540 CarbonylContact O-C 3.53Å; I533-Q540 VanDerWaalsContact O-CA 3.23Å; I533-Q540 WeakPolarHBondContact O-CA 3.41Å; K534-Q540 VanDerWaalsContact CE-OE1 3.3Å; K534-Q540 HydrophobicContact CG-CB 3.86Å
541	C	90.2	Very high	90.4	Very high	8 Å²	8	47.6 Å²	47.6	5%	0.054	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.4	169.8	177.6	0	0	0	0	110.4	I533 L563 C567	I533-C541 PolarHBondContact N-O 3.43Å; I533-C541 PolarHBondContact O-N 2.77Å; C541-L563 HydrophobicContact CB-CD2 4.19Å; C541-C567 HydrophobicContact CB-CB 3.77Å; C541-C567 WeakPolarHBondContact CB-SG 3.14Å; C541-C567 WeakPolarHBondContact SG-CB 3.37Å; C541-C567 CovalentContact SG-SG 1.99Å; C541-C567 PolarHBondContact SG-SG 3.25Å
542	V	91.3	Very high	90.4	Very high	77 Å²	77	47.6 Å²	47.6	47%	0.467	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.3	173.9	-177.4	0	0	0	0	109.6	E530 F531 L532	E530-V542 HydrophobicContact CB-CG1 4.21Å; F531-V542 CarbonylContact O-C 3.56Å; F531-V542 WeakPolarHBondContact O-CA 3.36Å; L532-V542 HydrophobicContact CD1-CG2 4.03Å
543	F	91.8	Very high	90.5	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.096	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.6	173.1	163.9	-117.8	0	0	0	108.8	F531 I533 R545 F555 I571	F531-F543 HydrophobicContact CB-CB 4.42Å; F531-F543 HydrophobicContact CB-CD1 4.2Å; F531-F543 AromaticContact CD2-CD1 3.57Å; F531-F543 HydrophobicContact CD2-CD1 3.57Å; F531-F543 AromaticContact CD2-CE1 3.94Å; F531-F543 HydrophobicContact CD2-CE1 3.94Å; F531-F543 WeakPolarHBondContact CD2-O 3.5Å; F531-F543 HydrophobicContact CE2-CD1 4.34Å; F531-F543 HydrophobicContact CE2-CE1 4.26Å; F531-F543 HydrophobicContact CG-CD1 4.2Å; F531-F543 PolarHBondContact N-O 3.03Å; F531-F543 PolarHBondContact O-N 3.46Å; I533-F543 HydrophobicContact CD1-CB 4.47Å; F543-R545 HydrophobicContact CE1-CB 4.19Å; F543-R545 HydrophobicContact CZ-CB 3.91Å; F543-F555 AromaticContact CE1-CD1 3.89Å; F543-F555 HydrophobicContact CE1-CD1 3.89Å; F543-F555 HydrophobicContact CE1-CD2 4.4Å; F543-F555 AromaticContact CE1-CE1 3.67Å; F543-F555 HydrophobicContact CE1-CE1 3.67Å; F543-F555 HydrophobicContact CE1-CE2 4.2Å; F543-F555 HydrophobicContact CE1-CG 4.26Å; F543-F555 AromaticContact CE1-CZ 3.84Å; F543-F555 HydrophobicContact CE1-CZ 3.84Å; F543-F555 HydrophobicContact CZ-CD1 4.04Å; F543-F555 AromaticContact CZ-CE1 3.63Å; F543-F555 HydrophobicContact CZ-CE1 3.63Å; F543-F555 HydrophobicContact CZ-CZ 4.11Å; F543-I571 HydrophobicContact CB-CD1 3.86Å; F543-I571 HydrophobicContact CD1-CD1 4.01Å; F543-I571 HydrophobicContact CD2-CD1 4.13Å; F543-I571 HydrophobicContact CG-CD1 3.73Å
544	S	92.9	Very high	90.7	Very high	60 Å²	60	46.3 Å²	46.3	42%	0.42	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.9	-179.6	-51.3	0	0	0	0	111	A529	A529-S544 VanDerWaalsContact O-CA 3.31Å; A529-S544 WeakPolarHBondContact O-CA 3.42Å
545	R	93.1	Very high	90.9	Very high	75 Å²	75	42.4 Å²	42.4	28%	0.283	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	137.1	177.1	-177.5	62.6	169.9	101.2	-7.9	110.2	A529 F531 F543 F547 F555 E573	A529-R545 PolarHBondContact N-O 3.32Å; A529-R545 PolarHBondContact O-N 3.07Å; F531-R545 HydrophobicContact CE2-CB 4.48Å; F543-R545 HydrophobicContact CE1-CB 4.19Å; F543-R545 HydrophobicContact CZ-CB 3.91Å; R545-F547 HydrophobicContact CB-CE1 4.48Å; R545-F547 HydrophobicContact CB-CE2 4.1Å; R545-F547 HydrophobicContact CB-CZ 3.9Å; R545-F547 HydrophobicContact CG-CD1 4.32Å; R545-F547 HydrophobicContact CG-CE1 3.76Å; R545-F547 HydrophobicContact CG-CE2 4.2Å; R545-F547 HydrophobicContact CG-CZ 3.69Å; R545-F555 HydrophobicContact CG-CZ 4.23Å; R545-E573 IonicContact CZ-OE2 3.07Å; R545-E573 IonicContact NE-OE2 3.86Å; R545-E573 PolarHBondContact NE-OE2 2.92Å; R545-E573 IonicContact NH2-OE1 2.68Å; R545-E573 IonicContact NH2-OE2 3.87Å; R545-E573 PolarHBondContact NH2-OE2 3.27Å
546	E	92.8	Very high	91.1	Very high	125 Å²	125	41.7 Å²	41.7	58%	0.584	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.1	171.7	-171.1	176.8	-171.4	0	0	110.6	G527	G527-E546 CarbonylContact O-C 3.55Å; G527-E546 WeakPolarHBondContact O-CA 3.49Å
547	F	93.4	Very high	91.7	Very high	10 Å²	10	37.2 Å²	37.2	4%	0.044	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.3	178.6	-63.3	-73	0	0	0	112.2	N489 I491 V524 G527 A529 F531 R545 Y553 F555	N489-F547 HydrophobicContact CB-CB 4.33Å; N489-F547 HydrophobicContact CB-CG 4.4Å; N489-F547 WeakPolarHBondContact ND2-CB 3.14Å; I491-F547 HydrophobicContact CD1-CD1 4.06Å; I491-F547 HydrophobicContact CD1-CE1 3.45Å; I491-F547 VanDerWaalsContact CD1-CE1 3.45Å; I491-F547 HydrophobicContact CD1-CE2 4.27Å; I491-F547 HydrophobicContact CD1-CZ 3.58Å; I491-F547 HydrophobicContact CG1-CE1 4.44Å; I491-F547 HydrophobicContact CG1-CE2 4.46Å; I491-F547 HydrophobicContact CG1-CZ 4.11Å; V524-F547 HydrophobicContact CG1-CD2 4.17Å; V524-F547 HydrophobicContact CG1-CE2 4.26Å; G527-F547 PolarHBondContact N-O 3.22Å; G527-F547 PolarHBondContact O-N 3.06Å; A529-F547 HydrophobicContact CB-CD2 3.97Å; A529-F547 HydrophobicContact CB-CE2 3.81Å; F531-F547 AromaticContact CE2-CE2 3.67Å; F531-F547 HydrophobicContact CE2-CE2 3.67Å; F531-F547 AromaticContact CE2-CZ 3.86Å; F531-F547 HydrophobicContact CE2-CZ 3.86Å; F531-F547 AromaticContact CZ-CE2 3.64Å; F531-F547 HydrophobicContact CZ-CE2 3.64Å; F531-F547 AromaticContact CZ-CZ 3.86Å; F531-F547 HydrophobicContact CZ-CZ 3.86Å; R545-F547 HydrophobicContact CB-CE1 4.48Å; R545-F547 HydrophobicContact CB-CE2 4.1Å; R545-F547 HydrophobicContact CB-CZ 3.9Å; R545-F547 HydrophobicContact CG-CD1 4.32Å; R545-F547 HydrophobicContact CG-CE1 3.76Å; R545-F547 HydrophobicContact CG-CE2 4.2Å; R545-F547 HydrophobicContact CG-CZ 3.69Å; F547-Y553 AromaticContact CD1-CD2 3.79Å; F547-Y553 HydrophobicContact CD1-CD2 3.79Å; F547-Y553 AromaticContact CD1-CE2 3.84Å; F547-Y553 HydrophobicContact CD1-CE2 3.84Å; F547-Y553 AromaticContact CE1-CD2 3.61Å; F547-Y553 HydrophobicContact CE1-CD2 3.61Å; F547-Y553 HydrophobicContact CE1-CE2 4.06Å; F547-Y553 HydrophobicContact CE1-CG 4.32Å; F547-F555 HydrophobicContact CE1-CE2 4.23Å; F547-F555 AromaticContact CE1-CZ 3.92Å; F547-F555 HydrophobicContact CE1-CZ 3.92Å; F547-F555 AromaticContact CZ-CE2 3.81Å; F547-F555 HydrophobicContact CZ-CE2 3.81Å; F547-F555 AromaticContact CZ-CZ 3.72Å; F547-F555 HydrophobicContact CZ-CZ 3.72Å
548	G	90.8	Very high	92.1	Very high	31 Å²	31	33.7 Å²	33.7	32%	0.32	19%	0.193	S	C	.	.			trans	-80.6	-147.6	168.3	0	0	0	0	0	111.9	N489 Q526	N489-G548 PolarHBondContact ND2-O 2.67Å; N489-G548 PolarHBondContact OD1-O 2.94Å; N489-G548 VanDerWaalsContact OD1-O 3.08Å; Q526-G548 WeakPolarHBondContact CB-O 3.35Å
549	F	92	Very high	92.4	Very high	17 Å²	17	34.5 Å²	34.5	8%	0.075	19%	0.188	C	C	.	.	S	Bend	trans	-108.5	133	-179.1	-66.4	-103.1	0	0	0	111.5	D319 N321 V326 G487 Q526 S551 A579 N580	D319-F549 HydrophobicContact CB-CD2 4.41Å; D319-F549 WeakPolarHBondContact OD1-CD2 3.23Å; D319-F549 WeakPolarHBondContact OD1-CE2 3.39Å; N321-F549 HydrophobicContact CB-CE2 3.83Å; N321-F549 HydrophobicContact CB-CZ 4.25Å; V326-F549 HydrophobicContact CG1-CE1 3.8Å; V326-F549 HydrophobicContact CG1-CZ 3.72Å; V326-F549 HydrophobicContact CG2-CZ 4.32Å; G487-F549 WeakPolarHBondContact O-CA 3.3Å; Q526-F549 HydrophobicContact CB-CD1 4.37Å; Q526-F549 HydrophobicContact CB-CD2 4.47Å; Q526-F549 HydrophobicContact CB-CE1 4.19Å; Q526-F549 HydrophobicContact CB-CE2 4.24Å; Q526-F549 HydrophobicContact CB-CZ 4.13Å; Q526-F549 HydrophobicContact CG-CD1 4.35Å; Q526-F549 HydrophobicContact CG-CE1 3.71Å; Q526-F549 HydrophobicContact CG-CE2 4.2Å; Q526-F549 HydrophobicContact CG-CZ 3.63Å; F549-S551 VanDerWaalsContact C-N 3.35Å; F549-S551 PolarHBondContact O-N 2.94Å; F549-A579 CarbonylContact O-C 3.57Å; F549-A579 VanDerWaalsContact O-CA 3.29Å; F549-A579 WeakPolarHBondContact O-CA 3.48Å; F549-N580 HydrophobicContact CB-CB 4.23Å; F549-N580 PolarHBondContact O-N 2.99Å
550	G	91.6	Very high	92.3	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.01	19%	0.191	C	C	.	.	S	Bend	trans	70	25.9	168.4	0	0	0	0	0	114.3	K483 G487 A488 N489	K483-G550 WeakPolarHBondContact CE-O 3.49Å; K483-G550 WeakPolarHBondContact CG-O 3.41Å; G487-G550 PolarHBondContact O-N 3.35Å; G487-G550 VanDerWaalsContact O-N 3.11Å; A488-G550 WeakPolarHBondContact O-CA 3.48Å; A488-G550 PolarHBondContact O-N 3.23Å; A488-G550 VanDerWaalsContact O-N 3.07Å; N489-G550 PolarHBondContact OD1-N 2.83Å
551	S	93.6	Very high	92.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.			trans	-93.4	162.6	-178.1	67.1	0	0	0	0	112.7	P484 N489 A490 F549 Y553 I577	P484-S551 WeakPolarHBondContact CG-O 3.46Å; N489-S551 CarbonylContact C-O 3.56Å; N489-S551 WeakPolarHBondContact CA-O 3.08Å; N489-S551 WeakPolarHBondContact OD1-CB 3.2Å; N489-S551 PolarHBondContact OD1-N 3.42Å; N489-S551 PolarHBondContact OD1-OG 3.32Å; A490-S551 PolarHBondContact N-O 3.49Å; F549-S551 VanDerWaalsContact C-N 3.35Å; F549-S551 PolarHBondContact O-N 2.94Å; S551-Y553 WeakPolarHBondContact OG-CE2 3.48Å; S551-I577 WeakPolarHBondContact CA-O 3.3Å; S551-I577 WeakPolarHBondContact CB-O 3.33Å
552	S	94.9	Very high	91.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131.3	171.5	179.7	0	0	0	0	109.5	A490 D576 I577	A490-S552 VanDerWaalsContact O-CA 3.24Å; A490-S552 WeakPolarHBondContact O-CA 3.41Å; A490-S552 PolarHBondContact O-OG 2.92Å; S552-D576 WeakPolarHBondContact O-CA 3.31Å; S552-D576 WeakPolarHBondContact O-CB 3.34Å; S552-D576 PolarHBondContact O-N 3.37Å; S552-I577 PolarHBondContact N-O 3.32Å; S552-I577 PolarHBondContact O-N 2.85Å; S552-I577 VanDerWaalsContact O-N 3.1Å
553	Y	95.4	Very high	91.5	Very high	16 Å²	16	29.1 Å²	29.1	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.3	-178.8	-68.8	-80.8	0	0	0	112.2	A490 I491 R492 F547 S551 V574 E575	A490-Y553 PolarHBondContact O-N 3.26Å; I491-Y553 HydrophobicContact CD1-CD2 4.03Å; I491-Y553 HydrophobicContact CD1-CG 4.47Å; R492-Y553 PolarHBondContact N-O 3.17Å; F547-Y553 AromaticContact CD1-CD2 3.79Å; F547-Y553 HydrophobicContact CD1-CD2 3.79Å; F547-Y553 AromaticContact CD1-CE2 3.84Å; F547-Y553 HydrophobicContact CD1-CE2 3.84Å; F547-Y553 AromaticContact CE1-CD2 3.61Å; F547-Y553 HydrophobicContact CE1-CD2 3.61Å; F547-Y553 HydrophobicContact CE1-CE2 4.06Å; F547-Y553 HydrophobicContact CE1-CG 4.32Å; S551-Y553 WeakPolarHBondContact OG-CE2 3.48Å; Y553-V574 WeakPolarHBondContact CA-O 3.31Å; Y553-E575 HydrophobicContact CD1-CB 4.09Å; Y553-E575 HydrophobicContact CD1-CG 4.35Å; Y553-E575 HydrophobicContact CE1-CB 3.66Å; Y553-E575 HydrophobicContact CE1-CG 3.65Å; Y553-E575 PolarHBondContact OH-OE2 3.46Å
554	T	96.1	Very high	91	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.1	166.2	-59.1	0	0	0	0	109.2	I407 R492 M518 V574 D576	I407-T554 HydrophobicContact CD1-CG2 4.39Å; R492-T554 HydrophobicContact CG-CG2 4.14Å; R492-T554 PolarHBondContact NE-OG1 3.43Å; R492-T554 PolarHBondContact NH2-OG1 2.95Å; R492-T554 VanDerWaalsContact NH2-OG1 3.09Å; R492-T554 CarbonylContact O-C 3.51Å; R492-T554 WeakPolarHBondContact O-CA 3.41Å; M518-T554 HydrophobicContact CE-CG2 4.18Å; T554-V574 PolarHBondContact N-O 2.79Å; T554-V574 WeakPolarHBondContact O-CB 3.26Å; T554-V574 PolarHBondContact O-N 3.41Å; T554-D576 WeakPolarHBondContact CB-OD2 2.97Å; T554-D576 PolarHBondContact N-OD2 3.43Å; T554-D576 PolarHBondContact OG1-OD2 3.27Å
555	F	95.8	Very high	89.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	122.6	173.8	-69.1	-68.2	0	0	0	110.7	I491 R492 F493 F494 F531 F543 R545 F547 I571 K572 E573	I491-F555 HydrophobicContact CD1-CE2 4.35Å; I491-F555 HydrophobicContact CG2-CD2 3.63Å; I491-F555 HydrophobicContact CG2-CE2 3.56Å; R492-F555 PolarHBondContact O-N 3.37Å; F493-F555 CarbonylContact C-O 3.6Å; F493-F555 VanDerWaalsContact CA-O 3.29Å; F493-F555 WeakPolarHBondContact CA-O 3.43Å; F493-F555 HydrophobicContact CD1-CB 3.42Å; F493-F555 VanDerWaalsContact CD1-CB 3.42Å; F493-F555 HydrophobicContact CD1-CD2 4.39Å; F493-F555 HydrophobicContact CD1-CG 4.29Å; F493-F555 HydrophobicContact CE1-CB 3.45Å; F493-F555 VanDerWaalsContact CE1-CB 3.45Å; F493-F555 AromaticContact CE1-CD2 3.81Å; F493-F555 HydrophobicContact CE1-CD2 3.81Å; F493-F555 AromaticContact CE1-CG 3.85Å; F493-F555 HydrophobicContact CE1-CG 3.85Å; F493-F555 HydrophobicContact CE2-CD2 4.1Å; F493-F555 HydrophobicContact CG-CB 4.12Å; F493-F555 HydrophobicContact CZ-CB 4.17Å; F493-F555 AromaticContact CZ-CD2 3.64Å; F493-F555 HydrophobicContact CZ-CD2 3.64Å; F493-F555 HydrophobicContact CZ-CE2 4.42Å; F493-F555 HydrophobicContact CZ-CG 4.17Å; F494-F555 PolarHBondContact N-O 3.21Å; F531-F555 HydrophobicContact CE2-CE2 4.45Å; F531-F555 HydrophobicContact CZ-CE2 4.49Å; F543-F555 AromaticContact CE1-CD1 3.89Å; F543-F555 HydrophobicContact CE1-CD1 3.89Å; F543-F555 HydrophobicContact CE1-CD2 4.4Å; F543-F555 AromaticContact CE1-CE1 3.67Å; F543-F555 HydrophobicContact CE1-CE1 3.67Å; F543-F555 HydrophobicContact CE1-CE2 4.2Å; F543-F555 HydrophobicContact CE1-CG 4.26Å; F543-F555 AromaticContact CE1-CZ 3.84Å; F543-F555 HydrophobicContact CE1-CZ 3.84Å; F543-F555 HydrophobicContact CZ-CD1 4.04Å; F543-F555 AromaticContact CZ-CE1 3.63Å; F543-F555 HydrophobicContact CZ-CE1 3.63Å; F543-F555 HydrophobicContact CZ-CZ 4.11Å; R545-F555 HydrophobicContact CG-CZ 4.23Å; F547-F555 HydrophobicContact CE1-CE2 4.23Å; F547-F555 AromaticContact CE1-CZ 3.92Å; F547-F555 HydrophobicContact CE1-CZ 3.92Å; F547-F555 AromaticContact CZ-CE2 3.81Å; F547-F555 HydrophobicContact CZ-CE2 3.81Å; F547-F555 AromaticContact CZ-CZ 3.72Å; F547-F555 HydrophobicContact CZ-CZ 3.72Å; F555-I571 HydrophobicContact CB-CG2 3.87Å; F555-I571 HydrophobicContact CD1-CG2 3.86Å; F555-I571 HydrophobicContact CG-CG2 4.22Å; F555-K572 CarbonylContact C-O 3.58Å; F555-E573 HydrophobicContact CD1-CB 4.04Å; F555-E573 HydrophobicContact CE1-CB 3.82Å
556	I	95.1	Very high	89.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123	177.6	-60.5	169.5	0	0	0	108.8	I407 M409 P558 I571 K572 V574	I407-I556 HydrophobicContact CD1-CD1 4.21Å; I407-I556 HydrophobicContact CG2-CD1 3.5Å; I407-I556 VanDerWaalsContact CG2-CD1 3.5Å; I407-I556 HydrophobicContact CG2-CG1 4.38Å; M409-I556 HydrophobicContact CE-CG2 3.84Å; M409-I556 HydrophobicContact SD-CG2 3.36Å; M409-I556 WeakPolarHBondContact SD-CG2 3.31Å; I556-P558 WeakPolarHBondContact O-CD 3.43Å; I556-I571 WeakPolarHBondContact O-CA 3.38Å; I556-K572 HydrophobicContact CB-CB 4.21Å; I556-K572 PolarHBondContact N-O 2.81Å; I556-K572 PolarHBondContact O-N 2.93Å; I556-V574 HydrophobicContact CD1-CG2 3.5Å; I556-V574 HydrophobicContact CG1-CG2 4.14Å
557	I	94.1	Very high	88.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	105.8	169.6	-58.2	179.6	0	0	0	107.4	F493 F494 G496 F497 L501 I503 I533 F561	F493-I557 HydrophobicContact CD1-CD1 4.13Å; F493-I557 HydrophobicContact CD1-CG1 4.38Å; F494-I557 PolarHBondContact O-N 2.96Å; G496-I557 CarbonylContact C-O 3.53Å; G496-I557 WeakPolarHBondContact CA-O 3.44Å; G496-I557 PolarHBondContact N-O 3.32Å; F497-I557 HydrophobicContact CB-CG2 4.1Å; L501-I557 HydrophobicContact CD1-CD1 3.52Å; L501-I557 HydrophobicContact CD1-CG2 4.02Å; I503-I557 HydrophobicContact CD1-CD1 3.77Å; I533-I557 HydrophobicContact CD1-CD1 4.34Å; I557-F561 HydrophobicContact CG2-CB 3.68Å; I557-F561 HydrophobicContact CG2-CD1 3.65Å; I557-F561 HydrophobicContact CG2-CD2 3.88Å; I557-F561 HydrophobicContact CG2-CE1 4.18Å; I557-F561 HydrophobicContact CG2-CE2 4.38Å; I557-F561 HydrophobicContact CG2-CG 3.48Å; I557-F561 VanDerWaalsContact CG2-CG 3.48Å
558	P	91.3	Very high	88.1	Confident	4 Å²	4	37 Å²	37	3%	0.026	21%	0.208	C	C	.	.			trans	-71.4	162.4	-176	30.4	-36.2	0	0	0	112	F428 I556 T560 F561 H570	F428-P558 HydrophobicContact CD1-CB 3.94Å; F428-P558 HydrophobicContact CD2-CB 4.33Å; F428-P558 HydrophobicContact CE1-CB 4.2Å; F428-P558 HydrophobicContact CG-CB 4.01Å; F428-P558 HydrophobicContact CZ-CB 4.49Å; I556-P558 WeakPolarHBondContact O-CD 3.43Å; P558-T560 PolarHBondContact O-N 3.03Å; P558-F561 HydrophobicContact CG-CB 4.37Å; P558-F561 WeakPolarHBondContact O-CB 3.37Å; P558-F561 PolarHBondContact O-N 3.44Å; P558-H570 WeakPolarHBondContact CD-O 3.42Å; P558-H570 HydrophobicContact CG-CB 4.43Å; P558-H570 WeakPolarHBondContact CG-O 3.4Å
559	P	87.8	Confident	87.7	Confident	74 Å²	74	42.7 Å²	42.7	48%	0.481	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.9	174.6	-21.4	33	0	0	0	113.8	F428 G496 F561	F428-P559 HydrophobicContact CE1-CG 4.14Å; G496-P559 WeakPolarHBondContact O-CA 3.38Å; P559-F561 PolarHBondContact O-N 3.05Å
560	T	84.9	Confident	87.4	Confident	89 Å²	89	45.5 Å²	45.5	55%	0.546	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-0.5	177	53.1	0	0	0	0	113.7	P558	P558-T560 PolarHBondContact O-N 3.03Å
561	F	86.8	Confident	87.4	Confident	5 Å²	5	46.2 Å²	46.2	2%	0.022	24%	0.243	C	C	.	.			trans	-62.5	133.2	-178.5	179.3	-101.9	0	0	0	112.3	F497 I533 I557 P558 P559 L563 C567 H570 I571	F497-F561 HydrophobicContact CD2-CB 4.34Å; F497-F561 HydrophobicContact CD2-CD1 4.14Å; F497-F561 HydrophobicContact CE2-CD1 4.44Å; F497-F561 WeakPolarHBondContact CE2-O 3.49Å; I533-F561 HydrophobicContact CD1-CZ 4.27Å; I533-F561 HydrophobicContact CG2-CE1 4.47Å; I533-F561 HydrophobicContact CG2-CZ 4.47Å; I557-F561 HydrophobicContact CG2-CB 3.68Å; I557-F561 HydrophobicContact CG2-CD1 3.65Å; I557-F561 HydrophobicContact CG2-CD2 3.88Å; I557-F561 HydrophobicContact CG2-CE1 4.18Å; I557-F561 HydrophobicContact CG2-CE2 4.38Å; I557-F561 HydrophobicContact CG2-CG 3.48Å; I557-F561 VanDerWaalsContact CG2-CG 3.48Å; P558-F561 HydrophobicContact CG-CB 4.37Å; P558-F561 WeakPolarHBondContact O-CB 3.37Å; P558-F561 PolarHBondContact O-N 3.44Å; P559-F561 PolarHBondContact O-N 3.05Å; F561-L563 HydrophobicContact CE1-CD2 4.02Å; F561-L563 HydrophobicContact CE1-CG 3.86Å; F561-C567 HydrophobicContact CD2-CB 4.4Å; F561-C567 HydrophobicContact CE2-CB 3.47Å; F561-C567 VanDerWaalsContact CE2-CB 3.47Å; F561-C567 HydrophobicContact CZ-CB 3.61Å; F561-C567 VanDerWaalsContact CZ-SG 3.59Å; F561-H570 HydrophobicContact CD2-CB 4.02Å; F561-I571 HydrophobicContact CD2-CG1 4.33Å; F561-I571 HydrophobicContact CE2-CD1 4.19Å; F561-I571 HydrophobicContact CE2-CG1 3.87Å
562	T	84.8	Confident	87.4	Confident	52 Å²	52	50.6 Å²	50.6	32%	0.319	26%	0.262	S	S	.	.			trans	-117.5	142.8	173.3	58.2	0	0	0	0	110.8	E564 C567	T562-E564 PolarHBondContact O-N 3.25Å; T562-E564 VanDerWaalsContact O-N 3.1Å; T562-E564 PolarHBondContact OG1-OE1 3.01Å; T562-C567 WeakPolarHBondContact O-CB 3.41Å
563	L	82.7	Confident	87.3	Confident	31 Å²	31	55.6 Å²	55.6	16%	0.162	29%	0.285	C	S	.	.			trans	-87.3	63.9	178.2	-75.4	142.8	0	0	0	110	F497 I533 N535 N539 C541 F561	F497-L563 HydrophobicContact CE1-CD1 4.13Å; F497-L563 HydrophobicContact CZ-CD1 3.99Å; I533-L563 HydrophobicContact CG2-CD2 4.36Å; N535-L563 HydrophobicContact CB-CD1 3.79Å; N535-L563 VanDerWaalsContact ND2-CD1 3.35Å; N535-L563 WeakPolarHBondContact ND2-CD1 3.44Å; N539-L563 HydrophobicContact CB-CB 4.06Å; N539-L563 HydrophobicContact CB-CD1 4.2Å; C541-L563 HydrophobicContact CB-CD2 4.19Å; F561-L563 HydrophobicContact CE1-CD2 4.02Å; F561-L563 HydrophobicContact CE1-CG 3.86Å
564	E	81.4	Confident	87.2	Confident	126 Å²	126	55 Å²	55	59%	0.589	28%	0.283	S	S	*	.	S	Bend	trans	-110	170.3	179.7	-68.6	174.9	-153	0	0	111.9	T562 N566 C567	T562-E564 PolarHBondContact O-N 3.25Å; T562-E564 VanDerWaalsContact O-N 3.1Å; T562-E564 PolarHBondContact OG1-OE1 3.01Å; E564-N566 PolarHBondContact O-N 3.03Å; E564-N566 VanDerWaalsContact O-N 3.14Å; E564-C567 PolarHBondContact O-N 2.84Å
565	E	70.7	Confident	87.1	Confident	188 Å²	188	58.7 Å²	58.7	88%	0.879	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	114.9	167.8	-71.6	-177.5	172.3	0	0	108.5
566	N	76.8	Confident	86.9	Confident	119 Å²	119	59.1 Å²	59.1	64%	0.636	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	29.9	-172.9	-46.8	-57.9	0	0	0	117.5	E564 G568 Q569	E564-N566 PolarHBondContact O-N 3.03Å; E564-N566 VanDerWaalsContact O-N 3.14Å; N566-G568 PolarHBondContact O-N 3.35Å; N566-Q569 PolarHBondContact O-N 2.87Å
567	C	82.3	Confident	86.8	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-55.3	-21.4	174.1	77.4	0	0	0	0	114.7	C541 F561 T562 E564 Q569 H570	C541-C567 HydrophobicContact CB-CB 3.77Å; C541-C567 WeakPolarHBondContact CB-SG 3.14Å; C541-C567 WeakPolarHBondContact SG-CB 3.37Å; C541-C567 CovalentContact SG-SG 1.99Å; C541-C567 PolarHBondContact SG-SG 3.25Å; F561-C567 HydrophobicContact CD2-CB 4.4Å; F561-C567 HydrophobicContact CE2-CB 3.47Å; F561-C567 VanDerWaalsContact CE2-CB 3.47Å; F561-C567 HydrophobicContact CZ-CB 3.61Å; F561-C567 VanDerWaalsContact CZ-SG 3.59Å; T562-C567 WeakPolarHBondContact O-CB 3.41Å; E564-C567 PolarHBondContact O-N 2.84Å; C567-Q569 PolarHBondContact O-N 2.89Å; C567-Q569 VanDerWaalsContact O-N 3.13Å; C567-H570 PolarHBondContact O-N 3.1Å; C567-H570 VanDerWaalsContact O-N 3.07Å
568	G	81.1	Confident	86.6	Confident	22 Å²	22	64.1 Å²	64.1	23%	0.227	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-55.6	-27	178	0	0	0	0	0	114.6	N566 H570 I571	N566-G568 PolarHBondContact O-N 3.35Å; G568-H570 PolarHBondContact O-N 3.36Å; G568-I571 PolarHBondContact O-N 3.34Å
569	Q	82.9	Confident	86.6	Confident	151 Å²	151	65.3 Å²	65.3	71%	0.706	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-65.5	-25.2	178.2	-64.8	-174.2	-1.5	0	0	113.4	N566 C567	N566-Q569 PolarHBondContact O-N 2.87Å; C567-Q569 PolarHBondContact O-N 2.89Å; C567-Q569 VanDerWaalsContact O-N 3.13Å
570	H	85.6	Confident	86.8	Confident	77 Å²	77	62.2 Å²	62.2	36%	0.356	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-87.5	-18.3	179.2	-65.1	-75.6	0	0	0	112.6	P558 F561 C567 G568 K572	P558-H570 WeakPolarHBondContact CD-O 3.42Å; P558-H570 HydrophobicContact CG-CB 4.43Å; P558-H570 WeakPolarHBondContact CG-O 3.4Å; F561-H570 HydrophobicContact CD2-CB 4.02Å; C567-H570 PolarHBondContact O-N 3.1Å; C567-H570 VanDerWaalsContact O-N 3.07Å; G568-H570 PolarHBondContact O-N 3.36Å; H570-K572 PolarHBondContact O-N 3.47Å
571	I	91.5	Very high	87	Confident	15 Å²	15	61.8 Å²	61.8	8%	0.077	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-74	128	178.8	-58.7	178.3	0	0	0	108.5	I533 F543 F555 I556 F561 G568	I533-I571 HydrophobicContact CD1-CD1 3.64Å; F543-I571 HydrophobicContact CB-CD1 3.86Å; F543-I571 HydrophobicContact CD1-CD1 4.01Å; F543-I571 HydrophobicContact CD2-CD1 4.13Å; F543-I571 HydrophobicContact CG-CD1 3.73Å; F555-I571 HydrophobicContact CB-CG2 3.87Å; F555-I571 HydrophobicContact CD1-CG2 3.86Å; F555-I571 HydrophobicContact CG-CG2 4.22Å; I556-I571 WeakPolarHBondContact O-CA 3.38Å; F561-I571 HydrophobicContact CD2-CG1 4.33Å; F561-I571 HydrophobicContact CE2-CD1 4.19Å; F561-I571 HydrophobicContact CE2-CG1 3.87Å; G568-I571 PolarHBondContact O-N 3.34Å
572	K	93	Very high	87.4	Confident	93 Å²	93	63 Å²	63	40%	0.404	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.7	175.5	-60.8	-60.3	-174.4	-174.2	0	109.7	F428 F555 I556 H570	F428-K572 HydrophobicContact CB-CG 4.27Å; F555-K572 CarbonylContact C-O 3.58Å; I556-K572 HydrophobicContact CB-CB 4.21Å; I556-K572 PolarHBondContact N-O 2.81Å; I556-K572 PolarHBondContact O-N 2.93Å; H570-K572 PolarHBondContact O-N 3.47Å
573	E	93.3	Very high	87.8	Confident	105 Å²	105	62.6 Å²	62.6	49%	0.491	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135	177	62.7	-179.2	-167.9	0	0	110.7	R545 F555	R545-E573 IonicContact CZ-OE2 3.07Å; R545-E573 IonicContact NE-OE2 3.86Å; R545-E573 PolarHBondContact NE-OE2 2.92Å; R545-E573 IonicContact NH2-OE1 2.68Å; R545-E573 IonicContact NH2-OE2 3.87Å; R545-E573 PolarHBondContact NH2-OE2 3.27Å; F555-E573 HydrophobicContact CD1-CB 4.04Å; F555-E573 HydrophobicContact CE1-CB 3.82Å
574	V	94.1	Very high	88.4	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	116.2	169.3	170.9	0	0	0	0	107.6	K405 I407 S430 Y553 T554 I556 D576	K405-V574 HydrophobicContact CD-CG1 3.9Å; I407-V574 HydrophobicContact CD1-CG2 4.37Å; S430-V574 VanDerWaalsContact OG-CG1 3.29Å; S430-V574 WeakPolarHBondContact OG-CG1 3.12Å; Y553-V574 WeakPolarHBondContact CA-O 3.31Å; T554-V574 PolarHBondContact N-O 2.79Å; T554-V574 WeakPolarHBondContact O-CB 3.26Å; T554-V574 PolarHBondContact O-N 3.41Å; I556-V574 HydrophobicContact CD1-CG2 3.5Å; I556-V574 HydrophobicContact CG1-CG2 4.14Å; V574-D576 PolarHBondContact O-N 3.19Å
575	E	92.9	Very high	89.1	Confident	78 Å²	78	56.9 Å²	56.9	36%	0.364	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.2	177	-175	173.4	82.4	0	0	110.1	K405 Y553 K578	K405-E575 PolarHBondContact NZ-O 3.41Å; Y553-E575 HydrophobicContact CD1-CB 4.09Å; Y553-E575 HydrophobicContact CD1-CG 4.35Å; Y553-E575 HydrophobicContact CE1-CB 3.66Å; Y553-E575 HydrophobicContact CE1-CG 3.65Å; Y553-E575 PolarHBondContact OH-OE2 3.46Å; E575-K578 HydrophobicContact CG-CG 4.27Å; E575-K578 WeakPolarHBondContact OE1-CE 3.48Å; E575-K578 WeakPolarHBondContact OE1-CG 3.44Å
576	D	91.8	Very high	90.2	Very high	9 Å²	9	55.8 Å²	55.8	5%	0.048	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-38.4	178.5	-68.1	-47	0	0	0	113.1	K405 Y434 R460 R492 S552 T554 V574	K405-D576 IonicContact NZ-OD1 3.34Å; K405-D576 PolarHBondContact NZ-OD1 3.11Å; Y434-D576 HydrophobicContact CE2-CB 4.48Å; Y434-D576 PolarHBondContact OH-OD1 3.01Å; R460-D576 PolarHBondContact NH2-O 3Å; R492-D576 IonicContact NH2-OD2 2.72Å; S552-D576 WeakPolarHBondContact O-CA 3.31Å; S552-D576 WeakPolarHBondContact O-CB 3.34Å; S552-D576 PolarHBondContact O-N 3.37Å; T554-D576 WeakPolarHBondContact CB-OD2 2.97Å; T554-D576 PolarHBondContact N-OD2 3.43Å; T554-D576 PolarHBondContact OG1-OD2 3.27Å; V574-D576 PolarHBondContact O-N 3.19Å
577	I	92.3	Very high	91.2	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	129.2	174.7	-60.2	175.3	0	0	0	107.9	P394 F396 V480 K483 S551 S552	P394-I577 HydrophobicContact CG-CG1 4.41Å; P394-I577 HydrophobicContact CG-CG2 3.98Å; F396-I577 HydrophobicContact CE1-CD1 4.22Å; F396-I577 HydrophobicContact CZ-CD1 4.11Å; V480-I577 HydrophobicContact CG2-CD1 3.69Å; K483-I577 HydrophobicContact CD-CG2 4.49Å; K483-I577 HydrophobicContact CG-CG2 4.23Å; S551-I577 WeakPolarHBondContact CA-O 3.3Å; S551-I577 WeakPolarHBondContact CB-O 3.33Å; S552-I577 PolarHBondContact N-O 3.32Å; S552-I577 PolarHBondContact O-N 2.85Å; S552-I577 VanDerWaalsContact O-N 3.1Å
578	K	91.6	Very high	91.8	Very high	102 Å²	102	53.4 Å²	53.4	44%	0.443	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-68	144.3	175.9	-75.5	170.6	-172.6	166.8	0	111.9	K483 E575	K483-K578 PolarHBondContact NZ-O 3.38Å; E575-K578 HydrophobicContact CG-CG 4.27Å; E575-K578 WeakPolarHBondContact OE1-CE 3.48Å; E575-K578 WeakPolarHBondContact OE1-CG 3.44Å
579	A	91.6	Very high	92.5	Very high	29 Å²	29	55.3 Å²	55.3	24%	0.24	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-58.9	154.1	169	0	0	0	0	0	111.7	F549 S581	F549-A579 CarbonylContact O-C 3.57Å; F549-A579 VanDerWaalsContact O-CA 3.29Å; F549-A579 WeakPolarHBondContact O-CA 3.48Å; A579-S581 PolarHBondContact O-N 3.09Å
580	N	91.6	Very high	93.2	Very high	10 Å²	10	48.1 Å²	48.1	5%	0.053	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-56.4	125.3	171.4	-64.2	-19.2	0	0	0	109.6	T317 M318 K483 F549	T317-N580 PolarHBondContact O-ND2 3.47Å; T317-N580 PolarHBondContact O-OD1 3.37Å; M318-N580 PolarHBondContact N-ND2 2.96Å; M318-N580 PolarHBondContact O-ND2 3.23Å; K483-N580 WeakPolarHBondContact CE-OD1 3.45Å; K483-N580 PolarHBondContact NZ-OD1 2.94Å; F549-N580 HydrophobicContact CB-CB 4.23Å; F549-N580 PolarHBondContact O-N 2.99Å
581	S	89.4	Confident	93.7	Very high	79 Å²	79	44.4 Å²	44.4	55%	0.552	23%	0.225	S	C	*	.			trans	-100.3	-22.7	-178.2	59.1	0	0	0	0	113.5	A579	A579-S581 PolarHBondContact O-N 3.09Å
582	I	93.8	Very high	94	Very high	30 Å²	30	48 Å²	48	15%	0.154	24%	0.24	C	C	.	.	S	Bend	trans	-90.2	117.6	-176.9	-50.6	-56.4	0	0	0	109.7	M318 D319 Q388 I389 W586	M318-I582 CarbonylContact C-O 3.52Å; M318-I582 WeakPolarHBondContact CA-O 3.4Å; M318-I582 VanDerWaalsContact CB-O 3.31Å; M318-I582 WeakPolarHBondContact CB-O 3.49Å; M318-I582 HydrophobicContact CE-CB 4.47Å; M318-I582 HydrophobicContact CE-CG2 3.66Å; D319-I582 PolarHBondContact N-O 3Å; Q388-I582 HydrophobicContact CB-CD1 3.98Å; Q388-I582 HydrophobicContact CB-CG1 4.3Å; I389-I582 HydrophobicContact CG1-CB 4.11Å; I389-I582 HydrophobicContact CG1-CG1 4.1Å; I389-I582 HydrophobicContact CG1-CG2 4.27Å; I582-W586 HydrophobicContact CG2-CB 4.4Å; I582-W586 HydrophobicContact CG2-CG 4.47Å
583	H	94.7	Very high	94.2	Very high	45 Å²	45	45.5 Å²	45.5	21%	0.208	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-74.6	138.1	-179.2	-171.8	-89.8	0	0	0	112.7	M318 N321 F322 A585 W586	M318-H583 VanDerWaalsContact CE-O 3.28Å; M318-H583 WeakPolarHBondContact CE-O 3.43Å; N321-H583 PolarHBondContact O-NE2 3.44Å; F322-H583 AromaticContact CD1-CE1 3.81Å; F322-H583 AromaticContact CD2-CE1 3.71Å; F322-H583 AromaticContact CD2-NE2 3.8Å; F322-H583 AromaticContact CE1-CE1 3.61Å; F322-H583 AromaticContact CE2-CE1 3.5Å; F322-H583 VanDerWaalsContact CE2-CE1 3.5Å; F322-H583 WeakPolarHBondContact CE2-CE1 3.37Å; F322-H583 AromaticContact CE2-NE2 3.97Å; F322-H583 AromaticContact CG-CE1 3.88Å; F322-H583 AromaticContact CZ-CE1 3.45Å; F322-H583 VanDerWaalsContact CZ-CE1 3.45Å; F322-H583 WeakPolarHBondContact CZ-CE1 3.34Å; H583-A585 WeakPolarHBondContact ND1-CB 3.47Å; H583-A585 PolarHBondContact ND1-N 3.07Å; H583-A585 PolarHBondContact O-N 3.47Å; H583-W586 WeakPolarHBondContact O-CB 3.42Å; H583-W586 PolarHBondContact O-N 2.91Å
584	M	95.1	Very high	94.4	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.025	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-55	-26.5	-178.4	-77	-179.5	-173.3	0	0	114.1	A315 M318 D319 F322 I327 P329 M332 W586 Q587	A315-M584 HydrophobicContact CB-CE 4.42Å; A315-M584 WeakPolarHBondContact O-CE 3.4Å; M318-M584 HydrophobicContact CB-CB 4.49Å; M318-M584 HydrophobicContact CB-CG 3.58Å; M318-M584 HydrophobicContact SD-CG 4.42Å; D319-M584 WeakPolarHBondContact O-CG 3.34Å; D319-M584 PolarHBondContact O-N 3.22Å; F322-M584 HydrophobicContact CE2-CB 4.11Å; F322-M584 HydrophobicContact CZ-CB 4.48Å; I327-M584 HydrophobicContact CG2-SD 4.36Å; P329-M584 HydrophobicContact CB-CE 4.39Å; P329-M584 HydrophobicContact CG-CE 3.88Å; M332-M584 HydrophobicContact CG-SD 4.35Å; M332-M584 HydrophobicContact SD-CB 4.21Å; M584-W586 PolarHBondContact O-N 3.45Å; M584-Q587 WeakPolarHBondContact O-CB 3.41Å; M584-Q587 PolarHBondContact O-N 3.15Å
585	A	94.4	Very high	94.5	Very high	32 Å²	32	40.3 Å²	40.3	26%	0.264	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-56.7	-22.2	175	0	0	0	0	0	113.7	F322 H583 Q587 I588	F322-A585 HydrophobicContact CE1-CB 4.05Å; F322-A585 HydrophobicContact CZ-CB 4.03Å; H583-A585 WeakPolarHBondContact ND1-CB 3.47Å; H583-A585 PolarHBondContact ND1-N 3.07Å; H583-A585 PolarHBondContact O-N 3.47Å; A585-Q587 PolarHBondContact O-N 2.99Å; A585-I588 HydrophobicContact CB-CD1 4.03Å; A585-I588 VanDerWaalsContact O-CB 3.3Å; A585-I588 WeakPolarHBondContact O-CB 3.34Å; A585-I588 WeakPolarHBondContact O-CG1 3.4Å; A585-I588 PolarHBondContact O-N 3.21Å
586	W	95.7	Very high	94.6	Very high	164 Å²	164	37.5 Å²	37.5	62%	0.621	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-65.2	-12.7	173	-79.9	106.9	0	0	0	114	M318 V385 I582 H583 M584 P589	M318-W586 HydrophobicContact CE-CB 4.2Å; V385-W586 HydrophobicContact CG2-CB 4.26Å; V385-W586 WeakPolarHBondContact CG2-O 3.28Å; I582-W586 HydrophobicContact CG2-CB 4.4Å; I582-W586 HydrophobicContact CG2-CG 4.47Å; H583-W586 WeakPolarHBondContact O-CB 3.42Å; H583-W586 PolarHBondContact O-N 2.91Å; M584-W586 PolarHBondContact O-N 3.45Å; W586-P589 WeakPolarHBondContact O-CD 3.42Å
587	Q	95.8	Very high	94.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-81	-14.3	168.2	-64.6	-171.2	-37.4	0	0	113.3	W311 M318 M332 M584 A585 Q590 Y591	W311-Q587 PolarHBondContact O-NE2 3.28Å; M318-Q587 HydrophobicContact CE-CG 4.09Å; M318-Q587 HydrophobicContact SD-CG 3.77Å; M332-Q587 HydrophobicContact CE-CB 3.99Å; M584-Q587 WeakPolarHBondContact O-CB 3.41Å; M584-Q587 PolarHBondContact O-N 3.15Å; A585-Q587 PolarHBondContact O-N 2.99Å; Q587-Q590 HydrophobicContact CB-CG 4.22Å; Q587-Q590 WeakPolarHBondContact O-CG 3.4Å; Q587-Q590 PolarHBondContact O-N 3.35Å; Q587-Y591 HydrophobicContact CB-CD2 4.17Å; Q587-Y591 HydrophobicContact CB-CE2 4.26Å; Q587-Y591 VanDerWaalsContact O-CD2 3.31Å; Q587-Y591 WeakPolarHBondContact O-CD2 3.43Å; Q587-Y591 PolarHBondContact O-N 3.45Å; Q587-Y591 VanDerWaalsContact O-N 3.11Å
588	I	95.6	Very high	95	Very high	71 Å²	71	38.4 Å²	38.4	36%	0.364	20%	0.2	S	C	.	.	H	α-helix	trans	-59.4	-42.1	-179.2	-64.1	170.9	0	0	0	112.1	M332 A585 Q590 Y591 F592	M332-I588 HydrophobicContact CE-CG1 4.48Å; A585-I588 HydrophobicContact CB-CD1 4.03Å; A585-I588 VanDerWaalsContact O-CB 3.3Å; A585-I588 WeakPolarHBondContact O-CB 3.34Å; A585-I588 WeakPolarHBondContact O-CG1 3.4Å; A585-I588 PolarHBondContact O-N 3.21Å; I588-Q590 PolarHBondContact O-N 3.31Å; I588-Y591 PolarHBondContact O-N 2.82Å; I588-F592 WeakPolarHBondContact O-CB 3.34Å; I588-F592 PolarHBondContact O-N 3.11Å
589	P	96.8	Very high	95	Very high	61 Å²	61	33.8 Å²	33.8	40%	0.396	18%	0.18	S	C	.	.	H	α-helix	trans	-57.3	-43.4	175.1	-28.1	36.2	0	0	0	114.9	W586 F592 L593	W586-P589 WeakPolarHBondContact O-CD 3.42Å; P589-F592 PolarHBondContact O-N 3.28Å; P589-L593 WeakPolarHBondContact O-CG 3.44Å; P589-L593 PolarHBondContact O-N 2.76Å
590	Q	97	Very high	95.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.4	-40.9	177.3	59.7	-171.1	60.7	0	0	111.3	W311 A378 A381 A382 Q587 I588 F592 L593 M594	W311-Q590 VanDerWaalsContact CD2-NE2 3.25Å; W311-Q590 HydrophobicContact CE3-CG 4.23Å; W311-Q590 HydrophobicContact CH2-CB 3.8Å; W311-Q590 HydrophobicContact CH2-CG 3.91Å; W311-Q590 HydrophobicContact CZ2-CB 4.11Å; W311-Q590 HydrophobicContact CZ2-CG 4.26Å; W311-Q590 HydrophobicContact CZ3-CB 4.26Å; W311-Q590 HydrophobicContact CZ3-CG 3.88Å; A378-Q590 WeakPolarHBondContact CB-O 3.25Å; A378-Q590 WeakPolarHBondContact O-CB 3.41Å; A381-Q590 HydrophobicContact CB-CB 4.13Å; A382-Q590 HydrophobicContact CB-CB 4.45Å; Q587-Q590 HydrophobicContact CB-CG 4.22Å; Q587-Q590 WeakPolarHBondContact O-CG 3.4Å; Q587-Q590 PolarHBondContact O-N 3.35Å; I588-Q590 PolarHBondContact O-N 3.31Å; Q590-F592 VanDerWaalsContact C-N 3.35Å; Q590-F592 PolarHBondContact O-N 3Å; Q590-L593 PolarHBondContact O-N 3.36Å; Q590-M594 WeakPolarHBondContact O-CB 3.43Å; Q590-M594 PolarHBondContact O-N 3.48Å
591	Y	96.6	Very high	95.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-42.3	172.8	-85.9	-78	0	0	0	111.8	Q307 W311 M332 V335 N336 Q587 I588 M594 T595	Q307-Y591 HydrophobicContact CB-CE1 4.17Å; Q307-Y591 HydrophobicContact CG-CD1 4.45Å; Q307-Y591 HydrophobicContact CG-CE1 3.91Å; Q307-Y591 VanDerWaalsContact OE1-CD1 3.25Å; W311-Y591 HydrophobicContact CE3-CD1 4.18Å; W311-Y591 HydrophobicContact CE3-CD2 4.02Å; W311-Y591 AromaticContact CE3-CE1 3.88Å; W311-Y591 HydrophobicContact CE3-CE1 3.88Å; W311-Y591 AromaticContact CE3-CE2 3.69Å; W311-Y591 HydrophobicContact CE3-CE2 3.69Å; W311-Y591 HydrophobicContact CE3-CG 4.24Å; W311-Y591 AromaticContact CE3-CZ 3.62Å; W311-Y591 AromaticContact CZ3-CD1 3.84Å; W311-Y591 HydrophobicContact CZ3-CD1 3.84Å; W311-Y591 AromaticContact CZ3-CD2 3.99Å; W311-Y591 HydrophobicContact CZ3-CD2 3.99Å; W311-Y591 AromaticContact CZ3-CE1 4Å; W311-Y591 HydrophobicContact CZ3-CE1 4Å; W311-Y591 HydrophobicContact CZ3-CE2 4.13Å; W311-Y591 AromaticContact CZ3-CG 3.83Å; W311-Y591 HydrophobicContact CZ3-CG 3.83Å; M332-Y591 HydrophobicContact CB-CE2 4.15Å; M332-Y591 HydrophobicContact CE-CE2 4.42Å; V335-Y591 HydrophobicContact CB-CD1 4.36Å; V335-Y591 HydrophobicContact CB-CG 4.17Å; V335-Y591 HydrophobicContact CG1-CG 4.11Å; N336-Y591 HydrophobicContact CB-CD1 4.3Å; Q587-Y591 HydrophobicContact CB-CD2 4.17Å; Q587-Y591 HydrophobicContact CB-CE2 4.26Å; Q587-Y591 VanDerWaalsContact O-CD2 3.31Å; Q587-Y591 WeakPolarHBondContact O-CD2 3.43Å; Q587-Y591 PolarHBondContact O-N 3.45Å; Q587-Y591 VanDerWaalsContact O-N 3.11Å; I588-Y591 PolarHBondContact O-N 2.82Å; Y591-M594 PolarHBondContact O-N 2.94Å; Y591-T595 VanDerWaalsContact O-CB 3.3Å; Y591-T595 WeakPolarHBondContact O-CB 3.34Å; Y591-T595 PolarHBondContact O-N 3.39Å; Y591-T595 PolarHBondContact O-OG1 3.38Å
592	F	97.4	Very high	95.3	Very high	89 Å²	89	29.5 Å²	29.5	39%	0.39	15%	0.148	S	C	.	.	H	α-helix	trans	-59.4	-48.7	177.1	177.1	-90.3	0	0	0	112.5	L339 M343 I588 P589 Q590 S596	L339-F592 HydrophobicContact CD1-CB 4.31Å; L339-F592 HydrophobicContact CD2-CD2 4.2Å; M343-F592 HydrophobicContact CE-CD2 4.08Å; M343-F592 HydrophobicContact CE-CE2 3.41Å; M343-F592 VanDerWaalsContact CE-CE2 3.41Å; M343-F592 HydrophobicContact CE-CZ 4.32Å; M343-F592 HydrophobicContact SD-CE2 4.08Å; I588-F592 WeakPolarHBondContact O-CB 3.34Å; I588-F592 PolarHBondContact O-N 3.11Å; P589-F592 PolarHBondContact O-N 3.28Å; Q590-F592 VanDerWaalsContact C-N 3.35Å; Q590-F592 PolarHBondContact O-N 3Å; F592-S596 VanDerWaalsContact O-CB 3.26Å; F592-S596 WeakPolarHBondContact O-CB 3.37Å; F592-S596 PolarHBondContact O-N 3.15Å; F592-S596 PolarHBondContact O-OG 3.43Å
593	L	97.8	Very high	94.8	Very high	41 Å²	41	31 Å²	31	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-43.5	178.7	-71.2	171.4	0	0	0	111.6	L374 L377 A378 A381 P589 Q590 S596 G597	L374-L593 HydrophobicContact CD2-CD2 4.25Å; L377-L593 HydrophobicContact CB-CD1 4.14Å; A378-L593 HydrophobicContact CB-CB 3.7Å; A381-L593 HydrophobicContact CB-CD1 4.39Å; P589-L593 WeakPolarHBondContact O-CG 3.44Å; P589-L593 PolarHBondContact O-N 2.76Å; Q590-L593 PolarHBondContact O-N 3.36Å; L593-S596 PolarHBondContact O-N 3.37Å; L593-G597 PolarHBondContact O-N 2.95Å
594	M	97.4	Very high	94.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.7	-46.8	178.2	-176	57	73.2	0	0	111.7	L303 F304 W311 A375 A378 F379 Q590 Y591 G597 E598	L303-M594 HydrophobicContact CB-CE 4.04Å; F304-M594 HydrophobicContact CB-SD 4.25Å; F304-M594 HydrophobicContact CD2-CG 3.92Å; F304-M594 HydrophobicContact CD2-SD 3.96Å; F304-M594 HydrophobicContact CE2-CG 4.47Å; W311-M594 HydrophobicContact CH2-CB 3.9Å; W311-M594 HydrophobicContact CH2-CE 4.43Å; W311-M594 HydrophobicContact CH2-CG 4.34Å; W311-M594 HydrophobicContact CZ2-CE 4.46Å; W311-M594 HydrophobicContact CZ3-CB 4.46Å; A375-M594 HydrophobicContact CB-CE 3.93Å; A375-M594 HydrophobicContact CB-SD 3.75Å; A378-M594 HydrophobicContact CB-CB 3.97Å; A378-M594 HydrophobicContact CB-CE 4.1Å; F379-M594 HydrophobicContact CD2-CE 3.79Å; F379-M594 HydrophobicContact CE2-CE 3.56Å; Q590-M594 WeakPolarHBondContact O-CB 3.43Å; Q590-M594 PolarHBondContact O-N 3.48Å; Y591-M594 PolarHBondContact O-N 2.94Å; M594-G597 CarbonylContact O-C 3.58Å; M594-G597 WeakPolarHBondContact O-CA 3.44Å; M594-G597 PolarHBondContact O-N 2.94Å; M594-G597 VanDerWaalsContact O-N 3.16Å; M594-E598 PolarHBondContact O-N 2.95Å
595	T	95.6	Very high	94.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-42.2	179.2	-48	0	0	0	0	111.2	N336 L339 I340 Y591 G597 E598 V599	N336-T595 WeakPolarHBondContact OD1-CG2 2.97Å; N336-T595 PolarHBondContact OD1-OG1 3.39Å; L339-T595 HydrophobicContact CB-CG2 3.6Å; L339-T595 WeakPolarHBondContact CD1-OG1 3.37Å; I340-T595 HydrophobicContact CB-CG2 4.44Å; I340-T595 HydrophobicContact CG1-CG2 3.55Å; Y591-T595 VanDerWaalsContact O-CB 3.3Å; Y591-T595 WeakPolarHBondContact O-CB 3.34Å; Y591-T595 PolarHBondContact O-N 3.39Å; Y591-T595 PolarHBondContact O-OG1 3.38Å; T595-G597 PolarHBondContact O-N 3.14Å; T595-E598 WeakPolarHBondContact O-CB 3.45Å; T595-E598 PolarHBondContact O-N 3.42Å; T595-E598 VanDerWaalsContact O-N 3.17Å; T595-V599 WeakPolarHBondContact O-CG2 3.49Å; T595-V599 PolarHBondContact O-N 2.94Å
596	S	95.5	Very high	93.5	Very high	18 Å²	18	30.7 Å²	30.7	13%	0.126	15%	0.154	C	C	.	.	H	α-helix	trans	-59.6	-40.7	174.2	-62	0	0	0	0	111	F592 L593 V600	F592-S596 VanDerWaalsContact O-CB 3.26Å; F592-S596 WeakPolarHBondContact O-CB 3.37Å; F592-S596 PolarHBondContact O-N 3.15Å; F592-S596 PolarHBondContact O-OG 3.43Å; L593-S596 PolarHBondContact O-N 3.37Å; S596-V600 WeakPolarHBondContact O-CG2 3.15Å; S596-V600 PolarHBondContact O-N 2.98Å
597	G	96.3	Very high	92.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-46.5	172.7	0	0	0	0	0	112.7	L593 M594 T595 V600 F601	L593-G597 PolarHBondContact O-N 2.95Å; M594-G597 CarbonylContact O-C 3.58Å; M594-G597 WeakPolarHBondContact O-CA 3.44Å; M594-G597 PolarHBondContact O-N 2.94Å; M594-G597 VanDerWaalsContact O-N 3.16Å; T595-G597 PolarHBondContact O-N 3.14Å; G597-V600 WeakPolarHBondContact O-CG2 3.5Å; G597-V600 PolarHBondContact O-N 3.15Å; G597-F601 WeakPolarHBondContact O-CB 3.46Å; G597-F601 PolarHBondContact O-N 3.35Å
598	E	94.5	Very high	92.5	Very high	30 Å²	30	28.9 Å²	28.9	14%	0.14	15%	0.153	C	C	.	.	H	α-helix	trans	-58.6	-48.4	176.8	-175.3	-169.6	-177.1	0	0	111.9	F300 F304 N336 I340 M594 T595 V600 F601 S602	F300-E598 HydrophobicContact CZ-CB 4.3Å; F304-E598 HydrophobicContact CD2-CB 4.34Å; F304-E598 HydrophobicContact CD2-CG 4.43Å; F304-E598 HydrophobicContact CE2-CB 3.93Å; F304-E598 HydrophobicContact CE2-CG 3.81Å; F304-E598 WeakPolarHBondContact CE2-OE2 3.41Å; F304-E598 HydrophobicContact CZ-CG 4.24Å; F304-E598 WeakPolarHBondContact CZ-OE1 3.14Å; F304-E598 WeakPolarHBondContact CZ-OE2 3.3Å; N336-E598 PolarHBondContact OD1-OE2 3.24Å; I340-E598 WeakPolarHBondContact CD1-OE2 3.31Å; M594-E598 PolarHBondContact O-N 2.95Å; T595-E598 WeakPolarHBondContact O-CB 3.45Å; T595-E598 PolarHBondContact O-N 3.42Å; T595-E598 VanDerWaalsContact O-N 3.17Å; E598-V600 VanDerWaalsContact C-N 3.34Å; E598-V600 PolarHBondContact O-N 3.47Å; E598-F601 PolarHBondContact O-N 3.38Å; E598-S602 WeakPolarHBondContact O-CA 3.42Å; E598-S602 VanDerWaalsContact O-CB 3.23Å; E598-S602 WeakPolarHBondContact O-CB 3.3Å; E598-S602 PolarHBondContact O-N 2.93Å
599	V	92.7	Very high	91.9	Very high	6 Å²	6	25.8 Å²	25.8	4%	0.036	14%	0.137	C	C	.	.	I	π-helix	trans	-59.1	-46.7	-178.2	172	0	0	0	0	110.6	M343 V344 V347 T595 V603	M343-V599 HydrophobicContact CB-CG2 4.06Å; V344-V599 HydrophobicContact CG2-CG1 3.96Å; V344-V599 HydrophobicContact CG2-CG2 3.83Å; V347-V599 HydrophobicContact CB-CG1 4.04Å; V347-V599 HydrophobicContact CG1-CG1 4.24Å; V347-V599 HydrophobicContact CG2-CG1 3.86Å; T595-V599 WeakPolarHBondContact O-CG2 3.49Å; T595-V599 PolarHBondContact O-N 2.94Å; V599-V603 WeakPolarHBondContact O-CB 3.39Å
600	V	93.8	Very high	90.9	Very high	13 Å²	13	28.9 Å²	28.9	8%	0.079	14%	0.142	C	C	.	.	I	π-helix	trans	-79.1	-22.8	-178.9	-56.4	0	0	0	0	113.5	V347 L374 S596 G597 E598 T604	V347-V600 HydrophobicContact CG1-CG1 4.21Å; L374-V600 HydrophobicContact CD1-CG2 4.47Å; S596-V600 WeakPolarHBondContact O-CG2 3.15Å; S596-V600 PolarHBondContact O-N 2.98Å; G597-V600 WeakPolarHBondContact O-CG2 3.5Å; G597-V600 PolarHBondContact O-N 3.15Å; E598-V600 VanDerWaalsContact C-N 3.34Å; E598-V600 PolarHBondContact O-N 3.47Å; V600-T604 WeakPolarHBondContact O-CB 3.43Å; V600-T604 PolarHBondContact O-OG1 2.77Å
601	F	94.5	Very high	90.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-89.6	-57.2	179.5	176.8	-96.5	0	0	0	113.2	L297 F300 W301 M368 M372 G597 E598 G605 W625	L297-F601 HydrophobicContact CB-CZ 4.06Å; L297-F601 HydrophobicContact CD2-CZ 4.43Å; L297-F601 HydrophobicContact CG-CE2 4.23Å; L297-F601 HydrophobicContact CG-CZ 3.75Å; F300-F601 HydrophobicContact CB-CD1 4.42Å; F300-F601 HydrophobicContact CB-CE1 3.83Å; F300-F601 HydrophobicContact CB-CE2 4.25Å; F300-F601 HydrophobicContact CB-CZ 3.71Å; F300-F601 AromaticContact CD1-CD1 3.34Å; F300-F601 HydrophobicContact CD1-CD1 3.34Å; F300-F601 AromaticContact CD1-CE1 3.28Å; F300-F601 HydrophobicContact CD1-CE1 3.28Å; F300-F601 HydrophobicContact CD1-CG 4.18Å; F300-F601 HydrophobicContact CD1-CZ 4.07Å; F300-F601 HydrophobicContact CD2-CB 4.41Å; F300-F601 AromaticContact CD2-CD1 3.95Å; F300-F601 HydrophobicContact CD2-CD1 3.95Å; F300-F601 HydrophobicContact CD2-CD2 4.23Å; F300-F601 HydrophobicContact CD2-CE1 4.22Å; F300-F601 HydrophobicContact CD2-CE2 4.5Å; F300-F601 AromaticContact CD2-CG 3.94Å; F300-F601 HydrophobicContact CD2-CG 3.94Å; F300-F601 HydrophobicContact CD2-CZ 4.46Å; F300-F601 AromaticContact CE1-CD1 3.46Å; F300-F601 HydrophobicContact CE1-CD1 3.46Å; F300-F601 VanDerWaalsContact CE1-CD1 3.46Å; F300-F601 AromaticContact CE1-CE1 3.89Å; F300-F601 HydrophobicContact CE1-CE1 3.89Å; F300-F601 HydrophobicContact CE1-CG 4.21Å; F300-F601 HydrophobicContact CE2-CB 3.97Å; F300-F601 HydrophobicContact CE2-CD1 4.03Å; F300-F601 AromaticContact CE2-CG 3.96Å; F300-F601 HydrophobicContact CE2-CG 3.96Å; F300-F601 AromaticContact CG-CD1 3.62Å; F300-F601 HydrophobicContact CG-CD1 3.62Å; F300-F601 HydrophobicContact CG-CD2 4.37Å; F300-F601 AromaticContact CG-CE1 3.49Å; F300-F601 HydrophobicContact CG-CE1 3.49Å; F300-F601 VanDerWaalsContact CG-CE1 3.49Å; F300-F601 HydrophobicContact CG-CE2 4.28Å; F300-F601 HydrophobicContact CG-CG 4.06Å; F300-F601 AromaticContact CG-CZ 3.82Å; F300-F601 HydrophobicContact CG-CZ 3.82Å; F300-F601 HydrophobicContact CZ-CB 4.07Å; F300-F601 AromaticContact CZ-CD1 3.82Å; F300-F601 HydrophobicContact CZ-CD1 3.82Å; F300-F601 HydrophobicContact CZ-CG 4.12Å; W301-F601 HydrophobicContact CZ2-CE1 4.16Å; M368-F601 HydrophobicContact CB-CD2 3.89Å; M368-F601 HydrophobicContact CB-CE2 4.36Å; M368-F601 HydrophobicContact CE-CD2 4.09Å; M368-F601 HydrophobicContact CE-CE2 3.71Å; M368-F601 HydrophobicContact CE-CZ 4.21Å; M368-F601 HydrophobicContact CG-CD2 4.24Å; M372-F601 HydrophobicContact CE-CD2 4.45Å; M372-F601 HydrophobicContact CE-CE2 3.52Å; M372-F601 HydrophobicContact CE-CZ 4.19Å; M372-F601 HydrophobicContact CG-CD2 4.03Å; M372-F601 HydrophobicContact CG-CE2 3.93Å; G597-F601 WeakPolarHBondContact O-CB 3.46Å; G597-F601 PolarHBondContact O-N 3.35Å; E598-F601 PolarHBondContact O-N 3.38Å; F601-G605 VanDerWaalsContact O-CA 3.31Å; F601-G605 WeakPolarHBondContact O-CA 3.11Å; F601-G605 PolarHBondContact O-N 2.9Å; F601-W625 HydrophobicContact CE1-CH2 4.18Å; F601-W625 HydrophobicContact CE1-CZ2 4.47Å
602	S	89.5	Confident	89.7	Confident	14 Å²	14	32.4 Å²	32.4	10%	0.098	17%	0.165	C	C	.	.	I	π-helix	trans	-75.4	-50.2	-169.8	-177.3	0	0	0	0	111.9	E598 G605 L606	E598-S602 WeakPolarHBondContact O-CA 3.42Å; E598-S602 VanDerWaalsContact O-CB 3.23Å; E598-S602 WeakPolarHBondContact O-CB 3.3Å; E598-S602 PolarHBondContact O-N 2.93Å; S602-G605 PolarHBondContact O-N 3.41Å; S602-L606 WeakPolarHBondContact O-CB 3.16Å; S602-L606 WeakPolarHBondContact O-CG 3.42Å; S602-L606 PolarHBondContact O-N 3.32Å
603	V	84.4	Confident	88.8	Confident	62 Å²	62	28.4 Å²	28.4	38%	0.376	15%	0.148	S	C	.	.	I	π-helix	trans	-62.2	-51.2	179.5	-176.7	0	0	0	0	109.9	V599 G605 L606 E607	V599-V603 WeakPolarHBondContact O-CB 3.39Å; V603-G605 VanDerWaalsContact C-N 3.34Å; V603-G605 PolarHBondContact O-N 3.48Å; V603-L606 PolarHBondContact O-N 3.25Å; V603-E607 PolarHBondContact O-N 3.1Å
604	T	87.4	Confident	88	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-41.4	176.3	-53.1	0	0	0	0	112.3	P364 R367 M368 V600 E607 F608	P364-T604 HydrophobicContact CB-CG2 3.64Å; P364-T604 WeakPolarHBondContact O-CG2 3.24Å; R367-T604 HydrophobicContact CB-CG2 4.01Å; M368-T604 HydrophobicContact CG-CG2 4.48Å; V600-T604 WeakPolarHBondContact O-CB 3.43Å; V600-T604 PolarHBondContact O-OG1 2.77Å; T604-E607 PolarHBondContact O-N 3.43Å; T604-F608 VanDerWaalsContact O-CB 3.31Å; T604-F608 WeakPolarHBondContact O-CB 3.38Å; T604-F608 PolarHBondContact O-N 2.93Å
605	G	87.4	Confident	86.8	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.9	-40.6	-177.9	0	0	0	0	0	112.1	F601 S602 V603 S609	F601-G605 VanDerWaalsContact O-CA 3.31Å; F601-G605 WeakPolarHBondContact O-CA 3.11Å; F601-G605 PolarHBondContact O-N 2.9Å; S602-G605 PolarHBondContact O-N 3.41Å; V603-G605 VanDerWaalsContact C-N 3.34Å; V603-G605 PolarHBondContact O-N 3.48Å; G605-S609 VanDerWaalsContact O-CB 3.24Å; G605-S609 WeakPolarHBondContact O-CB 3.06Å; G605-S609 PolarHBondContact O-N 3.45Å; G605-S609 PolarHBondContact O-OG 3.19Å
606	L	82.4	Confident	85.8	Confident	73 Å²	73	33 Å²	33	38%	0.382	18%	0.179	S	C	.	.	H	α-helix	trans	-63.8	-43.8	172.5	-74.7	170.1	0	0	0	111.8	S602 V603 S609 Y610 W625	S602-L606 WeakPolarHBondContact O-CB 3.16Å; S602-L606 WeakPolarHBondContact O-CG 3.42Å; S602-L606 PolarHBondContact O-N 3.32Å; V603-L606 PolarHBondContact O-N 3.25Å; L606-S609 WeakPolarHBondContact O-CB 3.34Å; L606-S609 PolarHBondContact O-N 3.21Å; L606-Y610 WeakPolarHBondContact O-CB 3.28Å; L606-Y610 PolarHBondContact O-N 3.41Å; L606-W625 HydrophobicContact CD2-CD2 3.94Å; L606-W625 HydrophobicContact CD2-CG 3.86Å; L606-W625 HydrophobicContact CD2-CZ2 4.47Å; L606-W625 HydrophobicContact CG-CD2 4.44Å; L606-W625 HydrophobicContact CG-CZ2 4.1Å
607	E	82	Confident	85	Confident	122 Å²	122	32.1 Å²	32.1	57%	0.57	17%	0.173	S	C	*	.	H	α-helix	trans	-62.3	-46.7	176.1	-171.9	-169.5	175.2	0	0	111.9	V603 T604 S609 Y610 S611	V603-E607 PolarHBondContact O-N 3.1Å; T604-E607 PolarHBondContact O-N 3.43Å; E607-S609 VanDerWaalsContact C-N 3.32Å; E607-S609 PolarHBondContact O-N 2.87Å; E607-Y610 PolarHBondContact O-N 3.35Å; E607-S611 PolarHBondContact O-N 3.17Å; E607-S611 PolarHBondContact O-OG 2.93Å
608	F	87.3	Confident	83.9	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.018	19%	0.185	C	C	.	.	H	α-helix	trans	-56.8	-48.4	174.7	168	-99.7	0	0	0	110.8	V290 L293 P364 L365 T604 Y610 S611 Q612 Y673 Y675	V290-F608 HydrophobicContact CG1-CE1 4.2Å; L293-F608 HydrophobicContact CD1-CE1 3.94Å; L293-F608 HydrophobicContact CD1-CZ 3.71Å; P364-F608 HydrophobicContact CB-CB 4.1Å; P364-F608 HydrophobicContact CB-CD2 4.2Å; L365-F608 HydrophobicContact CD1-CE2 4.35Å; L365-F608 HydrophobicContact CD1-CZ 4.41Å; L365-F608 HydrophobicContact CD2-CD1 4.26Å; L365-F608 HydrophobicContact CD2-CD2 4.28Å; L365-F608 HydrophobicContact CD2-CE1 3.95Å; L365-F608 HydrophobicContact CD2-CE2 3.95Å; L365-F608 HydrophobicContact CD2-CG 4.41Å; L365-F608 HydrophobicContact CD2-CZ 3.78Å; L365-F608 HydrophobicContact CG-CE2 4.12Å; L365-F608 HydrophobicContact CG-CZ 4.35Å; T604-F608 VanDerWaalsContact O-CB 3.31Å; T604-F608 WeakPolarHBondContact O-CB 3.38Å; T604-F608 PolarHBondContact O-N 2.93Å; F608-Y610 VanDerWaalsContact C-N 3.27Å; F608-Y610 PolarHBondContact O-N 3.38Å; F608-S611 PolarHBondContact O-N 3.23Å; F608-S611 PolarHBondContact O-OG 3.24Å; F608-Q612 HydrophobicContact CD2-CG 3.85Å; F608-Q612 HydrophobicContact CE1-CG 4.31Å; F608-Q612 HydrophobicContact CE2-CG 3.48Å; F608-Q612 VanDerWaalsContact CE2-CG 3.48Å; F608-Q612 HydrophobicContact CG-CG 4.42Å; F608-Q612 HydrophobicContact CZ-CG 3.74Å; F608-Q612 WeakPolarHBondContact O-CB 2.78Å; F608-Q612 VanDerWaalsContact O-CG 3.32Å; F608-Q612 WeakPolarHBondContact O-CG 3.17Å; F608-Q612 PolarHBondContact O-N 3.05Å; F608-Y673 HydrophobicContact CE2-CD1 4.43Å; F608-Y673 AromaticContact CE2-CE1 3.81Å; F608-Y673 HydrophobicContact CE2-CE1 3.81Å; F608-Y673 HydrophobicContact CZ-CD1 4.3Å; F608-Y673 AromaticContact CZ-CE1 3.63Å; F608-Y673 HydrophobicContact CZ-CE1 3.63Å; F608-Y673 HydrophobicContact CZ-CE2 4.48Å; F608-Y673 AromaticContact CZ-CZ 3.74Å; F608-Y675 AromaticContact CD2-CE1 3.92Å; F608-Y675 HydrophobicContact CD2-CE1 3.92Å; F608-Y675 HydrophobicContact CE2-CD1 4.06Å; F608-Y675 AromaticContact CE2-CE1 3.65Å; F608-Y675 HydrophobicContact CE2-CE1 3.65Å
609	S	83.9	Confident	83	Confident	6 Å²	6	35.9 Å²	35.9	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-60.6	-39.7	-179.8	-60.5	0	0	0	0	111.9	Y294 G605 L606 E607 A613	Y294-S609 WeakPolarHBondContact OH-CB 3.29Å; Y294-S609 PolarHBondContact OH-OG 3.4Å; G605-S609 VanDerWaalsContact O-CB 3.24Å; G605-S609 WeakPolarHBondContact O-CB 3.06Å; G605-S609 PolarHBondContact O-N 3.45Å; G605-S609 PolarHBondContact O-OG 3.19Å; L606-S609 WeakPolarHBondContact O-CB 3.34Å; L606-S609 PolarHBondContact O-N 3.21Å; E607-S609 VanDerWaalsContact C-N 3.32Å; E607-S609 PolarHBondContact O-N 2.87Å; S609-A613 WeakPolarHBondContact O-CB 3.4Å; S609-A613 PolarHBondContact O-N 2.64Å
610	Y	76.3	Confident	82.4	Confident	126 Å²	126	36.2 Å²	36.2	49%	0.494	20%	0.198	S	C	.	.	H	α-helix	trans	-69.9	-40.6	177.2	-165.7	-88.5	0	0	0	112.7	L606 E607 F608 A613 K618	L606-Y610 WeakPolarHBondContact O-CB 3.28Å; L606-Y610 PolarHBondContact O-N 3.41Å; E607-Y610 PolarHBondContact O-N 3.35Å; F608-Y610 VanDerWaalsContact C-N 3.27Å; F608-Y610 PolarHBondContact O-N 3.38Å; Y610-A613 PolarHBondContact O-N 3.15Å; Y610-K618 HydrophobicContact CD2-CD 4.13Å; Y610-K618 HydrophobicContact CD2-CG 4.25Å; Y610-K618 HydrophobicContact CE1-CD 4.15Å; Y610-K618 VanDerWaalsContact CE1-CE 3.49Å; Y610-K618 HydrophobicContact CE2-CB 4.47Å; Y610-K618 HydrophobicContact CE2-CD 3.56Å; Y610-K618 HydrophobicContact CE2-CG 4.13Å; Y610-K618 VanDerWaalsContact CZ-CE 3.42Å; Y610-K618 PolarHBondContact OH-NZ 3.33Å
611	S	81.5	Confident	81.9	Confident	61 Å²	61	35.7 Å²	35.7	43%	0.427	19%	0.194	S	C	.	.	H	α-helix	trans	-72.9	-27.6	-179.3	69.3	0	0	0	0	113.4	E607 F608 P678	E607-S611 PolarHBondContact O-N 3.17Å; E607-S611 PolarHBondContact O-OG 2.93Å; F608-S611 PolarHBondContact O-N 3.23Å; F608-S611 PolarHBondContact O-OG 3.24Å; S611-P678 WeakPolarHBondContact O-CD 3.31Å; S611-P678 WeakPolarHBondContact O-CG 3.44Å
612	Q	85.2	Confident	81.3	Confident	13 Å²	13	40.5 Å²	40.5	6%	0.061	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-4.9	176.6	-62.4	-62.2	-79.2	0	0	113.1	V290 F608 Y673 I676	V290-Q612 HydrophobicContact CG2-CB 3.69Å; F608-Q612 HydrophobicContact CD2-CG 3.85Å; F608-Q612 HydrophobicContact CE1-CG 4.31Å; F608-Q612 HydrophobicContact CE2-CG 3.48Å; F608-Q612 VanDerWaalsContact CE2-CG 3.48Å; F608-Q612 HydrophobicContact CG-CG 4.42Å; F608-Q612 HydrophobicContact CZ-CG 3.74Å; F608-Q612 WeakPolarHBondContact O-CB 2.78Å; F608-Q612 VanDerWaalsContact O-CG 3.32Å; F608-Q612 WeakPolarHBondContact O-CG 3.17Å; F608-Q612 PolarHBondContact O-N 3.05Å; Q612-Y673 PolarHBondContact OE1-OH 3.08Å; Q612-I676 PolarHBondContact NE2-O 3.34Å; Q612-I676 PolarHBondContact OE1-O 3.33Å
613	A	79.3	Confident	81	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.033	22%	0.217	C	C	.	.	S	Bend	trans	-82.3	137.5	-179.1	0	0	0	0	0	112.4	S609 Y610 K618 L621 P678	S609-A613 WeakPolarHBondContact O-CB 3.4Å; S609-A613 PolarHBondContact O-N 2.64Å; Y610-A613 PolarHBondContact O-N 3.15Å; A613-K618 HydrophobicContact CB-CB 4.28Å; A613-K618 HydrophobicContact CB-CG 3.48Å; A613-K618 VanDerWaalsContact CB-CG 3.48Å; A613-L621 HydrophobicContact CB-CD1 3.67Å; A613-P678 WeakPolarHBondContact O-CG 3.45Å
614	P	81.2	Confident	81.2	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.			trans	-57	150.1	163.1	-18.9	29.7	0	0	0	111.7	Q283 M286 V287 N616 M617 K618	Q283-P614 HydrophobicContact CB-CB 4.08Å; Q283-P614 HydrophobicContact CB-CG 3.86Å; Q283-P614 HydrophobicContact CG-CB 3.84Å; Q283-P614 HydrophobicContact CG-CG 4.09Å; M286-P614 HydrophobicContact CB-CG 4.32Å; M286-P614 HydrophobicContact CE-CG 4.03Å; V287-P614 HydrophobicContact CG2-CG 4.09Å; P614-N616 PolarHBondContact O-N 3.05Å; P614-N616 VanDerWaalsContact O-N 3.14Å; P614-M617 HydrophobicContact CB-CB 4.07Å; P614-M617 HydrophobicContact CB-CG 4.4Å; P614-M617 HydrophobicContact CG-CB 4.04Å; P614-M617 HydrophobicContact CG-CG 4.46Å; P614-M617 HydrophobicContact CG-SD 4.3Å; P614-M617 PolarHBondContact O-N 3.16Å; P614-K618 PolarHBondContact O-N 3.2Å
615	S	72.4	Confident	81.3	Confident	76 Å²	76	38.4 Å²	38.4	53%	0.531	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-37.2	-175.1	52.4	0	0	0	0	112.8	E682	S615-E682 PolarHBondContact N-OE1 3.13Å; S615-E682 VanDerWaalsContact N-OE1 3.17Å; S615-E682 PolarHBondContact OG-OE1 3.13Å; S615-E682 PolarHBondContact OG-OE2 2.76Å
616	N	73.9	Confident	81.5	Confident	61 Å²	61	40.3 Å²	40.3	33%	0.326	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.5	179.2	65.4	-8	0	0	0	114.9	I239 Q283 P614	I239-N616 WeakPolarHBondContact CD1-O 3.14Å; Q283-N616 VanDerWaalsContact CD-OD1 3.3Å; Q283-N616 PolarHBondContact NE2-ND2 2.94Å; Q283-N616 PolarHBondContact NE2-OD1 2.9Å; Q283-N616 VanDerWaalsContact NE2-OD1 3.13Å; Q283-N616 PolarHBondContact OE1-ND2 2.9Å; Q283-N616 PolarHBondContact OE1-OD1 3.03Å; P614-N616 PolarHBondContact O-N 3.05Å; P614-N616 VanDerWaalsContact O-N 3.14Å
617	M	78.9	Confident	82	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	9.6	-174.8	-68.5	-174	-171.4	0	0	114.7	I239 V243 L280 Q283 V284 V287 P614 S619 V620 L621	I239-M617 HydrophobicContact CG2-CG 3.89Å; V243-M617 HydrophobicContact CG2-CE 3.71Å; V243-M617 HydrophobicContact CG2-CG 4.48Å; V243-M617 HydrophobicContact CG2-SD 3.84Å; L280-M617 HydrophobicContact CD1-CE 3.4Å; L280-M617 VanDerWaalsContact CD1-CE 3.4Å; L280-M617 HydrophobicContact CG-CE 4.44Å; Q283-M617 HydrophobicContact CB-CE 3.57Å; Q283-M617 HydrophobicContact CB-SD 3.77Å; V284-M617 HydrophobicContact CG2-CE 4.03Å; V284-M617 HydrophobicContact CG2-SD 4.5Å; V287-M617 HydrophobicContact CG2-CB 3.83Å; V287-M617 HydrophobicContact CG2-CG 4.39Å; V287-M617 HydrophobicContact CG2-SD 3.67Å; P614-M617 HydrophobicContact CB-CB 4.07Å; P614-M617 HydrophobicContact CB-CG 4.4Å; P614-M617 HydrophobicContact CG-CB 4.04Å; P614-M617 HydrophobicContact CG-CG 4.46Å; P614-M617 HydrophobicContact CG-SD 4.3Å; P614-M617 PolarHBondContact O-N 3.16Å; M617-S619 VanDerWaalsContact C-N 3.25Å; M617-S619 PolarHBondContact O-N 3.06Å; M617-V620 HydrophobicContact CB-CG2 4.47Å; M617-V620 WeakPolarHBondContact O-CB 3.41Å; M617-V620 PolarHBondContact O-N 2.84Å; M617-L621 PolarHBondContact O-N 3Å
618	K	73.9	Confident	82.6	Confident	57 Å²	57	34.5 Å²	34.5	25%	0.248	19%	0.189	C	C	.	.	H	α-helix	trans	-52.1	-41.3	175.7	-77.1	164.3	171.8	-178.6	0	113.3	Y610 A613 P614 V620 L621 Q622	Y610-K618 HydrophobicContact CD2-CD 4.13Å; Y610-K618 HydrophobicContact CD2-CG 4.25Å; Y610-K618 HydrophobicContact CE1-CD 4.15Å; Y610-K618 VanDerWaalsContact CE1-CE 3.49Å; Y610-K618 HydrophobicContact CE2-CB 4.47Å; Y610-K618 HydrophobicContact CE2-CD 3.56Å; Y610-K618 HydrophobicContact CE2-CG 4.13Å; Y610-K618 VanDerWaalsContact CZ-CE 3.42Å; Y610-K618 PolarHBondContact OH-NZ 3.33Å; A613-K618 HydrophobicContact CB-CB 4.28Å; A613-K618 HydrophobicContact CB-CG 3.48Å; A613-K618 VanDerWaalsContact CB-CG 3.48Å; P614-K618 PolarHBondContact O-N 3.2Å; K618-V620 VanDerWaalsContact C-N 3.3Å; K618-V620 PolarHBondContact O-N 3.03Å; K618-L621 PolarHBondContact O-N 3.01Å; K618-Q622 WeakPolarHBondContact O-CG 3.44Å; K618-Q622 PolarHBondContact O-N 2.76Å
619	S	74.8	Confident	83	Confident	53 Å²	53	34.5 Å²	34.5	37%	0.371	19%	0.19	S	C	.	.	H	α-helix	trans	-64.4	-32.2	177.7	54.9	0	0	0	0	113.3	M617 A623	M617-S619 VanDerWaalsContact C-N 3.25Å; M617-S619 PolarHBondContact O-N 3.06Å; S619-A623 WeakPolarHBondContact O-CB 3.38Å; S619-A623 PolarHBondContact O-N 2.82Å
620	V	81.1	Confident	83.6	Confident	13 Å²	13	34.3 Å²	34.3	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-42.7	177.8	-178.5	0	0	0	0	110.6	I239 M240 V243 V287 M617 K618 A623 G624	I239-V620 HydrophobicContact CG2-CG2 4.05Å; M240-V620 HydrophobicContact CB-CG2 4.25Å; V243-V620 HydrophobicContact CG2-CG2 4.45Å; V287-V620 HydrophobicContact CG1-CG1 4.06Å; M617-V620 HydrophobicContact CB-CG2 4.47Å; M617-V620 WeakPolarHBondContact O-CB 3.41Å; M617-V620 PolarHBondContact O-N 2.84Å; K618-V620 VanDerWaalsContact C-N 3.3Å; K618-V620 PolarHBondContact O-N 3.03Å; V620-A623 PolarHBondContact O-N 3.45Å; V620-G624 PolarHBondContact O-N 2.9Å
621	L	83.3	Confident	84.6	Confident	1 Å²	1	31 Å²	31	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-70.4	-37.7	176.7	-77.3	174.8	0	0	0	112.3	V287 V290 L291 Y294 A613 M617 K618 A623 G624 W625	V287-L621 HydrophobicContact CG1-CD2 3.91Å; V287-L621 HydrophobicContact CG1-CG 4.16Å; V287-L621 HydrophobicContact CG2-CD1 4.41Å; V287-L621 HydrophobicContact CG2-CG 4.36Å; V290-L621 HydrophobicContact CB-CD1 4.17Å; V290-L621 HydrophobicContact CB-CD2 3.75Å; V290-L621 HydrophobicContact CG1-CD1 4.12Å; V290-L621 HydrophobicContact CG1-CD2 3.67Å; V290-L621 HydrophobicContact CG2-CD1 4.28Å; L291-L621 HydrophobicContact CD2-CD2 3.84Å; L291-L621 HydrophobicContact CG-CD2 3.91Å; Y294-L621 HydrophobicContact CE2-CD2 4.39Å; A613-L621 HydrophobicContact CB-CD1 3.67Å; M617-L621 PolarHBondContact O-N 3Å; K618-L621 PolarHBondContact O-N 3.01Å; L621-A623 VanDerWaalsContact C-N 3.33Å; L621-A623 PolarHBondContact O-N 2.88Å; L621-G624 CarbonylContact O-C 3.52Å; L621-G624 PolarHBondContact O-N 3.25Å; L621-W625 PolarHBondContact O-N 2.87Å
622	Q	81.1	Confident	85.3	Confident	102 Å²	102	28.1 Å²	28.1	48%	0.477	16%	0.161	S	C	.	.	H	α-helix	trans	-61.4	-40.7	172.3	-74.5	-179.1	-32.7	0	0	112.4	K618 W625 L626	K618-Q622 WeakPolarHBondContact O-CG 3.44Å; K618-Q622 PolarHBondContact O-N 2.76Å; Q622-W625 WeakPolarHBondContact O-CB 3.17Å; Q622-W625 PolarHBondContact O-N 3.03Å; Q622-L626 WeakPolarHBondContact O-CG 3.44Å; Q622-L626 PolarHBondContact O-N 2.83Å
623	A	84.2	Confident	85.9	Confident	12 Å²	12	27.5 Å²	27.5	10%	0.099	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-40.1	173.6	0	0	0	0	0	112	M240 S619 V620 L621 W625 L626 L627	M240-A623 HydrophobicContact CE-CB 3.22Å; S619-A623 WeakPolarHBondContact O-CB 3.38Å; S619-A623 PolarHBondContact O-N 2.82Å; V620-A623 PolarHBondContact O-N 3.45Å; L621-A623 VanDerWaalsContact C-N 3.33Å; L621-A623 PolarHBondContact O-N 2.88Å; A623-W625 VanDerWaalsContact C-N 3.28Å; A623-W625 PolarHBondContact O-N 2.85Å; A623-L626 PolarHBondContact O-N 2.95Å; A623-L627 WeakPolarHBondContact O-CB 3.44Å; A623-L627 PolarHBondContact O-N 3.01Å
624	G	88.6	Confident	86.7	Confident	12 Å²	12	30.7 Å²	30.7	12%	0.124	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-38.5	171.7	0	0	0	0	0	112.6	V620 L621 L627 T628	V620-G624 PolarHBondContact O-N 2.9Å; L621-G624 CarbonylContact O-C 3.52Å; L621-G624 PolarHBondContact O-N 3.25Å; G624-L627 WeakPolarHBondContact O-CB 3.4Å; G624-L627 PolarHBondContact O-N 3.05Å; G624-T628 WeakPolarHBondContact O-CG2 3.29Å; G624-T628 PolarHBondContact O-N 2.57Å
625	W	89.8	Confident	87.3	Confident	10 Å²	10	32.7 Å²	32.7	4%	0.038	18%	0.184	C	C	.	.	H	α-helix	trans	-64.6	-50.1	175.7	-179	-86.6	0	0	0	111.7	Y294 L297 W301 M368 F601 L606 L621 Q622 A623 L627 T628	Y294-W625 AromaticContact CE1-CE3 3.95Å; Y294-W625 HydrophobicContact CE1-CE3 3.95Å; Y294-W625 HydrophobicContact CE1-CZ3 4.35Å; Y294-W625 HydrophobicContact CE2-CB 4.12Å; Y294-W625 HydrophobicContact CE2-CE3 4.48Å; Y294-W625 AromaticContact CZ-CE3 3.89Å; L297-W625 HydrophobicContact CD2-CE3 3.98Å; L297-W625 HydrophobicContact CD2-CH2 4.31Å; L297-W625 HydrophobicContact CD2-CZ3 3.56Å; W301-W625 AromaticContact CZ2-CE2 3.91Å; W301-W625 AromaticContact CZ2-CZ2 3.68Å; W301-W625 HydrophobicContact CZ2-CZ2 3.68Å; W301-W625 AromaticContact CZ2-NE1 3.79Å; M368-W625 HydrophobicContact CE-CH2 4.27Å; M368-W625 HydrophobicContact CE-CZ3 4.17Å; F601-W625 HydrophobicContact CE1-CH2 4.18Å; F601-W625 HydrophobicContact CE1-CZ2 4.47Å; L606-W625 HydrophobicContact CD2-CD2 3.94Å; L606-W625 HydrophobicContact CD2-CG 3.86Å; L606-W625 HydrophobicContact CD2-CZ2 4.47Å; L606-W625 HydrophobicContact CG-CD2 4.44Å; L606-W625 HydrophobicContact CG-CZ2 4.1Å; L621-W625 PolarHBondContact O-N 2.87Å; Q622-W625 WeakPolarHBondContact O-CB 3.17Å; Q622-W625 PolarHBondContact O-N 3.03Å; A623-W625 VanDerWaalsContact C-N 3.28Å; A623-W625 PolarHBondContact O-N 2.85Å; W625-L627 PolarHBondContact O-N 2.81Å; W625-T628 WeakPolarHBondContact O-CB 3.42Å; W625-T628 PolarHBondContact O-N 2.96Å; W625-T628 PolarHBondContact O-OG1 2.88Å
626	L	90	Very high	88.3	Confident	41 Å²	41	29.1 Å²	29.1	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-36	176.3	-65.7	173.5	0	0	0	111.8	Y71 P74 Q622 A623 T628 V629 A630	Y71-L626 HydrophobicContact CD1-CB 4.49Å; Y71-L626 HydrophobicContact CD1-CD2 3.81Å; Y71-L626 HydrophobicContact CE1-CD2 3.98Å; P74-L626 HydrophobicContact CB-CD1 3.89Å; P74-L626 HydrophobicContact CG-CD1 4.1Å; Q622-L626 WeakPolarHBondContact O-CG 3.44Å; Q622-L626 PolarHBondContact O-N 2.83Å; A623-L626 PolarHBondContact O-N 2.95Å; L626-T628 PolarHBondContact O-N 3.45Å; L626-V629 WeakPolarHBondContact O-CB 3.22Å; L626-V629 PolarHBondContact O-N 3.06Å; L626-A630 PolarHBondContact O-N 2.87Å
627	L	92.4	Very high	89	Confident	65 Å²	65	27.7 Å²	27.7	34%	0.34	15%	0.151	S	C	.	.	H	α-helix	trans	-60.8	-33.7	173.8	-175.9	65.1	0	0	0	112	L72 I75 A623 G624 W625 V629 A630 V631	L72-L627 HydrophobicContact CD1-CD1 3.75Å; I75-L627 HydrophobicContact CD1-CD1 4.28Å; A623-L627 WeakPolarHBondContact O-CB 3.44Å; A623-L627 PolarHBondContact O-N 3.01Å; G624-L627 WeakPolarHBondContact O-CB 3.4Å; G624-L627 PolarHBondContact O-N 3.05Å; W625-L627 PolarHBondContact O-N 2.81Å; L627-V629 VanDerWaalsContact C-N 3.26Å; L627-V629 PolarHBondContact O-N 2.87Å; L627-A630 PolarHBondContact O-N 2.85Å; L627-V631 HydrophobicContact CD1-CG2 4.44Å; L627-V631 HydrophobicContact CG-CG2 4.35Å; L627-V631 VanDerWaalsContact O-CG2 3.32Å; L627-V631 WeakPolarHBondContact O-CG2 3.47Å; L627-V631 PolarHBondContact O-N 2.81Å
628	T	95.3	Very high	89.5	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-34.5	174.6	70.4	0	0	0	0	112.5	Y294 L297 P298 W301 G624 W625 L626 G632	Y294-T628 HydrophobicContact CD2-CG2 4.1Å; Y294-T628 HydrophobicContact CG-CG2 4.18Å; L297-T628 HydrophobicContact CB-CG2 4.15Å; P298-T628 WeakPolarHBondContact CA-O 3.14Å; P298-T628 HydrophobicContact CG-CG2 4.43Å; W301-T628 PolarHBondContact NE1-OG1 2.88Å; W301-T628 VanDerWaalsContact NE1-OG1 3.14Å; G624-T628 WeakPolarHBondContact O-CG2 3.29Å; G624-T628 PolarHBondContact O-N 2.57Å; W625-T628 WeakPolarHBondContact O-CB 3.42Å; W625-T628 PolarHBondContact O-N 2.96Å; W625-T628 PolarHBondContact O-OG1 2.88Å; L626-T628 PolarHBondContact O-N 3.45Å; T628-G632 PolarHBondContact O-N 3.08Å
629	V	95.3	Very high	90.1	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.03	17%	0.171	C	C	.	.	H	α-helix	trans	-66.9	-45.4	175.3	-172.3	0	0	0	0	110.4	Y71 W301 L626 L627 V631 G632 N633	Y71-V629 HydrophobicContact CD1-CB 3.84Å; Y71-V629 HydrophobicContact CD1-CG1 3.84Å; Y71-V629 HydrophobicContact CD1-CG2 4.18Å; Y71-V629 HydrophobicContact CD2-CB 4.37Å; Y71-V629 HydrophobicContact CD2-CG1 3.66Å; Y71-V629 HydrophobicContact CE1-CB 4.34Å; Y71-V629 HydrophobicContact CE1-CG1 4.01Å; Y71-V629 HydrophobicContact CE1-CG2 4.38Å; Y71-V629 HydrophobicContact CE2-CG1 3.86Å; Y71-V629 HydrophobicContact CG-CB 3.87Å; Y71-V629 HydrophobicContact CG-CG1 3.66Å; W301-V629 HydrophobicContact CB-CG1 4.43Å; W301-V629 HydrophobicContact CD2-CB 4.45Å; W301-V629 HydrophobicContact CD2-CG1 4.44Å; W301-V629 HydrophobicContact CD2-CG2 3.78Å; W301-V629 HydrophobicContact CE3-CG2 4.36Å; W301-V629 HydrophobicContact CG-CB 4.22Å; W301-V629 HydrophobicContact CG-CG1 4.38Å; W301-V629 HydrophobicContact CG-CG2 3.94Å; W301-V629 HydrophobicContact CZ2-CG2 4.18Å; L626-V629 WeakPolarHBondContact O-CB 3.22Å; L626-V629 PolarHBondContact O-N 3.06Å; L627-V629 VanDerWaalsContact C-N 3.26Å; L627-V629 PolarHBondContact O-N 2.87Å; V629-V631 PolarHBondContact O-N 3.03Å; V629-G632 PolarHBondContact O-N 2.92Å; V629-N633 PolarHBondContact O-N 3.38Å; V629-N633 VanDerWaalsContact O-N 3.08Å; V629-N633 PolarHBondContact O-ND2 2.94Å
630	A	96.3	Very high	90.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-60.5	-46	177.1	0	0	0	0	0	111.8	A68 L72 L626 L627 G632 N633 I634	A68-A630 WeakPolarHBondContact O-CB 3.36Å; L72-A630 HydrophobicContact CB-CB 4.22Å; L626-A630 PolarHBondContact O-N 2.87Å; L627-A630 PolarHBondContact O-N 2.85Å; A630-G632 VanDerWaalsContact C-N 3.3Å; A630-G632 PolarHBondContact O-N 2.98Å; A630-N633 PolarHBondContact O-N 3Å; A630-I634 WeakPolarHBondContact O-CG1 3.34Å; A630-I634 PolarHBondContact O-N 2.94Å; A630-I634 VanDerWaalsContact O-N 3.08Å
631	V	97.3	Very high	90.1	Very high	57 Å²	57	35.3 Å²	35.3	35%	0.345	19%	0.189	S	C	.	.	H	α-helix	trans	-63.9	-36.9	176.2	176.6	0	0	0	0	111.2	P298 L627 V629 N633 I634 I635	P298-V631 HydrophobicContact CB-CB 4Å; P298-V631 HydrophobicContact CB-CG1 3.74Å; P298-V631 HydrophobicContact CG-CB 3.95Å; P298-V631 HydrophobicContact CG-CG1 3.79Å; L627-V631 HydrophobicContact CD1-CG2 4.44Å; L627-V631 HydrophobicContact CG-CG2 4.35Å; L627-V631 VanDerWaalsContact O-CG2 3.32Å; L627-V631 WeakPolarHBondContact O-CG2 3.47Å; L627-V631 PolarHBondContact O-N 2.81Å; V629-V631 PolarHBondContact O-N 3.03Å; V631-N633 PolarHBondContact O-N 3.33Å; V631-I634 PolarHBondContact O-N 3.4Å; V631-I635 HydrophobicContact CG1-CD1 4.29Å; V631-I635 HydrophobicContact CG1-CG1 4.49Å; V631-I635 WeakPolarHBondContact O-CG1 3.42Å; V631-I635 PolarHBondContact O-N 3.04Å
632	G	97.1	Very high	89.9	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.8	-46.4	175.4	0	0	0	0	0	112.2	P298 A302 T628 V629 A630 I634 I635 V636	P298-G632 WeakPolarHBondContact O-CA 3.41Å; A302-G632 VanDerWaalsContact CB-O 3.23Å; A302-G632 WeakPolarHBondContact CB-O 3.43Å; T628-G632 PolarHBondContact O-N 3.08Å; V629-G632 PolarHBondContact O-N 2.92Å; A630-G632 VanDerWaalsContact C-N 3.3Å; A630-G632 PolarHBondContact O-N 2.98Å; G632-I634 VanDerWaalsContact C-N 3.32Å; G632-I634 PolarHBondContact O-N 2.82Å; G632-I635 WeakPolarHBondContact O-CB 3.17Å; G632-I635 PolarHBondContact O-N 3.39Å; G632-I635 VanDerWaalsContact O-N 3.15Å; G632-V636 PolarHBondContact O-N 3Å
633	N	96.9	Very high	89.4	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-35.1	175.8	-75.5	-89.9	0	0	0	112.4	H64 V67 A68 D305 V629 A630 V631 I635 V636 L637	H64-N633 HydrophobicContact CB-CB 4.36Å; H64-N633 PolarHBondContact ND1-OD1 3.3Å; V67-N633 WeakPolarHBondContact CG1-ND2 3.45Å; V67-N633 WeakPolarHBondContact CG1-OD1 3.49Å; A68-N633 HydrophobicContact CB-CB 3.83Å; D305-N633 PolarHBondContact OD2-ND2 3.2Å; V629-N633 PolarHBondContact O-N 3.38Å; V629-N633 VanDerWaalsContact O-N 3.08Å; V629-N633 PolarHBondContact O-ND2 2.94Å; A630-N633 PolarHBondContact O-N 3Å; V631-N633 PolarHBondContact O-N 3.33Å; N633-I635 VanDerWaalsContact C-N 3.34Å; N633-V636 WeakPolarHBondContact O-CB 3.35Å; N633-V636 PolarHBondContact O-N 2.91Å; N633-L637 WeakPolarHBondContact O-CG 2.94Å; N633-L637 PolarHBondContact O-N 3.4Å
634	I	95.9	Very high	88.7	Confident	72 Å²	72	40.6 Å²	40.6	37%	0.369	24%	0.238	S	C	.	.	H	α-helix	trans	-65.5	-36.4	173.2	-66.5	165.9	0	0	0	111.6	A68 A630 V631 G632 V636 L637 I638	A68-I634 HydrophobicContact CB-CG1 4.03Å; A630-I634 WeakPolarHBondContact O-CG1 3.34Å; A630-I634 PolarHBondContact O-N 2.94Å; A630-I634 VanDerWaalsContact O-N 3.08Å; V631-I634 PolarHBondContact O-N 3.4Å; G632-I634 VanDerWaalsContact C-N 3.32Å; G632-I634 PolarHBondContact O-N 2.82Å; I634-V636 VanDerWaalsContact C-N 3.28Å; I634-V636 PolarHBondContact O-N 3.31Å; I634-L637 WeakPolarHBondContact O-CB 3.23Å; I634-L637 PolarHBondContact O-N 3.05Å; I634-I638 HydrophobicContact CG2-CD1 3.94Å; I634-I638 HydrophobicContact CG2-CG1 4.41Å; I634-I638 WeakPolarHBondContact O-CG1 3.38Å; I634-I638 PolarHBondContact O-N 2.64Å
635	I	94.9	Very high	88.3	Confident	42 Å²	42	43.4 Å²	43.4	22%	0.215	25%	0.25	C	C	.	.	H	α-helix	trans	-60.2	-41	174.8	-69.9	165.7	0	0	0	110.4	P298 M299 A302 V631 G632 N633 L637 I638 V639	P298-I635 HydrophobicContact CB-CD1 3.69Å; M299-I635 HydrophobicContact CE-CG2 4.03Å; M299-I635 HydrophobicContact SD-CG2 4.02Å; A302-I635 HydrophobicContact CB-CB 4.31Å; A302-I635 HydrophobicContact CB-CG2 4.29Å; V631-I635 HydrophobicContact CG1-CD1 4.29Å; V631-I635 HydrophobicContact CG1-CG1 4.49Å; V631-I635 WeakPolarHBondContact O-CG1 3.42Å; V631-I635 PolarHBondContact O-N 3.04Å; G632-I635 WeakPolarHBondContact O-CB 3.17Å; G632-I635 PolarHBondContact O-N 3.39Å; G632-I635 VanDerWaalsContact O-N 3.15Å; N633-I635 VanDerWaalsContact C-N 3.34Å; I635-L637 VanDerWaalsContact C-N 3.31Å; I635-L637 PolarHBondContact O-N 3.25Å; I635-I638 PolarHBondContact O-N 3.17Å; I635-V639 HydrophobicContact CG2-CG2 4.1Å; I635-V639 WeakPolarHBondContact O-CB 3.24Å; I635-V639 VanDerWaalsContact O-CG2 3.31Å; I635-V639 WeakPolarHBondContact O-CG2 3.48Å; I635-V639 PolarHBondContact O-N 2.86Å
636	V	92.4	Very high	87.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-58.1	-45.5	176.2	-177.6	0	0	0	0	110.9	A302 G632 N633 I634 I638 V639 A640 F655	A302-V636 HydrophobicContact CB-CG2 3.84Å; A302-V636 VanDerWaalsContact O-CG2 3.27Å; A302-V636 WeakPolarHBondContact O-CG2 2.93Å; G632-V636 PolarHBondContact O-N 3Å; N633-V636 WeakPolarHBondContact O-CB 3.35Å; N633-V636 PolarHBondContact O-N 2.91Å; I634-V636 VanDerWaalsContact C-N 3.28Å; I634-V636 PolarHBondContact O-N 3.31Å; V636-I638 PolarHBondContact O-N 3.2Å; V636-V639 PolarHBondContact O-N 2.93Å; V636-A640 WeakPolarHBondContact O-CB 3.31Å; V636-A640 PolarHBondContact O-N 3.06Å; V636-F655 HydrophobicContact CG1-CZ 4.3Å; V636-F655 HydrophobicContact CG2-CE1 4.42Å; V636-F655 HydrophobicContact CG2-CZ 4.36Å
637	L	90.2	Very high	87.2	Confident	31 Å²	31	50.2 Å²	50.2	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-46	177	-54.4	178	0	0	0	112.2	T61 H64 T65 N633 I634 I635 V639 A640 E641	T61-L637 HydrophobicContact CG2-CD2 4.03Å; T61-L637 WeakPolarHBondContact O-CD2 3.28Å; H64-L637 HydrophobicContact CB-CD2 3.74Å; H64-L637 HydrophobicContact CB-CG 4.34Å; T65-L637 WeakPolarHBondContact OG1-CD1 3.48Å; N633-L637 WeakPolarHBondContact O-CG 2.94Å; N633-L637 PolarHBondContact O-N 3.4Å; I634-L637 WeakPolarHBondContact O-CB 3.23Å; I634-L637 PolarHBondContact O-N 3.05Å; I635-L637 VanDerWaalsContact C-N 3.31Å; I635-L637 PolarHBondContact O-N 3.25Å; L637-V639 VanDerWaalsContact C-N 3.33Å; L637-V639 PolarHBondContact O-N 3.43Å; L637-A640 PolarHBondContact O-N 3.18Å; L637-E641 WeakPolarHBondContact O-CG 3.41Å; L637-E641 PolarHBondContact O-N 3.27Å; L637-E641 VanDerWaalsContact O-N 3.11Å
638	I	89.6	Confident	86.9	Confident	105 Å²	105	49.2 Å²	49.2	54%	0.538	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-43	179.7	-66.2	167.5	0	0	0	110.4	I634 I635 V636 A642	I634-I638 HydrophobicContact CG2-CD1 3.94Å; I634-I638 HydrophobicContact CG2-CG1 4.41Å; I634-I638 WeakPolarHBondContact O-CG1 3.38Å; I634-I638 PolarHBondContact O-N 2.64Å; I635-I638 PolarHBondContact O-N 3.17Å; V636-I638 PolarHBondContact O-N 3.2Å; I638-A642 WeakPolarHBondContact O-CB 3.45Å; I638-A642 PolarHBondContact O-N 2.64Å
639	V	86.1	Confident	86.7	Confident	19 Å²	19	52.9 Å²	52.9	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-68.7	-43.2	-179.4	172.8	0	0	0	0	110.9	I635 V636 L637 E641 A642 A643 L654 F655 L658	I635-V639 HydrophobicContact CG2-CG2 4.1Å; I635-V639 WeakPolarHBondContact O-CB 3.24Å; I635-V639 VanDerWaalsContact O-CG2 3.31Å; I635-V639 WeakPolarHBondContact O-CG2 3.48Å; I635-V639 PolarHBondContact O-N 2.86Å; V636-V639 PolarHBondContact O-N 2.93Å; L637-V639 VanDerWaalsContact C-N 3.33Å; L637-V639 PolarHBondContact O-N 3.43Å; V639-E641 PolarHBondContact O-N 3.14Å; V639-A642 PolarHBondContact O-N 2.73Å; V639-A643 HydrophobicContact CG1-CB 4.31Å; V639-A643 WeakPolarHBondContact O-CB 3.35Å; V639-A643 PolarHBondContact O-N 3.2Å; V639-L654 HydrophobicContact CG1-CD2 3.75Å; V639-F655 HydrophobicContact CB-CE1 4.31Å; V639-F655 HydrophobicContact CB-CZ 3.89Å; V639-F655 HydrophobicContact CG1-CE1 4.25Å; V639-F655 HydrophobicContact CG1-CE2 4.03Å; V639-F655 HydrophobicContact CG1-CZ 3.69Å; V639-F655 HydrophobicContact CG2-CE1 4.32Å; V639-F655 HydrophobicContact CG2-CZ 4.39Å; V639-L658 HydrophobicContact CG2-CD1 4.46Å
640	A	77.7	Confident	86.5	Confident	25 Å²	25	53.6 Å²	53.6	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-46.9	177.7	0	0	0	0	0	111.7	V636 L637	V636-A640 WeakPolarHBondContact O-CB 3.31Å; V636-A640 PolarHBondContact O-N 3.06Å; L637-A640 PolarHBondContact O-N 3.18Å
641	E	77.9	Confident	86.3	Confident	133 Å²	133	54.3 Å²	54.3	62%	0.621	31%	0.31	S	S	*	.	H	α-helix	trans	-73.7	-33.7	179.6	-66.7	-69.4	161.6	0	0	113.4	L637 V639	L637-E641 WeakPolarHBondContact O-CG 3.41Å; L637-E641 PolarHBondContact O-N 3.27Å; L637-E641 VanDerWaalsContact O-N 3.11Å; V639-E641 PolarHBondContact O-N 3.14Å
642	A	79.6	Confident	86.2	Confident	78 Å²	78	51.7 Å²	51.7	65%	0.645	29%	0.294	S	S	*	.	H	α-helix	trans	-88.3	-30.4	-174.4	0	0	0	0	0	114	I638 V639	I638-A642 WeakPolarHBondContact O-CB 3.45Å; I638-A642 PolarHBondContact O-N 2.64Å; V639-A642 PolarHBondContact O-N 2.73Å
643	A	70.3	Confident	86.1	Confident	32 Å²	32	54.9 Å²	54.9	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-87.1	-24.7	-172.8	0	0	0	0	0	113	V639 L645 L654	V639-A643 HydrophobicContact CG1-CB 4.31Å; V639-A643 WeakPolarHBondContact O-CB 3.35Å; V639-A643 PolarHBondContact O-N 3.2Å; A643-L645 HydrophobicContact CB-CD1 4.21Å; A643-L645 HydrophobicContact CB-CG 3.98Å; A643-L645 WeakPolarHBondContact O-CG 3.26Å; A643-L645 PolarHBondContact O-N 3.06Å; A643-L654 HydrophobicContact CB-CD2 3.89Å
644	T	69.8	Low	86	Confident	117 Å²	117	57.6 Å²	57.6	72%	0.718	33%	0.328	S	S	*	.			trans	29.9	53.3	-177.8	62.2	0	0	0	0	112.5
645	L	79	Confident	86	Confident	70 Å²	70	54.1 Å²	54.1	37%	0.366	31%	0.31	S	S	.	.			trans	-83.7	126.3	-177.6	-67.8	174.2	0	0	0	107.9	A643 D647 A650 E651 L654	A643-L645 HydrophobicContact CB-CD1 4.21Å; A643-L645 HydrophobicContact CB-CG 3.98Å; A643-L645 WeakPolarHBondContact O-CG 3.26Å; A643-L645 PolarHBondContact O-N 3.06Å; L645-D647 PolarHBondContact O-N 3.43Å; L645-A650 HydrophobicContact CD1-CB 4.16Å; L645-E651 HydrophobicContact CD1-CB 4.49Å; L645-L654 HydrophobicContact CD1-CB 4.41Å; L645-L654 HydrophobicContact CD1-CD2 4.01Å
646	P	72.8	Confident	86.1	Confident	119 Å²	119	52.4 Å²	52.4	77%	0.773	30%	0.302	S	S	*	.	S	Bend	trans	-67.6	-30.1	179.9	26.9	-33.5	0	0	0	111.8
647	D	84	Confident	86.3	Confident	76 Å²	76	55.2 Å²	55.2	41%	0.406	33%	0.325	S	S	.	.			trans	-103.7	127.3	-173.6	-54.4	-36.6	0	0	0	112.4	L645 W649 A650 E651	L645-D647 PolarHBondContact O-N 3.43Å; D647-W649 VanDerWaalsContact C-N 3.31Å; D647-W649 HydrophobicContact CB-CG 4.36Å; D647-W649 VanDerWaalsContact CB-NE1 3.27Å; D647-W649 PolarHBondContact O-N 2.7Å; D647-W649 PolarHBondContact OD2-NE1 3.43Å; D647-A650 HydrophobicContact CB-CB 4.25Å; D647-A650 WeakPolarHBondContact O-CB 3.12Å; D647-A650 PolarHBondContact O-N 2.81Å; D647-A650 VanDerWaalsContact O-N 3.15Å; D647-E651 PolarHBondContact O-N 2.92Å
648	Q	85.9	Confident	86.5	Confident	43 Å²	43	56.4 Å²	56.4	20%	0.201	33%	0.331	C	S	.	.	H	α-helix	trans	-63	-34.7	178.8	-70.4	-172.8	-9.3	0	0	113	Q386 A650 E651 Y652	Q386-Q648 HydrophobicContact CG-CB 4.04Å; Q648-A650 PolarHBondContact O-N 2.97Å; Q648-E651 WeakPolarHBondContact O-CB 3.4Å; Q648-E651 PolarHBondContact O-N 2.83Å; Q648-Y652 WeakPolarHBondContact O-CD2 3.39Å; Q648-Y652 PolarHBondContact O-N 2.87Å
649	W	91.5	Very high	86.9	Confident	84 Å²	84	51.4 Å²	51.4	32%	0.318	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-34.2	178	72	-96.2	0	0	0	111.6	Q386 L387 D647 Y652 V653	Q386-W649 HydrophobicContact CB-CB 3.85Å; Q386-W649 HydrophobicContact CG-CB 3.83Å; L387-W649 HydrophobicContact CD2-CB 4.14Å; L387-W649 HydrophobicContact CD2-CD2 3.66Å; L387-W649 HydrophobicContact CD2-CE3 4.21Å; L387-W649 HydrophobicContact CD2-CG 3.59Å; L387-W649 HydrophobicContact CG-CB 4.06Å; L387-W649 HydrophobicContact CG-CD2 4.31Å; L387-W649 HydrophobicContact CG-CG 4.06Å; D647-W649 VanDerWaalsContact C-N 3.31Å; D647-W649 HydrophobicContact CB-CG 4.36Å; D647-W649 VanDerWaalsContact CB-NE1 3.27Å; D647-W649 PolarHBondContact O-N 2.7Å; D647-W649 PolarHBondContact OD2-NE1 3.43Å; W649-Y652 PolarHBondContact O-N 3.32Å; W649-V653 HydrophobicContact CE3-CG2 4.06Å; W649-V653 HydrophobicContact CZ3-CG2 4.29Å; W649-V653 WeakPolarHBondContact O-CG2 3.4Å; W649-V653 PolarHBondContact O-N 2.89Å; W649-V653 VanDerWaalsContact O-N 3.08Å
650	A	92.3	Very high	87.4	Confident	21 Å²	21	53.3 Å²	53.3	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-69.4	-36.7	178.7	0	0	0	0	0	111.1	L645 D647 Q648 V653 L654	L645-A650 HydrophobicContact CD1-CB 4.16Å; D647-A650 HydrophobicContact CB-CB 4.25Å; D647-A650 WeakPolarHBondContact O-CB 3.12Å; D647-A650 PolarHBondContact O-N 2.81Å; D647-A650 VanDerWaalsContact O-N 3.15Å; Q648-A650 PolarHBondContact O-N 2.97Å; A650-V653 PolarHBondContact O-N 3.04Å; A650-L654 WeakPolarHBondContact O-CB 3.49Å; A650-L654 PolarHBondContact O-N 3.02Å
651	E	91.4	Very high	88.4	Confident	15 Å²	15	56.8 Å²	56.8	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-59.5	-45.9	171.9	-170.9	-177.3	154.1	0	0	110.9	R310 L645 D647 Q648 V653 L654 F655	R310-E651 IonicContact CZ-OE1 2.72Å; R310-E651 IonicContact CZ-OE2 3.63Å; R310-E651 VanDerWaalsContact CZ-OE2 3.31Å; R310-E651 IonicContact NE-OE1 3.67Å; R310-E651 PolarHBondContact NE-OE1 3.3Å; R310-E651 IonicContact NE-OE2 2.86Å; R310-E651 PolarHBondContact NE-OE2 2.89Å; R310-E651 IonicContact NH2-OE1 3.7Å; R310-E651 IonicContact NH2-OE2 3.67Å; R310-E651 PolarHBondContact NH2-OE2 2.71Å; L645-E651 HydrophobicContact CD1-CB 4.49Å; D647-E651 PolarHBondContact O-N 2.92Å; Q648-E651 WeakPolarHBondContact O-CB 3.4Å; Q648-E651 PolarHBondContact O-N 2.83Å; E651-V653 PolarHBondContact O-N 3.23Å; E651-L654 WeakPolarHBondContact O-CB 3.29Å; E651-L654 PolarHBondContact O-N 2.82Å; E651-F655 HydrophobicContact CG-CD2 3.87Å; E651-F655 HydrophobicContact CG-CE2 3.67Å; E651-F655 VanDerWaalsContact O-CD2 3.27Å; E651-F655 WeakPolarHBondContact O-CD2 3.39Å; E651-F655 PolarHBondContact O-N 3.2Å
652	Y	95.1	Very high	89.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-41.6	176.8	-66.2	-43	0	0	0	112.9	R310 W311 F379 A382 Q386 Q648 W649 F655 A656	R310-Y652 HydrophobicContact CB-CE1 4.01Å; R310-Y652 PolarHBondContact O-OH 3.43Å; W311-Y652 AromaticContact CD1-CE1 3.85Å; W311-Y652 AromaticContact NE1-CE1 3.88Å; F379-Y652 AromaticContact CD1-CD1 3.83Å; F379-Y652 HydrophobicContact CD1-CD1 3.83Å; F379-Y652 HydrophobicContact CD1-CG 4.48Å; F379-Y652 AromaticContact CE1-CD1 3.77Å; F379-Y652 HydrophobicContact CE1-CD1 3.77Å; F379-Y652 HydrophobicContact CE1-CE1 4.38Å; A382-Y652 HydrophobicContact CB-CD1 4.44Å; A382-Y652 HydrophobicContact CB-CD2 4.2Å; A382-Y652 HydrophobicContact CB-CE2 4.42Å; A382-Y652 HydrophobicContact CB-CG 4.23Å; Q386-Y652 HydrophobicContact CB-CD2 4.15Å; Q386-Y652 HydrophobicContact CB-CE2 4.11Å; Q386-Y652 HydrophobicContact CG-CE2 4.3Å; Q648-Y652 WeakPolarHBondContact O-CD2 3.39Å; Q648-Y652 PolarHBondContact O-N 2.87Å; W649-Y652 PolarHBondContact O-N 3.32Å; Y652-F655 PolarHBondContact O-N 2.92Å; Y652-A656 WeakPolarHBondContact O-CB 3.5Å; Y652-A656 PolarHBondContact O-N 3.5Å
653	V	95.9	Very high	90.1	Very high	68 Å²	68	48.4 Å²	48.4	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-40.6	176	173.3	0	0	0	0	111.3	A383 W649 A650 E651 A656 A657	A383-V653 HydrophobicContact CB-CG2 3.73Å; W649-V653 HydrophobicContact CE3-CG2 4.06Å; W649-V653 HydrophobicContact CZ3-CG2 4.29Å; W649-V653 WeakPolarHBondContact O-CG2 3.4Å; W649-V653 PolarHBondContact O-N 2.89Å; W649-V653 VanDerWaalsContact O-N 3.08Å; A650-V653 PolarHBondContact O-N 3.04Å; E651-V653 PolarHBondContact O-N 3.23Å; V653-A656 PolarHBondContact O-N 3.41Å; V653-A657 WeakPolarHBondContact O-CB 3.49Å; V653-A657 PolarHBondContact O-N 2.93Å
654	L	94.1	Very high	91.3	Very high	56 Å²	56	51.4 Å²	51.4	29%	0.293	29%	0.293	S	S	.	.	H	α-helix	trans	-59.2	-49.8	175.8	176.1	63.9	0	0	0	110.9	V639 A643 L645 A650 E651 A656 A657 L658	V639-L654 HydrophobicContact CG1-CD2 3.75Å; A643-L654 HydrophobicContact CB-CD2 3.89Å; L645-L654 HydrophobicContact CD1-CB 4.41Å; L645-L654 HydrophobicContact CD1-CD2 4.01Å; A650-L654 WeakPolarHBondContact O-CB 3.49Å; A650-L654 PolarHBondContact O-N 3.02Å; E651-L654 WeakPolarHBondContact O-CB 3.29Å; E651-L654 PolarHBondContact O-N 2.82Å; L654-A656 VanDerWaalsContact C-N 3.35Å; L654-A656 PolarHBondContact O-N 3Å; L654-A657 PolarHBondContact O-N 3.23Å; L654-L658 HydrophobicContact CD1-CD1 4.2Å; L654-L658 HydrophobicContact CD1-CG 4.26Å; L654-L658 HydrophobicContact CG-CD1 4.11Å; L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.41Å; L654-L658 PolarHBondContact O-N 3.26Å
655	F	95.1	Very high	92.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-40.7	177.2	-84.2	-66.8	0	0	0	112.5	M299 L303 Q306 F379 V636 V639 E651 Y652 L659	M299-F655 HydrophobicContact CE-CD1 3.63Å; M299-F655 HydrophobicContact CE-CE1 3.95Å; L303-F655 HydrophobicContact CD1-CB 3.91Å; L303-F655 HydrophobicContact CD1-CD1 3.74Å; L303-F655 HydrophobicContact CD1-CG 4.21Å; L303-F655 HydrophobicContact CD2-CB 4.32Å; L303-F655 HydrophobicContact CG-CB 4.05Å; L303-F655 HydrophobicContact CG-CD1 4.49Å; Q306-F655 VanDerWaalsContact NE2-CE2 3.34Å; F379-F655 HydrophobicContact CD1-CB 3.61Å; F379-F655 HydrophobicContact CD1-CG 4.49Å; F379-F655 HydrophobicContact CE1-CB 3.75Å; F379-F655 HydrophobicContact CE1-CD2 4.29Å; F379-F655 HydrophobicContact CE1-CG 4.16Å; V636-F655 HydrophobicContact CG1-CZ 4.3Å; V636-F655 HydrophobicContact CG2-CE1 4.42Å; V636-F655 HydrophobicContact CG2-CZ 4.36Å; V639-F655 HydrophobicContact CB-CE1 4.31Å; V639-F655 HydrophobicContact CB-CZ 3.89Å; V639-F655 HydrophobicContact CG1-CE1 4.25Å; V639-F655 HydrophobicContact CG1-CE2 4.03Å; V639-F655 HydrophobicContact CG1-CZ 3.69Å; V639-F655 HydrophobicContact CG2-CE1 4.32Å; V639-F655 HydrophobicContact CG2-CZ 4.39Å; E651-F655 HydrophobicContact CG-CD2 3.87Å; E651-F655 HydrophobicContact CG-CE2 3.67Å; E651-F655 VanDerWaalsContact O-CD2 3.27Å; E651-F655 WeakPolarHBondContact O-CD2 3.39Å; E651-F655 PolarHBondContact O-N 3.2Å; Y652-F655 PolarHBondContact O-N 2.92Å; F655-L659 WeakPolarHBondContact O-CB 3.37Å; F655-L659 PolarHBondContact O-N 3.32Å
656	A	97	Very high	93.4	Very high	6 Å²	6	46.2 Å²	46.2	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-47.2	174.6	0	0	0	0	0	111.7	F379 V380 Y652 V653 L654 L659 V660	F379-A656 HydrophobicContact CB-CB 3.89Å; V380-A656 HydrophobicContact CG2-CB 4.03Å; Y652-A656 WeakPolarHBondContact O-CB 3.5Å; Y652-A656 PolarHBondContact O-N 3.5Å; V653-A656 PolarHBondContact O-N 3.41Å; L654-A656 VanDerWaalsContact C-N 3.35Å; L654-A656 PolarHBondContact O-N 3Å; A656-L659 PolarHBondContact O-N 2.86Å; A656-V660 WeakPolarHBondContact O-CG2 3.03Å; A656-V660 PolarHBondContact O-N 3.46Å
657	A	96.4	Very high	94.5	Very high	59 Å²	59	42.3 Å²	42.3	49%	0.488	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-43.5	179.8	0	0	0	0	0	112.2	V653 L654 L659 V660 L661	V653-A657 WeakPolarHBondContact O-CB 3.49Å; V653-A657 PolarHBondContact O-N 2.93Å; L654-A657 PolarHBondContact O-N 3.23Å; A657-L659 PolarHBondContact O-N 2.9Å; A657-V660 PolarHBondContact O-N 2.85Å; A657-L661 PolarHBondContact O-N 3.23Å
658	L	95.6	Very high	95	Very high	56 Å²	56	43.2 Å²	43.2	29%	0.293	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-44	174.9	-71.9	174.6	0	0	0	111.4	M299 V639 L654 L661 V662	M299-L658 HydrophobicContact SD-CB 4.29Å; V639-L658 HydrophobicContact CG2-CD1 4.46Å; L654-L658 HydrophobicContact CD1-CD1 4.2Å; L654-L658 HydrophobicContact CD1-CG 4.26Å; L654-L658 HydrophobicContact CG-CD1 4.11Å; L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.41Å; L654-L658 PolarHBondContact O-N 3.26Å; L658-L661 PolarHBondContact O-N 3.02Å; L658-V662 WeakPolarHBondContact O-CB 3.48Å; L658-V662 VanDerWaalsContact O-CG2 3.31Å; L658-V662 WeakPolarHBondContact O-CG2 3.31Å; L658-V662 PolarHBondContact O-N 3.47Å
659	L	97.1	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.4	-35	178.6	-174.3	59	0	0	0	112.4	M299 L303 M372 A375 A376 F655 A656 A657 V662 C663	M299-L659 HydrophobicContact CB-CD1 4.03Å; M299-L659 HydrophobicContact CG-CB 4.35Å; M299-L659 HydrophobicContact CG-CD1 3.98Å; L303-L659 HydrophobicContact CD1-CB 4.22Å; L303-L659 HydrophobicContact CD1-CD2 4.41Å; L303-L659 HydrophobicContact CD2-CB 3.99Å; L303-L659 HydrophobicContact CD2-CD2 3.56Å; L303-L659 HydrophobicContact CD2-CG 4.41Å; L303-L659 HydrophobicContact CG-CD2 4.38Å; M372-L659 HydrophobicContact CB-CD1 4.22Å; M372-L659 HydrophobicContact CG-CD1 4.38Å; M372-L659 VanDerWaalsContact O-CD2 3.23Å; M372-L659 WeakPolarHBondContact O-CD2 3.36Å; A375-L659 HydrophobicContact CB-CD2 3.61Å; A376-L659 HydrophobicContact CB-CB 4.26Å; A376-L659 HydrophobicContact CB-CD2 4.16Å; A376-L659 HydrophobicContact CB-CG 4.26Å; F655-L659 WeakPolarHBondContact O-CB 3.37Å; F655-L659 PolarHBondContact O-N 3.32Å; A656-L659 PolarHBondContact O-N 2.86Å; A657-L659 PolarHBondContact O-N 2.9Å; L659-V662 PolarHBondContact O-N 3.03Å; L659-C663 WeakPolarHBondContact O-CB 3.39Å; L659-C663 PolarHBondContact O-N 3.44Å
660	V	97.8	Very high	95.4	Very high	59 Å²	59	39.6 Å²	39.6	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-46.3	172.6	170.6	0	0	0	0	110.8	A376 A656 A657 V662 C663 I664	A376-V660 HydrophobicContact CB-CG2 3.79Å; A656-V660 WeakPolarHBondContact O-CG2 3.03Å; A656-V660 PolarHBondContact O-N 3.46Å; A657-V660 PolarHBondContact O-N 2.85Å; V660-V662 VanDerWaalsContact C-N 3.34Å; V660-V662 PolarHBondContact O-N 2.7Å; V660-C663 WeakPolarHBondContact O-CB 3.42Å; V660-C663 PolarHBondContact O-N 2.89Å; V660-I664 HydrophobicContact CG1-CD1 4.29Å; V660-I664 WeakPolarHBondContact O-CG1 3.25Å; V660-I664 PolarHBondContact O-N 3.43Å
661	L	97.1	Very high	95.3	Very high	99 Å²	99	47.2 Å²	47.2	52%	0.518	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-47.3	176	177.1	64.6	0	0	0	111.3	A657 L658 C663 I664 I665	A657-L661 PolarHBondContact O-N 3.23Å; L658-L661 PolarHBondContact O-N 3.02Å; L661-C663 VanDerWaalsContact C-N 3.32Å; L661-C663 PolarHBondContact O-N 2.88Å; L661-I664 PolarHBondContact O-N 3.04Å; L661-I665 HydrophobicContact CD1-CD1 4.45Å; L661-I665 HydrophobicContact CG-CD1 4.19Å; L661-I665 WeakPolarHBondContact O-CG1 3.36Å; L661-I665 PolarHBondContact O-N 2.9Å
662	V	96.4	Very high	95.3	Very high	25 Å²	25	53.8 Å²	53.8	15%	0.152	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-37	178.2	171.1	0	0	0	0	111.8	P296 M299 L658 L659 V660 I664 I665 F666	P296-V662 HydrophobicContact CB-CG1 3.69Å; P296-V662 WeakPolarHBondContact O-CG1 3.3Å; M299-V662 HydrophobicContact CB-CB 4.14Å; M299-V662 HydrophobicContact CB-CG1 3.83Å; M299-V662 HydrophobicContact CB-CG2 3.99Å; M299-V662 HydrophobicContact CG-CB 4.2Å; M299-V662 HydrophobicContact CG-CG1 4.44Å; M299-V662 HydrophobicContact CG-CG2 3.87Å; L658-V662 WeakPolarHBondContact O-CB 3.48Å; L658-V662 VanDerWaalsContact O-CG2 3.31Å; L658-V662 WeakPolarHBondContact O-CG2 3.31Å; L658-V662 PolarHBondContact O-N 3.47Å; L659-V662 PolarHBondContact O-N 3.03Å; V660-V662 VanDerWaalsContact C-N 3.34Å; V660-V662 PolarHBondContact O-N 2.7Å; V662-I664 VanDerWaalsContact C-N 3.35Å; V662-I664 PolarHBondContact O-N 2.94Å; V662-I665 PolarHBondContact O-N 3.39Å; V662-F666 VanDerWaalsContact O-CB 3.32Å; V662-F666 WeakPolarHBondContact O-CB 3.19Å; V662-F666 PolarHBondContact O-N 2.89Å
663	C	97.1	Very high	95.1	Very high	10 Å²	10	54.7 Å²	54.7	7%	0.068	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-42.6	174.8	-178.4	0	0	0	0	111.3	T369 M372 L659 V660 L661 F666 A667	T369-C663 VanDerWaalsContact CG2-SG 3.58Å; T369-C663 PolarHBondContact O-SG 3.43Å; T369-C663 VanDerWaalsContact O-SG 3.41Å; M372-C663 HydrophobicContact CB-CB 4.01Å; M372-C663 HydrophobicContact SD-CB 4.45Å; L659-C663 WeakPolarHBondContact O-CB 3.39Å; L659-C663 PolarHBondContact O-N 3.44Å; V660-C663 WeakPolarHBondContact O-CB 3.42Å; V660-C663 PolarHBondContact O-N 2.89Å; L661-C663 VanDerWaalsContact C-N 3.32Å; L661-C663 PolarHBondContact O-N 2.88Å; C663-F666 PolarHBondContact O-N 2.98Å; C663-A667 VanDerWaalsContact O-CB 3.32Å; C663-A667 WeakPolarHBondContact O-CB 3.44Å; C663-A667 PolarHBondContact O-N 3.38Å
664	I	96.8	Very high	94.7	Very high	95 Å²	95	56 Å²	56	49%	0.487	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-47.5	175	-64.5	169	0	0	0	110.5	V660 L661 V662 F666 A667 I668	V660-I664 HydrophobicContact CG1-CD1 4.29Å; V660-I664 WeakPolarHBondContact O-CG1 3.25Å; V660-I664 PolarHBondContact O-N 3.43Å; L661-I664 PolarHBondContact O-N 3.04Å; V662-I664 VanDerWaalsContact C-N 3.35Å; V662-I664 PolarHBondContact O-N 2.94Å; I664-F666 VanDerWaalsContact C-N 3.34Å; I664-F666 PolarHBondContact O-N 3.38Å; I664-A667 PolarHBondContact O-N 2.8Å; I664-I668 HydrophobicContact CG2-CD1 4.08Å; I664-I668 WeakPolarHBondContact O-CG1 3.23Å; I664-I668 PolarHBondContact O-N 2.89Å
665	I	96.3	Very high	94.3	Very high	76 Å²	76	58 Å²	58	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-59.2	-47.5	177.8	-66.7	167.1	0	0	0	110.4	L661 V662 A667 I668 M669	L661-I665 HydrophobicContact CD1-CD1 4.45Å; L661-I665 HydrophobicContact CG-CD1 4.19Å; L661-I665 WeakPolarHBondContact O-CG1 3.36Å; L661-I665 PolarHBondContact O-N 2.9Å; V662-I665 PolarHBondContact O-N 3.39Å; I665-A667 VanDerWaalsContact C-N 3.35Å; I665-A667 PolarHBondContact O-N 2.84Å; I665-I668 PolarHBondContact O-N 3.03Å; I665-M669 HydrophobicContact CG2-CG 4.48Å; I665-M669 HydrophobicContact CG2-SD 3.94Å; I665-M669 WeakPolarHBondContact O-CG 3.49Å; I665-M669 PolarHBondContact O-N 2.71Å
666	F	96.3	Very high	93.8	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-39.6	178.8	-177.9	-100.6	0	0	0	111.8	P296 L297 L365 M368 M372 V662 C663 I664 I668 M669 A670	P296-F666 HydrophobicContact CB-CB 4.09Å; P296-F666 HydrophobicContact CB-CD2 4.18Å; P296-F666 HydrophobicContact CG-CB 4.4Å; P296-F666 HydrophobicContact CG-CD2 4.14Å; L297-F666 HydrophobicContact CD1-CD2 3.96Å; L297-F666 HydrophobicContact CD1-CE2 3.66Å; L365-F666 HydrophobicContact CD2-CZ 4.02Å; M368-F666 HydrophobicContact CB-CE1 3.73Å; M368-F666 HydrophobicContact CB-CZ 4Å; M368-F666 HydrophobicContact CE-CZ 4.04Å; M368-F666 HydrophobicContact SD-CZ 4.16Å; M372-F666 HydrophobicContact CE-CB 4.06Å; M372-F666 HydrophobicContact CE-CD1 3.98Å; M372-F666 HydrophobicContact CE-CD2 3.98Å; M372-F666 HydrophobicContact CE-CE1 4.46Å; M372-F666 HydrophobicContact CE-CE2 4.45Å; M372-F666 HydrophobicContact CE-CG 3.72Å; M372-F666 HydrophobicContact SD-CB 3.92Å; M372-F666 HydrophobicContact SD-CD1 4.02Å; M372-F666 HydrophobicContact SD-CG 4.01Å; V662-F666 VanDerWaalsContact O-CB 3.32Å; V662-F666 WeakPolarHBondContact O-CB 3.19Å; V662-F666 PolarHBondContact O-N 2.89Å; C663-F666 PolarHBondContact O-N 2.98Å; I664-F666 VanDerWaalsContact C-N 3.34Å; I664-F666 PolarHBondContact O-N 3.38Å; F666-I668 VanDerWaalsContact C-N 3.34Å; F666-I668 PolarHBondContact O-N 2.9Å; F666-M669 PolarHBondContact O-N 2.7Å; F666-A670 WeakPolarHBondContact O-CB 3.45Å; F666-A670 PolarHBondContact O-N 3.43Å
667	A	95.2	Very high	93.2	Very high	37 Å²	37	63.7 Å²	63.7	31%	0.306	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-41.5	175.3	0	0	0	0	0	112.1	T369 C663 I664 I665 A670 Y671	T369-A667 HydrophobicContact CG2-CB 3.85Å; C663-A667 VanDerWaalsContact O-CB 3.32Å; C663-A667 WeakPolarHBondContact O-CB 3.44Å; C663-A667 PolarHBondContact O-N 3.38Å; I664-A667 PolarHBondContact O-N 2.8Å; I665-A667 VanDerWaalsContact C-N 3.35Å; I665-A667 PolarHBondContact O-N 2.84Å; A667-A670 PolarHBondContact O-N 2.84Å; A667-Y671 WeakPolarHBondContact O-CB 2.93Å; A667-Y671 PolarHBondContact O-N 3.09Å
668	I	94.9	Very high	92.4	Very high	95 Å²	95	61.6 Å²	61.6	49%	0.487	31%	0.312	S	S	.	.	H	α-helix	trans	-64.1	-48.2	174.8	-65.6	166.6	0	0	0	110.1	I664 I665 F666 A670 Y671 F672	I664-I668 HydrophobicContact CG2-CD1 4.08Å; I664-I668 WeakPolarHBondContact O-CG1 3.23Å; I664-I668 PolarHBondContact O-N 2.89Å; I665-I668 PolarHBondContact O-N 3.03Å; F666-I668 VanDerWaalsContact C-N 3.34Å; F666-I668 PolarHBondContact O-N 2.9Å; I668-A670 VanDerWaalsContact C-N 3.3Å; I668-A670 PolarHBondContact O-N 3.1Å; I668-Y671 WeakPolarHBondContact O-CB 3.33Å; I668-Y671 PolarHBondContact O-N 2.87Å; I668-F672 HydrophobicContact CG2-CD2 4.07Å; I668-F672 HydrophobicContact CG2-CE2 3.86Å; I668-F672 WeakPolarHBondContact O-CD2 3.07Å; I668-F672 PolarHBondContact O-N 3.44Å
669	M	93.9	Very high	91.7	Very high	35 Å²	35	62.1 Å²	62.1	17%	0.172	33%	0.325	C	S	.	.	H	α-helix	trans	-60.3	-41	177.6	-70.1	176.8	61.2	0	0	112.1	F292 L293 P296 I665 F666 F672 Y673	F292-M669 HydrophobicContact CD1-CE 3.73Å; F292-M669 HydrophobicContact CE1-CE 3.53Å; F292-M669 HydrophobicContact CG-CE 4.45Å; F292-M669 HydrophobicContact CZ-CE 4.09Å; F292-M669 VanDerWaalsContact O-CE 3.23Å; F292-M669 WeakPolarHBondContact O-CE 3.08Å; L293-M669 HydrophobicContact CD2-CB 3.98Å; L293-M669 HydrophobicContact CD2-CE 4.22Å; P296-M669 HydrophobicContact CG-CE 4.15Å; P296-M669 HydrophobicContact CG-SD 3.62Å; I665-M669 HydrophobicContact CG2-CG 4.48Å; I665-M669 HydrophobicContact CG2-SD 3.94Å; I665-M669 WeakPolarHBondContact O-CG 3.49Å; I665-M669 PolarHBondContact O-N 2.71Å; F666-M669 PolarHBondContact O-N 2.7Å; M669-F672 PolarHBondContact O-N 3.4Å; M669-Y673 PolarHBondContact O-N 2.56Å
670	A	91.9	Very high	91	Very high	17 Å²	17	68.7 Å²	68.7	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-36.3	177.2	0	0	0	0	0	112.6	L365 F666 A667 I668 F672 Y673	L365-A670 HydrophobicContact CB-CB 3.72Å; L365-A670 HydrophobicContact CD1-CB 4.04Å; L365-A670 HydrophobicContact CG-CB 4.43Å; F666-A670 WeakPolarHBondContact O-CB 3.45Å; F666-A670 PolarHBondContact O-N 3.43Å; A667-A670 PolarHBondContact O-N 2.84Å; I668-A670 VanDerWaalsContact C-N 3.3Å; I668-A670 PolarHBondContact O-N 3.1Å; A670-F672 VanDerWaalsContact C-N 3.32Å; A670-F672 PolarHBondContact O-N 2.98Å; A670-Y673 PolarHBondContact O-N 3.29Å
671	Y	90.5	Very high	90.1	Very high	181 Å²	181	68 Å²	68	71%	0.71	35%	0.347	S	S	*	.	H	α-helix	trans	-62.5	-39.4	176.4	179.6	-98.7	0	0	0	112.2	A667 I668 Y673	A667-Y671 WeakPolarHBondContact O-CB 2.93Å; A667-Y671 PolarHBondContact O-N 3.09Å; I668-Y671 WeakPolarHBondContact O-CB 3.33Å; I668-Y671 PolarHBondContact O-N 2.87Å; Y671-Y673 VanDerWaalsContact C-N 3.33Å
672	F	91.6	Very high	89.2	Confident	152 Å²	152	65.1 Å²	65.1	67%	0.667	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.4	177.8	-66.9	-68.1	0	0	0	114	I668 M669 A670 T674	I668-F672 HydrophobicContact CG2-CD2 4.07Å; I668-F672 HydrophobicContact CG2-CE2 3.86Å; I668-F672 WeakPolarHBondContact O-CD2 3.07Å; I668-F672 PolarHBondContact O-N 3.44Å; M669-F672 PolarHBondContact O-N 3.4Å; A670-F672 VanDerWaalsContact C-N 3.32Å; A670-F672 PolarHBondContact O-N 2.98Å; F672-T674 PolarHBondContact O-N 3.17Å
673	Y	90.4	Very high	88.3	Confident	22 Å²	22	65.3 Å²	65.3	9%	0.086	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-78.8	123	-178.3	-172.9	-94.2	0	0	0	112	K289 L293 L365 F608 Q612 M669 A670 Y671 Y675	K289-Y673 HydrophobicContact CD-CE2 3.85Å; K289-Y673 HydrophobicContact CG-CD2 4.43Å; K289-Y673 HydrophobicContact CG-CE2 3.81Å; L293-Y673 HydrophobicContact CD1-CD1 4.14Å; L293-Y673 HydrophobicContact CD1-CD2 3.21Å; L293-Y673 HydrophobicContact CD1-CE1 4.29Å; L293-Y673 HydrophobicContact CD1-CE2 3.36Å; L293-Y673 HydrophobicContact CD1-CG 3.61Å; L293-Y673 HydrophobicContact CD2-CD2 4.15Å; L293-Y673 HydrophobicContact CG-CD2 3.66Å; L293-Y673 HydrophobicContact CG-CE2 3.96Å; L293-Y673 HydrophobicContact CG-CG 4.37Å; L365-Y673 HydrophobicContact CD1-CD1 3.65Å; L365-Y673 HydrophobicContact CD1-CE1 4.5Å; L365-Y673 HydrophobicContact CD1-CG 3.88Å; F608-Y673 HydrophobicContact CE2-CD1 4.43Å; F608-Y673 AromaticContact CE2-CE1 3.81Å; F608-Y673 HydrophobicContact CE2-CE1 3.81Å; F608-Y673 HydrophobicContact CZ-CD1 4.3Å; F608-Y673 AromaticContact CZ-CE1 3.63Å; F608-Y673 HydrophobicContact CZ-CE1 3.63Å; F608-Y673 HydrophobicContact CZ-CE2 4.48Å; F608-Y673 AromaticContact CZ-CZ 3.74Å; Q612-Y673 PolarHBondContact OE1-OH 3.08Å; M669-Y673 PolarHBondContact O-N 2.56Å; A670-Y673 PolarHBondContact O-N 3.29Å; Y671-Y673 VanDerWaalsContact C-N 3.33Å; Y673-Y675 HydrophobicContact CD1-CD2 4.44Å; Y673-Y675 HydrophobicContact CE1-CD1 4.39Å; Y673-Y675 HydrophobicContact CE1-CG 4.4Å
674	T	86.8	Confident	87.5	Confident	94 Å²	94	71 Å²	71	58%	0.577	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-95.6	121	172.1	48.4	0	0	0	0	111	K289 F672	K289-T674 PolarHBondContact NZ-O 2.9Å; K289-T674 PolarHBondContact NZ-OG1 3.4Å; F672-T674 PolarHBondContact O-N 3.17Å
675	Y	86.2	Confident	86.4	Confident	99 Å²	99	69.1 Å²	69.1	39%	0.388	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-63.4	134.3	176.9	-68.4	-97.2	0	0	0	110.6	P364 L365 F608 Y673	P364-Y675 HydrophobicContact CG-CE1 4.5Å; L365-Y675 WeakPolarHBondContact CG-OH 3.41Å; F608-Y675 AromaticContact CD2-CE1 3.92Å; F608-Y675 HydrophobicContact CD2-CE1 3.92Å; F608-Y675 HydrophobicContact CE2-CD1 4.06Å; F608-Y675 AromaticContact CE2-CE1 3.65Å; F608-Y675 HydrophobicContact CE2-CE1 3.65Å; Y673-Y675 HydrophobicContact CD1-CD2 4.44Å; Y673-Y675 HydrophobicContact CE1-CD1 4.39Å; Y673-Y675 HydrophobicContact CE1-CG 4.4Å
676	I	83.9	Confident	85	Confident	35 Å²	35	68 Å²	68	18%	0.179	35%	0.353	C	S	.	.			trans	-110.7	136.1	178.1	-61.4	177	0	0	0	107.9	M286 K289 Q612 P678 I681	M286-I676 HydrophobicContact CG-CD1 4.27Å; M286-I676 HydrophobicContact CG-CG2 4.19Å; M286-I676 HydrophobicContact SD-CG2 3.71Å; K289-I676 HydrophobicContact CD-CD1 3.65Å; Q612-I676 PolarHBondContact NE2-O 3.34Å; Q612-I676 PolarHBondContact OE1-O 3.33Å; I676-P678 WeakPolarHBondContact O-CD 3.41Å; I676-I681 HydrophobicContact CG2-CD1 3.4Å; I676-I681 HydrophobicContact CG2-CG1 4.3Å
677	D	84.6	Confident	83.4	Confident	91 Å²	91	73.6 Å²	73.6	49%	0.487	38%	0.382	S	S	.	.			trans	-95.2	107.2	168.5	179	-7	0	0	0	108.7	A679 K680 I681	D677-A679 VanDerWaalsContact C-N 3.3Å; D677-A679 PolarHBondContact O-N 2.97Å; D677-A679 WeakPolarHBondContact OD1-CB 3.17Å; D677-A679 PolarHBondContact OD1-N 2.66Å; D677-K680 HydrophobicContact CB-CB 4.08Å; D677-K680 PolarHBondContact O-N 2.9Å; D677-K680 PolarHBondContact OD1-N 2.83Å; D677-I681 PolarHBondContact O-N 2.68Å
678	P	81	Confident	81.9	Confident	14 Å²	14	75.4 Å²	75.4	9%	0.091	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-37.8	-178.2	-22.8	34.3	0	0	0	112.6	M286 S611 A613 I676 K680 I681 E682	M286-P678 HydrophobicContact SD-CB 4.43Å; S611-P678 WeakPolarHBondContact O-CD 3.31Å; S611-P678 WeakPolarHBondContact O-CG 3.44Å; A613-P678 WeakPolarHBondContact O-CG 3.45Å; I676-P678 WeakPolarHBondContact O-CD 3.41Å; P678-K680 VanDerWaalsContact C-N 3.31Å; P678-K680 PolarHBondContact O-N 2.74Å; P678-I681 PolarHBondContact O-N 2.89Å; P678-I681 VanDerWaalsContact O-N 3.16Å; P678-E682 WeakPolarHBondContact O-CB 3.36Å; P678-E682 WeakPolarHBondContact O-CG 3.33Å; P678-E682 PolarHBondContact O-N 2.88Å
679	A	80.1	Confident	80.2	Confident	68 Å²	68	77 Å²	77	56%	0.562	39%	0.392	S	S	*	.	H	α-helix	trans	-64.9	-38	-177.2	0	0	0	0	0	111.4	D677 I681 G683	D677-A679 VanDerWaalsContact C-N 3.3Å; D677-A679 PolarHBondContact O-N 2.97Å; D677-A679 WeakPolarHBondContact OD1-CB 3.17Å; D677-A679 PolarHBondContact OD1-N 2.66Å; A679-I681 VanDerWaalsContact C-N 3.34Å; A679-I681 PolarHBondContact O-N 3Å; A679-G683 PolarHBondContact O-N 2.65Å
680	K	81.8	Confident	78.3	Confident	137 Å²	137	78.5 Å²	78.5	60%	0.596	40%	0.404	S	S	*	.	H	α-helix	trans	-66.6	-34.9	176.2	-169.7	174.8	-175.1	174.3	0	112.5	D677 P678 K684	D677-K680 HydrophobicContact CB-CB 4.08Å; D677-K680 PolarHBondContact O-N 2.9Å; D677-K680 PolarHBondContact OD1-N 2.83Å; P678-K680 VanDerWaalsContact C-N 3.31Å; P678-K680 PolarHBondContact O-N 2.74Å; K680-K684 VanDerWaalsContact O-CG 3.3Å; K680-K684 WeakPolarHBondContact O-CG 3.32Å; K680-K684 PolarHBondContact O-N 2.87Å
681	I	79.6	Confident	76.6	Confident	44 Å²	44	83.1 Å²	83.1	23%	0.226	42%	0.423	C	S	.	.	H	α-helix	trans	-76.4	-46.7	177.5	-65.6	-172.7	0	0	0	110.5	A282 M286 I676 D677 P678 A679 G683 K684 F685	A282-I681 HydrophobicContact CB-CG2 4.45Å; M286-I681 HydrophobicContact CE-CB 4.28Å; M286-I681 HydrophobicContact CE-CG2 3.96Å; M286-I681 HydrophobicContact CG-CD1 4.49Å; M286-I681 HydrophobicContact SD-CB 4.44Å; M286-I681 HydrophobicContact SD-CD1 3.88Å; I676-I681 HydrophobicContact CG2-CD1 3.4Å; I676-I681 HydrophobicContact CG2-CG1 4.3Å; D677-I681 PolarHBondContact O-N 2.68Å; P678-I681 PolarHBondContact O-N 2.89Å; P678-I681 VanDerWaalsContact O-N 3.16Å; A679-I681 VanDerWaalsContact C-N 3.34Å; A679-I681 PolarHBondContact O-N 3Å; I681-G683 VanDerWaalsContact C-N 3.32Å; I681-G683 PolarHBondContact O-N 3.4Å; I681-K684 WeakPolarHBondContact O-CB 3.47Å; I681-K684 PolarHBondContact O-N 3.14Å; I681-K684 VanDerWaalsContact O-N 3.14Å; I681-F685 HydrophobicContact CG2-CD2 3.96Å; I681-F685 HydrophobicContact CG2-CE2 3.8Å; I681-F685 VanDerWaalsContact O-CD2 3.28Å; I681-F685 WeakPolarHBondContact O-CD2 3.49Å; I681-F685 PolarHBondContact O-N 2.82Å
682	E	78.9	Confident	75.1	Confident	40 Å²	40	77.9 Å²	77.9	19%	0.187	41%	0.407	C	S	.	.	H	α-helix	trans	-58.6	-44.5	176.7	-70.4	-178.8	171.6	0	0	110.7	L279 Q283 S615 P678 K684 F685 A686	L279-E682 HydrophobicContact CD1-CG 4.37Å; Q283-E682 PolarHBondContact NE2-OE1 3.15Å; S615-E682 PolarHBondContact N-OE1 3.13Å; S615-E682 VanDerWaalsContact N-OE1 3.17Å; S615-E682 PolarHBondContact OG-OE1 3.13Å; S615-E682 PolarHBondContact OG-OE2 2.76Å; P678-E682 WeakPolarHBondContact O-CB 3.36Å; P678-E682 WeakPolarHBondContact O-CG 3.33Å; P678-E682 PolarHBondContact O-N 2.88Å; E682-K684 VanDerWaalsContact C-N 3.34Å; E682-K684 PolarHBondContact O-N 3.03Å; E682-F685 PolarHBondContact O-N 3.38Å; E682-A686 WeakPolarHBondContact O-CB 3.37Å; E682-A686 PolarHBondContact O-N 3.38Å
683	G	76.7	Confident	73.4	Confident	29 Å²	29	76 Å²	76	30%	0.299	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-34.9	175.3	0	0	0	0	0	114.1	A679 I681 N687	A679-G683 PolarHBondContact O-N 2.65Å; I681-G683 VanDerWaalsContact C-N 3.32Å; I681-G683 PolarHBondContact O-N 3.4Å; G683-N687 VanDerWaalsContact O-CG 3.25Å; G683-N687 PolarHBondContact O-N 3.14Å; G683-N687 VanDerWaalsContact O-N 3.12Å; G683-N687 PolarHBondContact O-ND2 2.89Å
684	K	79.4	Confident	71.8	Confident	129 Å²	129	81.8 Å²	81.8	56%	0.561	43%	0.426	S	S	*	.	H	α-helix	trans	-63	-41.6	174.7	-80.7	175.3	-179.9	-172	0	112.1	K680 I681 E682 L688	K680-K684 VanDerWaalsContact O-CG 3.3Å; K680-K684 WeakPolarHBondContact O-CG 3.32Å; K680-K684 PolarHBondContact O-N 2.87Å; I681-K684 WeakPolarHBondContact O-CB 3.47Å; I681-K684 PolarHBondContact O-N 3.14Å; I681-K684 VanDerWaalsContact O-N 3.14Å; E682-K684 VanDerWaalsContact C-N 3.34Å; E682-K684 PolarHBondContact O-N 3.03Å; K684-L688 WeakPolarHBondContact O-CD1 3.29Å; K684-L688 WeakPolarHBondContact O-CG 3.35Å; K684-L688 PolarHBondContact O-N 3.1Å
685	F	75.1	Confident	70.3	Confident	56 Å²	56	83.1 Å²	83.1	25%	0.246	42%	0.424	C	S	.	.	H	α-helix	trans	-78.3	-34.4	179.7	-74.5	-73.8	0	0	0	112.6	K278 L279 A282 I681 E682 N687 L688 E689	K278-F685 HydrophobicContact CB-CD1 4.5Å; K278-F685 HydrophobicContact CB-CE1 4.15Å; L279-F685 HydrophobicContact CB-CB 4.39Å; L279-F685 HydrophobicContact CD1-CB 3.86Å; L279-F685 HydrophobicContact CD1-CD2 4.14Å; L279-F685 HydrophobicContact CD1-CG 4.22Å; A282-F685 HydrophobicContact CB-CD2 4.37Å; A282-F685 HydrophobicContact CB-CE2 3.61Å; A282-F685 HydrophobicContact CB-CZ 4Å; I681-F685 HydrophobicContact CG2-CD2 3.96Å; I681-F685 HydrophobicContact CG2-CE2 3.8Å; I681-F685 VanDerWaalsContact O-CD2 3.28Å; I681-F685 WeakPolarHBondContact O-CD2 3.49Å; I681-F685 PolarHBondContact O-N 2.82Å; E682-F685 PolarHBondContact O-N 3.38Å; F685-N687 PolarHBondContact O-N 2.8Å; F685-L688 HydrophobicContact CD1-CD1 3.97Å; F685-L688 HydrophobicContact CE1-CD1 4.3Å; F685-L688 PolarHBondContact O-N 2.82Å; F685-E689 PolarHBondContact O-N 1.99Å; F685-E689 VanDerWaalsContact O-N 3.15Å
686	A	66.5	Low	68.8	Low	53 Å²	53	85.5 Å²	85.5	44%	0.438	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-31.9	171.6	0	0	0	0	0	112.5	E682 P690	E682-A686 WeakPolarHBondContact O-CB 3.37Å; E682-A686 PolarHBondContact O-N 3.38Å; A686-P690 WeakPolarHBondContact O-CD 3.4Å
687	N	63.1	Low	67.5	Low	117 Å²	117	89.4 Å²	89.4	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-80.2	-21.3	174.6	-69.5	-25.1	0	0	0	113.6	G683 F685 P690	G683-N687 VanDerWaalsContact O-CG 3.25Å; G683-N687 PolarHBondContact O-N 3.14Å; G683-N687 VanDerWaalsContact O-N 3.12Å; G683-N687 PolarHBondContact O-ND2 2.89Å; F685-N687 PolarHBondContact O-N 2.8Å; N687-P690 WeakPolarHBondContact O-CD 3.35Å; N687-P690 WeakPolarHBondContact O-CG 3.28Å
688	L	63.1	Low	66.3	Low	75 Å²	75	90 Å²	90	39%	0.393	46%	0.456	S	S	.	.	H	α-helix	trans	-80.4	-34.1	177.4	-76.3	162.9	0	0	0	112.4	K684 F685 E691 D692	K684-L688 WeakPolarHBondContact O-CD1 3.29Å; K684-L688 WeakPolarHBondContact O-CG 3.35Å; K684-L688 PolarHBondContact O-N 3.1Å; F685-L688 HydrophobicContact CD1-CD1 3.97Å; F685-L688 HydrophobicContact CE1-CD1 4.3Å; F685-L688 PolarHBondContact O-N 2.82Å; L688-E691 PolarHBondContact O-N 3.07Å; L688-D692 WeakPolarHBondContact O-CB 3.47Å; L688-D692 PolarHBondContact O-N 3.2Å
689	E	58.3	Low	65.2	Low	130 Å²	130	94.5 Å²	94.5	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-52.8	-48.1	175.1	-78.2	-176.9	164.1	0	0	114.1	F685 E691 E693	F685-E689 PolarHBondContact O-N 1.99Å; F685-E689 VanDerWaalsContact O-N 3.15Å; E689-E691 PolarHBondContact O-N 3.13Å; E689-E693 WeakPolarHBondContact O-CB 3.45Å; E689-E693 PolarHBondContact O-N 3.19Å
690	P	54.6	Low	64.3	Low	66 Å²	66	97.4 Å²	97.4	43%	0.429	48%	0.48	S	S	.	.	H	α-helix	trans	-70.3	-27.2	177.1	23.7	-31.7	0	0	0	113.7	A686 N687 K694	A686-P690 WeakPolarHBondContact O-CD 3.4Å; N687-P690 WeakPolarHBondContact O-CD 3.35Å; N687-P690 WeakPolarHBondContact O-CG 3.28Å; P690-K694 WeakPolarHBondContact O-CB 3.3Å; P690-K694 VanDerWaalsContact O-CG 3.25Å; P690-K694 WeakPolarHBondContact O-CG 3.45Å; P690-K694 PolarHBondContact O-N 2.98Å
691	E	55.9	Low	63.4	Low	113 Å²	113	94.6 Å²	94.6	53%	0.528	47%	0.474	S	S	.	.	H	α-helix	trans	-76.5	-40.1	174.5	-76.3	-155.4	164.7	0	0	112.8	L688 E689 K694 K695	L688-E691 PolarHBondContact O-N 3.07Å; E689-E691 PolarHBondContact O-N 3.13Å; E691-K694 PolarHBondContact O-N 3.18Å; E691-K695 WeakPolarHBondContact O-CB 3.21Å; E691-K695 WeakPolarHBondContact O-CG 3.19Å; E691-K695 PolarHBondContact O-N 3Å
692	D	58.9	Low	62.6	Low	72 Å²	72	95.8 Å²	95.8	39%	0.385	48%	0.483	S	S	.	.	H	α-helix	trans	-70.9	-34.9	176.4	-81.9	-17.1	0	0	0	111.2	L688 K695 K696	L688-D692 WeakPolarHBondContact O-CB 3.47Å; L688-D692 PolarHBondContact O-N 3.2Å; D692-K695 PolarHBondContact O-N 3.27Å; D692-K696 WeakPolarHBondContact O-CB 3.38Å; D692-K696 PolarHBondContact O-N 2.77Å
693	E	56.2	Low	61.6	Low	112 Å²	112	100.7 Å²	100.7	52%	0.523	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-44.7	167.7	-92.2	-138	175.2	0	0	112	E689 K695 K696 K697	E689-E693 WeakPolarHBondContact O-CB 3.45Å; E689-E693 PolarHBondContact O-N 3.19Å; E693-K695 VanDerWaalsContact C-N 3.35Å; E693-K696 PolarHBondContact O-N 3.49Å; E693-K697 WeakPolarHBondContact O-CB 3.4Å; E693-K697 WeakPolarHBondContact O-CG 3.45Å; E693-K697 PolarHBondContact O-N 2.88Å; E693-K697 IonicContact OE2-NZ 2.79Å; E693-K697 PolarHBondContact OE2-NZ 2.88Å
694	K	56.2	Low	60.8	Low	144 Å²	144	106.8 Å²	106.8	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-41.3	174.8	-83.1	176.1	179.6	178.3	0	111.6	P690 E691 N698	P690-K694 WeakPolarHBondContact O-CB 3.3Å; P690-K694 VanDerWaalsContact O-CG 3.25Å; P690-K694 WeakPolarHBondContact O-CG 3.45Å; P690-K694 PolarHBondContact O-N 2.98Å; E691-K694 PolarHBondContact O-N 3.18Å; K694-N698 VanDerWaalsContact O-CB 3.27Å; K694-N698 WeakPolarHBondContact O-CB 3.4Å; K694-N698 PolarHBondContact O-N 2.94Å; K694-N698 PolarHBondContact O-ND2 2.84Å; K694-N698 PolarHBondContact O-OD1 2.95Å
695	K	55.9	Low	59.8	Low	122 Å²	122	104.2 Å²	104.2	53%	0.53	52%	0.515	S	S	.	.	H	α-helix	trans	-65.7	-44.1	175.4	-83.8	177.5	179.7	165.1	0	112	E691 D692 E693 N698 L699	E691-K695 WeakPolarHBondContact O-CB 3.21Å; E691-K695 WeakPolarHBondContact O-CG 3.19Å; E691-K695 PolarHBondContact O-N 3Å; D692-K695 PolarHBondContact O-N 3.27Å; E693-K695 VanDerWaalsContact C-N 3.35Å; K695-N698 PolarHBondContact O-N 3.08Å; K695-L699 WeakPolarHBondContact O-CB 3.23Å; K695-L699 WeakPolarHBondContact O-CD1 3.46Å; K695-L699 PolarHBondContact O-N 2.77Å
696	K	55.3	Low	58.8	Low	149 Å²	149	107.7 Å²	107.7	65%	0.648	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-46	175.2	-86.2	-177.2	175	176.9	0	111.7	D692 E693 N698 L699 E700	D692-K696 WeakPolarHBondContact O-CB 3.38Å; D692-K696 PolarHBondContact O-N 2.77Å; E693-K696 PolarHBondContact O-N 3.49Å; K696-N698 PolarHBondContact O-N 3.34Å; K696-L699 PolarHBondContact O-N 3.07Å; K696-E700 WeakPolarHBondContact O-CB 3.49Å; K696-E700 WeakPolarHBondContact O-CG 3.22Å; K696-E700 PolarHBondContact O-N 2.68Å
697	K	57.1	Low	58.4	Low	116 Å²	116	109.4 Å²	109.4	50%	0.504	54%	0.538	S	S	.	.	H	α-helix	trans	-59.9	-44.7	174.5	-79.2	170	174.9	150	0	111.2	E693 L699 E700 V701	E693-K697 WeakPolarHBondContact O-CB 3.4Å; E693-K697 WeakPolarHBondContact O-CG 3.45Å; E693-K697 PolarHBondContact O-N 2.88Å; E693-K697 IonicContact OE2-NZ 2.79Å; E693-K697 PolarHBondContact OE2-NZ 2.88Å; K697-L699 PolarHBondContact O-N 2.82Å; K697-E700 PolarHBondContact O-N 2.81Å; K697-V701 WeakPolarHBondContact O-CB 3.05Å; K697-V701 WeakPolarHBondContact O-CG2 3.17Å; K697-V701 PolarHBondContact O-N 2.8Å
698	N	59	Low	58.1	Low	105 Å²	105	110.2 Å²	110.2	56%	0.561	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-41.9	175.8	-73.1	-10.2	0	0	0	112.1	K694 K695 K696 V701 T702	K694-N698 VanDerWaalsContact O-CB 3.27Å; K694-N698 WeakPolarHBondContact O-CB 3.4Å; K694-N698 PolarHBondContact O-N 2.94Å; K694-N698 PolarHBondContact O-ND2 2.84Å; K694-N698 PolarHBondContact O-OD1 2.95Å; K695-N698 PolarHBondContact O-N 3.08Å; K696-N698 PolarHBondContact O-N 3.34Å; N698-V701 PolarHBondContact O-N 2.84Å; N698-T702 PolarHBondContact O-N 2.76Å; N698-T702 PolarHBondContact O-OG1 3.2Å
699	L	57.9	Low	57.7	Low	108 Å²	108	111.1 Å²	111.1	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-66.4	-35.5	176.1	-96.5	142.1	0	0	0	113	K695 K696 K697 K703	K695-L699 WeakPolarHBondContact O-CB 3.23Å; K695-L699 WeakPolarHBondContact O-CD1 3.46Å; K695-L699 PolarHBondContact O-N 2.77Å; K696-L699 PolarHBondContact O-N 3.07Å; K697-L699 PolarHBondContact O-N 2.82Å; L699-K703 WeakPolarHBondContact O-CB 3.43Å; L699-K703 WeakPolarHBondContact O-CG 3.45Å; L699-K703 PolarHBondContact O-N 3.02Å
700	E	60.3	Low	57.5	Low	129 Å²	129	110.7 Å²	110.7	60%	0.603	54%	0.541	S	S	*	.	H	α-helix	trans	-70.3	-37.9	173.4	-76.9	-179.2	175.5	0	0	111.9	K696 K697 K703 K704	K696-E700 WeakPolarHBondContact O-CB 3.49Å; K696-E700 WeakPolarHBondContact O-CG 3.22Å; K696-E700 PolarHBondContact O-N 2.68Å; K697-E700 PolarHBondContact O-N 2.81Å; E700-K703 PolarHBondContact O-N 3.12Å; E700-K704 PolarHBondContact O-N 3.48Å
701	V	64.2	Low	57.5	Low	77 Å²	77	111.9 Å²	111.9	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-48.8	172.4	173	0	0	0	0	110.4	K697 N698 K703 K704 D705	K697-V701 WeakPolarHBondContact O-CB 3.05Å; K697-V701 WeakPolarHBondContact O-CG2 3.17Å; K697-V701 PolarHBondContact O-N 2.8Å; N698-V701 PolarHBondContact O-N 2.84Å; V701-K703 VanDerWaalsContact C-N 3.3Å; V701-K703 PolarHBondContact O-N 3.2Å; V701-K704 WeakPolarHBondContact O-CB 3.39Å; V701-K704 PolarHBondContact O-N 3.24Å; V701-K704 VanDerWaalsContact O-N 3.07Å; V701-D705 VanDerWaalsContact O-CG 3.23Å; V701-D705 PolarHBondContact O-N 3.43Å
702	T	62.7	Low	57.4	Low	69 Å²	69	111.7 Å²	111.7	42%	0.423	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-36.6	176.7	-45.9	0	0	0	0	112.2	N698 D705 M706	N698-T702 PolarHBondContact O-N 2.76Å; N698-T702 PolarHBondContact O-OG1 3.2Å; T702-D705 PolarHBondContact O-N 2.84Å; T702-M706 HydrophobicContact CG2-CE 4.11Å; T702-M706 WeakPolarHBondContact O-CB 3.42Å; T702-M706 VanDerWaalsContact O-CG 3.23Å; T702-M706 WeakPolarHBondContact O-CG 3.47Å; T702-M706 PolarHBondContact O-N 2.83Å
703	K	58.1	Low	57.2	Low	144 Å²	144	115.7 Å²	115.7	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-66.8	-40	173.5	-84.5	-177.6	176.3	-179.6	0	112.3	L699 E700 V701 V707	L699-K703 WeakPolarHBondContact O-CB 3.43Å; L699-K703 WeakPolarHBondContact O-CG 3.45Å; L699-K703 PolarHBondContact O-N 3.02Å; E700-K703 PolarHBondContact O-N 3.12Å; V701-K703 VanDerWaalsContact C-N 3.3Å; V701-K703 PolarHBondContact O-N 3.2Å; K703-V707 VanDerWaalsContact O-CG2 3.24Å; K703-V707 WeakPolarHBondContact O-CG2 3.43Å; K703-V707 PolarHBondContact O-N 2.87Å; K703-V707 VanDerWaalsContact O-N 3.07Å
704	K	58.9	Low	56.8	Low	157 Å²	157	118.3 Å²	118.3	68%	0.683	56%	0.562	S	S	*	*	H	α-helix	trans	-63.6	-45.3	173.4	-88.1	-176.5	171.8	-179.1	0	111.6	E700 V701 M706 V707 E708	E700-K704 PolarHBondContact O-N 3.48Å; V701-K704 WeakPolarHBondContact O-CB 3.39Å; V701-K704 PolarHBondContact O-N 3.24Å; V701-K704 VanDerWaalsContact O-N 3.07Å; K704-M706 VanDerWaalsContact C-N 3.31Å; K704-M706 PolarHBondContact O-N 3.44Å; K704-V707 PolarHBondContact O-N 3.06Å; K704-V707 VanDerWaalsContact O-N 3.13Å; K704-E708 PolarHBondContact O-N 3.17Å
705	D	58.7	Low	56.6	Low	75 Å²	75	120.7 Å²	120.7	40%	0.401	57%	0.567	S	S	.	*	H	α-helix	trans	-64.5	-34.9	178.9	-64.4	-18.9	0	0	0	112.3	V701 T702 N709	V701-D705 VanDerWaalsContact O-CG 3.23Å; V701-D705 PolarHBondContact O-N 3.43Å; T702-D705 PolarHBondContact O-N 2.84Å; D705-N709 VanDerWaalsContact O-CB 3.31Å; D705-N709 WeakPolarHBondContact O-CB 3.28Å; D705-N709 PolarHBondContact O-N 2.89Å; D705-N709 PolarHBondContact O-ND2 3.15Å; D705-N709 VanDerWaalsContact O-ND2 3.16Å
706	M	53.2	Low	56.4	Low	128 Å²	128	122 Å²	122	63%	0.631	57%	0.573	S	S	*	*	H	α-helix	trans	-69	-38.2	173.5	-77.2	-178.7	172.3	0	0	112.1	T702 K704 H710	T702-M706 HydrophobicContact CG2-CE 4.11Å; T702-M706 WeakPolarHBondContact O-CB 3.42Å; T702-M706 VanDerWaalsContact O-CG 3.23Å; T702-M706 WeakPolarHBondContact O-CG 3.47Å; T702-M706 PolarHBondContact O-N 2.83Å; K704-M706 VanDerWaalsContact C-N 3.31Å; K704-M706 PolarHBondContact O-N 3.44Å; M706-H710 VanDerWaalsContact O-CB 3.3Å; M706-H710 WeakPolarHBondContact O-CB 3.26Å; M706-H710 PolarHBondContact O-N 3.49Å
707	V	59.5	Low	56.2	Low	90 Å²	90	118.4 Å²	118.4	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-72.1	-38.7	177.2	171.8	0	0	0	0	111.3	K703 K704 H710 N711	K703-V707 VanDerWaalsContact O-CG2 3.24Å; K703-V707 WeakPolarHBondContact O-CG2 3.43Å; K703-V707 PolarHBondContact O-N 2.87Å; K703-V707 VanDerWaalsContact O-N 3.07Å; K704-V707 PolarHBondContact O-N 3.06Å; K704-V707 VanDerWaalsContact O-N 3.13Å; V707-H710 PolarHBondContact O-N 2.95Å; V707-N711 WeakPolarHBondContact O-CB 3.3Å; V707-N711 PolarHBondContact O-N 2.86Å
708	E	56.9	Low	55.8	Low	133 Å²	133	115.9 Å²	115.9	62%	0.621	56%	0.563	S	S	*	*	H	α-helix	trans	-65.8	-46.7	174	-81.5	-175	164	0	0	111.8	K704 H710 N711 E712	K704-E708 PolarHBondContact O-N 3.17Å; E708-H710 VanDerWaalsContact C-N 3.26Å; E708-H710 PolarHBondContact O-N 3.35Å; E708-N711 PolarHBondContact O-N 2.8Å; E708-N711 VanDerWaalsContact O-N 3.15Å; E708-E712 WeakPolarHBondContact O-CB 3.42Å; E708-E712 PolarHBondContact O-N 2.91Å
709	N	54.1	Low	55	Low	94 Å²	94	117.4 Å²	117.4	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-60.4	-34.6	174.2	-92.4	-56.7	0	0	0	112.9	D705 K713	D705-N709 VanDerWaalsContact O-CB 3.31Å; D705-N709 WeakPolarHBondContact O-CB 3.28Å; D705-N709 PolarHBondContact O-N 2.89Å; D705-N709 PolarHBondContact O-ND2 3.15Å; D705-N709 VanDerWaalsContact O-ND2 3.16Å; N709-K713 WeakPolarHBondContact O-CB 3.43Å; N709-K713 WeakPolarHBondContact O-CG 3.3Å; N709-K713 PolarHBondContact O-N 3.34Å
710	H	53.6	Low	54.3	Low	122 Å²	122	117 Å²	117	57%	0.565	58%	0.578	S	S	*	*	H	α-helix	trans	-73.4	-32.6	178	-152.8	-45.7	0	0	0	112.3	M706 V707 E708 R714	M706-H710 VanDerWaalsContact O-CB 3.3Å; M706-H710 WeakPolarHBondContact O-CB 3.26Å; M706-H710 PolarHBondContact O-N 3.49Å; V707-H710 PolarHBondContact O-N 2.95Å; E708-H710 VanDerWaalsContact C-N 3.26Å; E708-H710 PolarHBondContact O-N 3.35Å; H710-R714 PolarHBondContact O-N 3.15Å
711	N	54	Low	53.5	Low	90 Å²	90	115.5 Å²	115.5	48%	0.481	58%	0.581	S	S	.	*	H	α-helix	trans	-75.1	-34.4	172.6	-82.2	-20.1	0	0	0	112.4	V707 E708 R714 R715	V707-N711 WeakPolarHBondContact O-CB 3.3Å; V707-N711 PolarHBondContact O-N 2.86Å; E708-N711 PolarHBondContact O-N 2.8Å; E708-N711 VanDerWaalsContact O-N 3.15Å; N711-R714 PolarHBondContact O-N 2.82Å; N711-R715 PolarHBondContact O-N 2.79Å
712	E	54.9	Low	52.3	Low	109 Å²	109	115.9 Å²	115.9	51%	0.509	59%	0.588	S	S	.	*	H	α-helix	trans	-70.7	-38.4	176.4	-146.5	-176.6	-164.9	0	0	111.7	E708 R714 R715 K716	E708-E712 WeakPolarHBondContact O-CB 3.42Å; E708-E712 PolarHBondContact O-N 2.91Å; E712-R714 VanDerWaalsContact C-N 3.35Å; E712-R715 PolarHBondContact O-N 3.27Å; E712-K716 PolarHBondContact O-N 2.98Å
713	K	54	Low	51.1	Low	156 Å²	156	120 Å²	120	68%	0.678	61%	0.607	S	S	*	*	H	α-helix	trans	-62.4	-38.3	169.2	-81.2	-179.1	176.4	179.2	0	112.7	N709 K716 S717	N709-K713 WeakPolarHBondContact O-CB 3.43Å; N709-K713 WeakPolarHBondContact O-CG 3.3Å; N709-K713 PolarHBondContact O-N 3.34Å; K713-K716 PolarHBondContact O-N 2.9Å; K713-S717 PolarHBondContact O-N 3.44Å; K713-S717 PolarHBondContact O-OG 2.92Å
714	R	49.4	Very low	50.1	Low	167 Å²	167	122.1 Å²	122.1	63%	0.63	62%	0.619	S	S	*	*	H	α-helix	trans	-66.4	-38.1	173.5	-92.9	-177.2	172.2	-179.7	-2.8	113.1	H710 N711 E712 S717 S718	H710-R714 PolarHBondContact O-N 3.15Å; N711-R714 PolarHBondContact O-N 2.82Å; E712-R714 VanDerWaalsContact C-N 3.35Å; R714-S717 WeakPolarHBondContact CA-OG 3.5Å; R714-S717 PolarHBondContact O-N 2.84Å; R714-S717 PolarHBondContact O-OG 2.88Å; R714-S718 PolarHBondContact O-N 2.99Å; R714-S718 VanDerWaalsContact O-N 3.08Å; R714-S718 PolarHBondContact O-OG 3.45Å
715	R	51.3	Low	48.9	Very low	194 Å²	194	123.2 Å²	123.2	73%	0.732	63%	0.627	S	S	*	*	H	α-helix	trans	-68.5	-36.3	174.6	-85.6	-178.6	169.6	172.6	-3	112.8	N711 E712 S718 N719	N711-R715 PolarHBondContact O-N 2.79Å; E712-R715 PolarHBondContact O-N 3.27Å; R715-S718 WeakPolarHBondContact CA-OG 3.4Å; R715-S718 PolarHBondContact O-OG 2.89Å; R715-N719 PolarHBondContact O-N 2.99Å
716	K	52.2	Low	47.7	Very low	151 Å²	151	127.8 Å²	127.8	66%	0.657	65%	0.646	S	S	*	*	H	α-helix	trans	-70.7	-32.8	174.1	-78.3	180	177.4	171.5	0	112.6	E712 K713	E712-K716 PolarHBondContact O-N 2.98Å; K713-K716 PolarHBondContact O-N 2.9Å
717	S	50.7	Low	46.6	Very low	72 Å²	72	128.8 Å²	128.8	50%	0.503	66%	0.659	S	S	.	*	H	α-helix	trans	-76.6	-22.9	174.2	62.1	0	0	0	0	114.2	K713 R714 S720	K713-S717 PolarHBondContact O-N 3.44Å; K713-S717 PolarHBondContact O-OG 2.92Å; R714-S717 WeakPolarHBondContact CA-OG 3.5Å; R714-S717 PolarHBondContact O-N 2.84Å; R714-S717 PolarHBondContact O-OG 2.88Å; S717-S720 PolarHBondContact O-OG 2.8Å
718	S	47.4	Very low	45.3	Very low	63 Å²	63	129.5 Å²	129.5	44%	0.441	67%	0.668	S	S	.	*	H	α-helix	trans	-85	-17.3	177.1	60.9	0	0	0	0	114	R714 R715	R714-S718 PolarHBondContact O-N 2.99Å; R714-S718 VanDerWaalsContact O-N 3.08Å; R714-S718 PolarHBondContact O-OG 3.45Å; R715-S718 WeakPolarHBondContact CA-OG 3.4Å; R715-S718 PolarHBondContact O-OG 2.89Å
719	N	44.1	Very low	44.2	Very low	138 Å²	138	131.7 Å²	131.7	74%	0.738	68%	0.678	S	S	*	*	S	Bend	trans	-92.3	-0.5	177	-86.4	17	0	0	0	113.5	R715	R715-N719 PolarHBondContact O-N 2.99Å
720	S	42.7	Very low	43.3	Very low	99 Å²	99	132.6 Å²	132.6	69%	0.692	69%	0.687	S	S	*	*	S	Bend	trans	-109.8	15.3	179.8	70.6	0	0	0	0	113.6	S717	S717-S720 PolarHBondContact O-OG 2.8Å
721	S	42.7	Very low	42.4	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	70%	0.697	S	S	*	*	S	Bend	trans	-135.8	30.9	-175.5	71.1	0	0	0	0	113.3
722	S	38.6	Very low	41.4	Very low	86 Å²	86	142.7 Å²	142.7	60%	0.601	73%	0.733	S	S	*	*	S	Bend	trans	-140.6	40.8	-179.5	64.8	0	0	0	0	113
723	D	38.2	Very low	40.7	Very low	156 Å²	156	144.4 Å²	144.4	83%	0.834	74%	0.744	S	S	*	*	S	Bend	trans	-151.7	80	164.4	-83.4	-37.8	0	0	0	107.7
724	E	37.5	Very low	40	Very low	187 Å²	187	143.7 Å²	143.7	87%	0.874	75%	0.747	S	S	*	*			trans	159.7	91.7	154.5	-91.4	172.6	-169.2	0	0	108.2
725	E	33.6	Very low	39.5	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	75%	0.754	S	S	*	*				176.1	121.3	126.4	-96.6	174.7	168.6	0	0	112.4
726	E	33.5	Very low	38.8	Very low	172 Å²	172	139.4 Å²	139.4	80%	0.804	76%	0.755	S	S	*	*			trans	78.6	90.6	143.5	-64.8	-170.9	148.2	0	0	121.5
727	T	30	Very low	38	Very low	149 Å²	149	138.7 Å²	138.7	91%	0.914	76%	0.761	S	S	*	*			trans	-66.8	112.3	133	39.5	0	0	0	0	111.4
728	S	32.3	Very low	37.1	Very low	104 Å²	104	143.1 Å²	143.1	73%	0.727	78%	0.778	S	S	*	*			trans	-144.3	101.9	151.5	124	0	0	0	0	110.8
729	Q	33.9	Very low	36.4	Very low	180 Å²	180	148.9 Å²	148.9	84%	0.841	80%	0.802	S	S	*	*			trans	35.2	110.9	144.1	-75.4	178.1	-13.6	0	0	122.8
730	T	34.8	Very low	35.8	Very low	113 Å²	113	149.7 Å²	149.7	69%	0.693	81%	0.807	S	S	*	*				35.9	117	118.5	49.6	0	0	0	0	121.5
731	N	35.2	Very low	35.2	Very low	144 Å²	144	153.9 Å²	153.9	77%	0.77	82%	0.817	S	S	*	*				147.9	101.1	112.3	-85.2	-18	0	0	0	112.5
732	F	32.7	Very low	34.6	Very low	279 Å²	279	159.1 Å²	159.1	100%	1.224	83%	0.829	S	S	*	*				178.1	0	113.4	-110.2	-78.8	0	0	0	110.2

Retrieved 732 of 732 residues in 1282.6 ms (Link to these results)

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