A0A077Z2R3_TRITR Loading...

PPR 3 and PPR domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z2R3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,303 aa.

						>A0A077Z2R3_TRITR|A0A077Z2R3
MNDTLNAIAERRLWERTRRSVLITSQLNATAADALGRMRSDVFRMGVIYPETLNIFLGSLSSDDKINVQDAFFLISCCGSALPECVPSERMKLLQKVWDILPSHGILAFLMFITPSFHLVVCQGVEYNLDDYNARLVVAKENGVKISSDQFLSEMAKAGIEPSQTTYELLIAHCCQDGDIKEATRLLELLKEKKMPINERVFASLINGYLKANDEANASAIEELMKSRGLRPGSLTYVAKLLAYAEQADRQKIEAVSTIYVFFCLVKPSASIFALFLNLFCEVNSANIFLSDDDVLEAACILAKNGHDELIDQVLANLRKQIGFTHKAKNASIRLASLGLFEASYKVMQTVNKANDPTRMLVDVGDRLLRHMVKIAVSQAYRQPKPVEVIGDFCRRMENDGLHRKAFASALRLIRQMAVSGVALRPQYFWPLICMEDAAEGHTVKTLELMLEMNVPITMTTMADWFWSHSPSMTVETLSKLPVGAKLGQNFVSLSYLCHLMKNADANSALEFANKNKSPMLSVGKVTECLLTLFGRDQNHEVTVALLERLNTMLQVEPTAAEFNGDLVIRLSNMFEAEQLNRVLENMIARKLPVSEIAIEYMISRGKLADNSEIVEKLRLVASSGEETAAKAPDDTADKILSDFTTGGRDVSIRAERLLQRTLAEKKYDEAVKLYNFLKENYPSSAVIFDKHMITLCARKSYLDEALSLFRDGLENRGLRDSRTAIDLAMALVSGRRFFDAVDVLKSHRSFMSNINTKAISYDVNQLLTKACECGNVEELCDLVEALLESGYSVGNNMPLLKCARVLLANGDLKKAVDFFDASCVRFRRLPFASELLVALIQAENSALLQRGERESRMNNGLYDLIVEKRGESSALTMLTLALISARRIEQAEQLLKKRDITFDSGQLTAFCRNRVLASKVRDLESLLTVTRDMPAVSRDLLYCYLLIAYRNSMNWRNAADAWNRMKEENFNPSRRLLLLFQKIFSECKQQPPDDLQNLLDGSGFADSILSEGDLLSSIYASLPSCEVNALLNQGNIDAAADRYYELGKSGQAMPVQLSRRLFGALRNAGNYETMAKIRRYVSSVDARYLNLNFMISEAMIESGNVEAFLKPLENNPASVVSSGLFAFLLECQPDLEERVKAYSVRAMAKGNVVPKVGLWVYYVAKGREEEANAIMTELGEDVLTKNMRYMYLVQQARSRNRPELVKQILLLLKRHTPEQLSSAVGYIINLDLSAGRLDSLKEMIEFAQENKCTESGIYRRAIQRIDRGSIVSDSAIGNLAEDSNEDEDLIVDKEAIPVREKN
					

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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	37.4	Very low	41.4	Very low	181 Å²	181	96.5 Å²	96.5	89%	0.892	51%	0.507	S	S	*	.				0	-52.4	0	-138.5	174	-162.1	0	0	110.9	T4 L5	M1-T4 VanDerWaalsContact CA-OG1 3.27Å; M1-T4 WeakPolarHBondContact CA-OG1 3.3Å; M1-T4 PolarHBondContact N-OG1 3Å; M1-T4 CarbonylContact O-C 3.55Å; M1-T4 WeakPolarHBondContact O-CA 3.25Å; M1-T4 VanDerWaalsContact O-CB 3.22Å; M1-T4 WeakPolarHBondContact O-CB 3.47Å; M1-T4 PolarHBondContact O-N 3.05Å; M1-T4 VanDerWaalsContact O-N 3.16Å; M1-T4 PolarHBondContact O-OG1 3.08Å; M1-L5 PolarHBondContact O-N 3.04Å
2	N	37.8	Very low	41.6	Very low	81 Å²	81	101.8 Å²	101.8	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-39.1	170.7	-83.2	6.7	0	0	0	113.3	T4 L5 N6	N2-T4 PolarHBondContact O-N 3.39Å; N2-L5 CarbonylContact O-C 3.59Å; N2-L5 PolarHBondContact O-N 3.15Å; N2-L5 VanDerWaalsContact O-N 3.08Å; N2-N6 WeakPolarHBondContact O-CB 3.47Å; N2-N6 PolarHBondContact O-N 3.17Å
3	D	38.5	Very low	41.8	Very low	99 Å²	99	103.8 Å²	103.8	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-62	-34	173.5	-41.9	-73.6	0	0	0	111.5	A7	D3-A7 WeakPolarHBondContact O-CB 3.46Å; D3-A7 PolarHBondContact O-N 3.13Å
4	T	37.5	Very low	41.7	Very low	80 Å²	80	104.1 Å²	104.1	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-68.8	-41	174.4	-22.4	0	0	0	0	111.1	M1 N2 I8	M1-T4 VanDerWaalsContact CA-OG1 3.27Å; M1-T4 WeakPolarHBondContact CA-OG1 3.3Å; M1-T4 PolarHBondContact N-OG1 3Å; M1-T4 CarbonylContact O-C 3.55Å; M1-T4 WeakPolarHBondContact O-CA 3.25Å; M1-T4 VanDerWaalsContact O-CB 3.22Å; M1-T4 WeakPolarHBondContact O-CB 3.47Å; M1-T4 PolarHBondContact O-N 3.05Å; M1-T4 VanDerWaalsContact O-N 3.16Å; M1-T4 PolarHBondContact O-OG1 3.08Å; N2-T4 PolarHBondContact O-N 3.39Å; T4-I8 VanDerWaalsContact O-CB 3.29Å; T4-I8 WeakPolarHBondContact O-CB 3.49Å; T4-I8 VanDerWaalsContact O-CD1 3.28Å; T4-I8 WeakPolarHBondContact O-CD1 3.44Å; T4-I8 WeakPolarHBondContact O-CG1 3.46Å; T4-I8 PolarHBondContact O-N 2.98Å
5	L	45.2	Very low	41.7	Very low	96 Å²	96	103.9 Å²	103.9	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-71.7	-36.9	176.8	-76.8	165.5	0	0	0	112.8	M1 N2 I8 A9	M1-L5 PolarHBondContact O-N 3.04Å; N2-L5 CarbonylContact O-C 3.59Å; N2-L5 PolarHBondContact O-N 3.15Å; N2-L5 VanDerWaalsContact O-N 3.08Å; L5-I8 CarbonylContact O-C 3.59Å; L5-I8 PolarHBondContact O-N 3.21Å; L5-A9 WeakPolarHBondContact O-CB 3.24Å; L5-A9 PolarHBondContact O-N 2.99Å
6	N	44.3	Very low	41.8	Very low	63 Å²	63	110.3 Å²	110.3	34%	0.337	53%	0.532	S	S	.	.	H	α-helix	trans	-68.7	-45	173	-76.5	-1.9	0	0	0	110.5	N2 I8 A9 E10	N2-N6 WeakPolarHBondContact O-CB 3.47Å; N2-N6 PolarHBondContact O-N 3.17Å; N6-I8 PolarHBondContact O-N 2.88Å; N6-A9 PolarHBondContact O-N 3.49Å; N6-E10 WeakPolarHBondContact O-CB 3.45Å; N6-E10 WeakPolarHBondContact O-CG 3.37Å; N6-E10 PolarHBondContact O-N 3.14Å
7	A	44.5	Very low	41.9	Very low	48 Å²	48	108.6 Å²	108.6	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-31.3	171.3	0	0	0	0	0	112.6	D3 R11	D3-A7 WeakPolarHBondContact O-CB 3.46Å; D3-A7 PolarHBondContact O-N 3.13Å; A7-R11 WeakPolarHBondContact O-CB 3.18Å; A7-R11 WeakPolarHBondContact O-CG 3.34Å; A7-R11 PolarHBondContact O-N 3.43Å
8	I	41.4	Very low	41.6	Very low	66 Å²	66	111.9 Å²	111.9	34%	0.338	54%	0.536	S	S	.	.	H	α-helix	trans	-74.8	-33	171.3	-73.4	162.8	0	0	0	111.8	T4 L5 N6 R12	T4-I8 VanDerWaalsContact O-CB 3.29Å; T4-I8 WeakPolarHBondContact O-CB 3.49Å; T4-I8 VanDerWaalsContact O-CD1 3.28Å; T4-I8 WeakPolarHBondContact O-CD1 3.44Å; T4-I8 WeakPolarHBondContact O-CG1 3.46Å; T4-I8 PolarHBondContact O-N 2.98Å; L5-I8 CarbonylContact O-C 3.59Å; L5-I8 PolarHBondContact O-N 3.21Å; N6-I8 PolarHBondContact O-N 2.88Å; I8-R12 HydrophobicContact CG2-CG 4.37Å; I8-R12 WeakPolarHBondContact O-CB 3.39Å; I8-R12 WeakPolarHBondContact O-CG 3.34Å; I8-R12 PolarHBondContact O-N 3.42Å
9	A	46	Very low	41.3	Very low	50 Å²	50	117.2 Å²	117.2	41%	0.413	55%	0.55	S	S	.	.	H	α-helix	trans	-73.4	-45.2	177.6	0	0	0	0	0	111.3	L5 N6 R12 L13	L5-A9 WeakPolarHBondContact O-CB 3.24Å; L5-A9 PolarHBondContact O-N 2.99Å; N6-A9 PolarHBondContact O-N 3.49Å; A9-R12 PolarHBondContact O-N 3.11Å; A9-R12 VanDerWaalsContact O-N 3.12Å; A9-L13 PolarHBondContact O-N 3.12Å
10	E	42.4	Very low	40.9	Very low	132 Å²	132	115.2 Å²	115.2	62%	0.617	55%	0.549	S	S	*	.	H	α-helix	trans	-61.1	-45.8	169.9	-69.6	179.2	168.1	0	0	110.6	N6 R12 L13 W14	N6-E10 WeakPolarHBondContact O-CB 3.45Å; N6-E10 WeakPolarHBondContact O-CG 3.37Å; N6-E10 PolarHBondContact O-N 3.14Å; E10-R12 VanDerWaalsContact C-N 3.32Å; E10-R12 PolarHBondContact O-N 3.15Å; E10-L13 PolarHBondContact O-N 3.37Å; E10-W14 WeakPolarHBondContact O-CB 3.43Å; E10-W14 PolarHBondContact O-N 3.38Å
11	R	40.8	Very low	40.6	Very low	166 Å²	166	116.7 Å²	116.7	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-59.2	-38	169.7	-89.5	-174.3	167.1	173.6	-3.6	112.9	A7 W14 E15	A7-R11 WeakPolarHBondContact O-CB 3.18Å; A7-R11 WeakPolarHBondContact O-CG 3.34Å; A7-R11 PolarHBondContact O-N 3.43Å; R11-W14 CarbonylContact O-C 3.6Å; R11-W14 WeakPolarHBondContact O-CB 3.18Å; R11-W14 PolarHBondContact O-N 2.87Å; R11-E15 VanDerWaalsContact O-CB 3.26Å; R11-E15 WeakPolarHBondContact O-CB 3.34Å; R11-E15 WeakPolarHBondContact O-CG 3.45Å; R11-E15 PolarHBondContact O-N 2.93Å
12	R	43.8	Very low	40.8	Very low	159 Å²	159	114.3 Å²	114.3	60%	0.6	56%	0.556	S	S	*	*	H	α-helix	trans	-72	-33.1	179	-82.2	171.5	175.5	-174	-0.5	112.6	I8 A9 E10 W14 R16	I8-R12 HydrophobicContact CG2-CG 4.37Å; I8-R12 WeakPolarHBondContact O-CB 3.39Å; I8-R12 WeakPolarHBondContact O-CG 3.34Å; I8-R12 PolarHBondContact O-N 3.42Å; A9-R12 PolarHBondContact O-N 3.11Å; A9-R12 VanDerWaalsContact O-N 3.12Å; E10-R12 VanDerWaalsContact C-N 3.32Å; E10-R12 PolarHBondContact O-N 3.15Å; R12-W14 VanDerWaalsContact C-N 3.32Å; R12-R16 WeakPolarHBondContact O-CB 3.47Å; R12-R16 VanDerWaalsContact O-CG 3.24Å; R12-R16 WeakPolarHBondContact O-CG 3.01Å; R12-R16 PolarHBondContact O-N 3.4Å
13	L	43.1	Very low	41.4	Very low	129 Å²	129	113.3 Å²	113.3	68%	0.675	55%	0.549	S	S	*	.	H	α-helix	trans	-64.7	-40.4	168.7	-119.3	121.4	0	0	0	110.8	A9 E10 T17	A9-L13 PolarHBondContact O-N 3.12Å; E10-L13 PolarHBondContact O-N 3.37Å; L13-T17 PolarHBondContact O-N 2.87Å; L13-T17 VanDerWaalsContact O-N 3.14Å; L13-T17 PolarHBondContact O-OG1 2.97Å
14	W	41	Very low	42.2	Very low	107 Å²	107	112.8 Å²	112.8	41%	0.405	55%	0.55	S	S	.	.	H	α-helix	trans	-71.6	-37.3	176.6	-162.1	77.7	0	0	0	113.2	E10 R11 R12 T17 R18 F43	E10-W14 WeakPolarHBondContact O-CB 3.43Å; E10-W14 PolarHBondContact O-N 3.38Å; R11-W14 CarbonylContact O-C 3.6Å; R11-W14 WeakPolarHBondContact O-CB 3.18Å; R11-W14 PolarHBondContact O-N 2.87Å; R12-W14 VanDerWaalsContact C-N 3.32Å; W14-T17 WeakPolarHBondContact CA-OG1 3.32Å; W14-T17 PolarHBondContact O-N 3.19Å; W14-T17 PolarHBondContact O-OG1 2.98Å; W14-R18 VanDerWaalsContact O-CB 3.24Å; W14-R18 WeakPolarHBondContact O-CB 3.48Å; W14-R18 PolarHBondContact O-N 3.48Å; W14-F43 AromaticContact CD1-CE2 3.49Å; W14-F43 VanDerWaalsContact CD1-CE2 3.49Å; W14-F43 AromaticContact NE1-CE2 3.75Å; W14-F43 AromaticContact NE1-CZ 3.95Å
15	E	41.5	Very low	43.6	Very low	102 Å²	102	109.9 Å²	109.9	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-71.8	-32.8	175.6	-76.8	166.5	-173.2	0	0	111.5	R11 R18 R19	R11-E15 VanDerWaalsContact O-CB 3.26Å; R11-E15 WeakPolarHBondContact O-CB 3.34Å; R11-E15 WeakPolarHBondContact O-CG 3.45Å; R11-E15 PolarHBondContact O-N 2.93Å; E15-R18 PolarHBondContact O-N 3.47Å; E15-R19 PolarHBondContact O-N 3.15Å
16	R	44	Very low	45.2	Very low	206 Å²	206	110.6 Å²	110.6	78%	0.777	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-38.6	170.7	-79.3	175.9	175.1	-165.3	-3.1	112.2	R12 R18	R12-R16 WeakPolarHBondContact O-CB 3.47Å; R12-R16 VanDerWaalsContact O-CG 3.24Å; R12-R16 WeakPolarHBondContact O-CG 3.01Å; R12-R16 PolarHBondContact O-N 3.4Å; R16-R18 VanDerWaalsContact C-N 3.31Å; R16-R18 PolarHBondContact O-N 3.42Å
17	T	42.5	Very low	46.8	Very low	81 Å²	81	108.8 Å²	108.8	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-79.5	-8.3	175.9	45.4	0	0	0	0	114.2	L13 W14	L13-T17 PolarHBondContact O-N 2.87Å; L13-T17 VanDerWaalsContact O-N 3.14Å; L13-T17 PolarHBondContact O-OG1 2.97Å; W14-T17 WeakPolarHBondContact CA-OG1 3.32Å; W14-T17 PolarHBondContact O-N 3.19Å; W14-T17 PolarHBondContact O-OG1 2.98Å
18	R	36.7	Very low	48.8	Very low	169 Å²	169	108.4 Å²	108.4	64%	0.638	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	6.4	-178.8	-152.2	174.3	-172.3	-145.8	1.4	114.7	W14 E15 R16 S20	W14-R18 VanDerWaalsContact O-CB 3.24Å; W14-R18 WeakPolarHBondContact O-CB 3.48Å; W14-R18 PolarHBondContact O-N 3.48Å; E15-R18 PolarHBondContact O-N 3.47Å; R16-R18 VanDerWaalsContact C-N 3.31Å; R16-R18 PolarHBondContact O-N 3.42Å; R18-S20 PolarHBondContact O-N 3.04Å; R18-S20 VanDerWaalsContact O-N 3.11Å
19	R	36.5	Very low	50.8	Low	212 Å²	212	109.3 Å²	109.3	80%	0.8	53%	0.532	S	S	*	.			trans	-82.3	83.7	171.4	-80.5	-171.8	176.6	-166.3	-1.8	111.2	E15	E15-R19 PolarHBondContact O-N 3.15Å
20	S	33.1	Very low	52.6	Low	77 Å²	77	111 Å²	111	54%	0.538	54%	0.538	S	S	.	.			trans	-92.5	125.6	170.6	48.1	0	0	0	0	112.7	R18	R18-S20 PolarHBondContact O-N 3.04Å; R18-S20 VanDerWaalsContact O-N 3.11Å
21	V	35.7	Very low	54.7	Low	147 Å²	147	104.7 Å²	104.7	89%	0.891	51%	0.508	S	S	*	.				-99.1	119.2	115.4	176.1	0	0	0	0	104.2	I23	V21-I23 PolarHBondContact O-N 3.38Å
22	L	39.8	Very low	56.9	Low	131 Å²	131	98.9 Å²	98.9	69%	0.686	50%	0.496	S	S	*	.			trans	-72.7	96.8	-164.3	-72.2	96.6	0	0	0	111.6	T24	L22-T24 HydrophobicContact CB-CG2 4.41Å; L22-T24 HydrophobicContact CD2-CG2 3.94Å
23	I	50.7	Low	58.8	Low	59 Å²	59	95 Å²	95	30%	0.303	49%	0.487	S	S	.	.			trans	-94.3	81.4	146	-53.8	-179.7	0	0	0	106.2	V21 N67 L107 F109	V21-I23 PolarHBondContact O-N 3.38Å; I23-N67 PolarHBondContact O-ND2 2.93Å; I23-L107 HydrophobicContact CG2-CB 4.07Å; I23-L107 HydrophobicContact CG2-CD1 4.01Å; I23-L107 HydrophobicContact CG2-CG 4.49Å; I23-F109 HydrophobicContact CD1-CB 3.73Å; I23-F109 HydrophobicContact CD1-CD2 3.61Å; I23-F109 HydrophobicContact CD1-CG 3.98Å
24	T	55.5	Low	60.9	Low	88 Å²	88	89 Å²	89	54%	0.54	46%	0.456	S	S	.	.			trans	-56.5	141.2	163.9	46.7	0	0	0	0	108.4	L22 Q26	L22-T24 HydrophobicContact CB-CG2 4.41Å; L22-T24 HydrophobicContact CD2-CG2 3.94Å; T24-Q26 PolarHBondContact O-N 2.89Å
25	S	68.3	Low	63.1	Low	19 Å²	19	84.2 Å²	84.2	13%	0.133	44%	0.439	C	S	.	.			trans	-54.2	130.4	168.7	37.6	0	0	0	0	108.9	L27 K65 N67 D70	S25-L27 VanDerWaalsContact C-N 3.26Å; S25-L27 PolarHBondContact O-N 3.47Å; S25-L27 WeakPolarHBondContact OG-CD1 3.48Å; S25-K65 CarbonylContact C-O 2.88Å; S25-K65 WeakPolarHBondContact CA-O 3.24Å; S25-K65 VanDerWaalsContact CB-O 3.31Å; S25-K65 WeakPolarHBondContact CB-O 3.23Å; S25-N67 PolarHBondContact N-ND2 3.38Å; S25-N67 VanDerWaalsContact N-ND2 3.17Å; S25-D70 VanDerWaalsContact CB-OD2 3.23Å; S25-D70 WeakPolarHBondContact CB-OD2 3.31Å; S25-D70 PolarHBondContact OG-OD2 3.41Å
26	Q	77	Confident	65.1	Low	111 Å²	111	81.3 Å²	81.3	52%	0.519	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-81.9	83.2	178.8	-63.9	-175	-33.3	0	0	106.5	T24 D64 K65 L107	T24-Q26 PolarHBondContact O-N 2.89Å; Q26-D64 CarbonylContact O-C 3.58Å; Q26-D64 VanDerWaalsContact O-CA 3.27Å; Q26-D64 WeakPolarHBondContact O-CA 3.35Å; Q26-K65 HydrophobicContact CB-CB 4.22Å; Q26-K65 PolarHBondContact N-O 2.87Å; Q26-K65 PolarHBondContact O-N 3.22Å; Q26-L107 HydrophobicContact CG-CD1 4.11Å
27	L	79	Confident	67	Low	25 Å²	25	77.9 Å²	77.9	13%	0.131	42%	0.423	C	S	.	.			trans	-111.8	141.9	-177.1	-61.4	175.6	0	0	0	109.9	S25 A31 A32 L35 F56 L60 D64 I66	S25-L27 VanDerWaalsContact C-N 3.26Å; S25-L27 PolarHBondContact O-N 3.47Å; S25-L27 WeakPolarHBondContact OG-CD1 3.48Å; L27-A31 HydrophobicContact CB-CB 4.04Å; L27-A31 HydrophobicContact CD1-CB 4.44Å; L27-A31 HydrophobicContact CD2-CB 4.3Å; L27-A31 HydrophobicContact CG-CB 4.48Å; L27-A32 HydrophobicContact CB-CB 3.99Å; L27-L35 HydrophobicContact CD1-CB 4.29Å; L27-L35 HydrophobicContact CD1-CD2 3.46Å; L27-L35 VanDerWaalsContact CD1-CD2 3.46Å; L27-F56 HydrophobicContact CD1-CE2 3.88Å; L27-F56 HydrophobicContact CD2-CE2 4.44Å; L27-L60 HydrophobicContact CD2-CD2 3.86Å; L27-D64 VanDerWaalsContact CA-OD1 3.25Å; L27-D64 WeakPolarHBondContact CA-OD1 3.3Å; L27-D64 HydrophobicContact CD2-CB 4.04Å; L27-I66 HydrophobicContact CD2-CG1 4.15Å
28	N	85.4	Confident	68.9	Low	40 Å²	40	74 Å²	74	21%	0.214	40%	0.399	C	S	.	.			trans	-56.1	158.1	164.7	71.7	67.6	0	0	0	110.7	T30 A31 A32 S59 D64	N28-T30 PolarHBondContact O-N 3.26Å; N28-T30 VanDerWaalsContact O-N 3.11Å; N28-T30 PolarHBondContact OD1-N 3.03Å; N28-T30 VanDerWaalsContact OD1-N 3.1Å; N28-T30 PolarHBondContact OD1-OG1 2.68Å; N28-A31 PolarHBondContact O-N 2.99Å; N28-A31 VanDerWaalsContact O-N 3.13Å; N28-A31 PolarHBondContact OD1-N 2.76Å; N28-A32 WeakPolarHBondContact O-CB 3.47Å; N28-A32 PolarHBondContact O-N 3.46Å; N28-S59 PolarHBondContact ND2-O 2.98Å; N28-D64 PolarHBondContact N-OD1 3.33Å; N28-D64 PolarHBondContact ND2-OD1 3.19Å; N28-D64 PolarHBondContact ND2-OD2 3.47Å
29	A	83.4	Confident	71.1	Confident	85 Å²	85	70 Å²	70	70%	0.702	38%	0.384	S	S	*	.	H	α-helix	trans	-55.9	-35.4	-172.1	0	0	0	0	0	113.7	D33	A29-D33 VanDerWaalsContact O-CB 3.27Å; A29-D33 WeakPolarHBondContact O-CB 3.12Å; A29-D33 PolarHBondContact O-N 3.14Å
30	T	85.2	Confident	73.1	Confident	85 Å²	85	61.7 Å²	61.7	52%	0.521	36%	0.358	S	S	.	.	H	α-helix	trans	-71.8	-43.5	178.4	30.1	0	0	0	0	113.1	N28 A34	N28-T30 PolarHBondContact O-N 3.26Å; N28-T30 VanDerWaalsContact O-N 3.11Å; N28-T30 PolarHBondContact OD1-N 3.03Å; N28-T30 VanDerWaalsContact OD1-N 3.1Å; N28-T30 PolarHBondContact OD1-OG1 2.68Å; T30-A34 VanDerWaalsContact O-CB 3.31Å; T30-A34 WeakPolarHBondContact O-CB 3.39Å; T30-A34 PolarHBondContact O-N 2.71Å
31	A	86.5	Confident	75.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-39.2	175.8	0	0	0	0	0	111.6	L27 N28 A34 L35 F56 S59 L60	L27-A31 HydrophobicContact CB-CB 4.04Å; L27-A31 HydrophobicContact CD1-CB 4.44Å; L27-A31 HydrophobicContact CD2-CB 4.3Å; L27-A31 HydrophobicContact CG-CB 4.48Å; N28-A31 PolarHBondContact O-N 2.99Å; N28-A31 VanDerWaalsContact O-N 3.13Å; N28-A31 PolarHBondContact OD1-N 2.76Å; A31-A34 PolarHBondContact O-N 3.39Å; A31-L35 VanDerWaalsContact O-CB 3.29Å; A31-L35 WeakPolarHBondContact O-CB 3.47Å; A31-L35 PolarHBondContact O-N 3Å; A31-F56 HydrophobicContact CB-CD2 4.2Å; A31-F56 HydrophobicContact CB-CE2 4.3Å; A31-F56 WeakPolarHBondContact O-CD2 3.39Å; A31-S59 WeakPolarHBondContact CA-OG 3.38Å; A31-S59 PolarHBondContact N-OG 3.42Å; A31-L60 HydrophobicContact CB-CD2 4.34Å
32	A	85.7	Confident	77.3	Confident	44 Å²	44	55 Å²	55	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-62.2	-45.7	175.6	0	0	0	0	0	112.5	L27 N28 G36	L27-A32 HydrophobicContact CB-CB 3.99Å; N28-A32 WeakPolarHBondContact O-CB 3.47Å; N28-A32 PolarHBondContact O-N 3.46Å; A32-G36 PolarHBondContact O-N 3.47Å
33	D	84.5	Confident	78.9	Confident	78 Å²	78	55.8 Å²	55.8	42%	0.417	31%	0.311	S	S	.	.	H	α-helix	trans	-66.3	-44.4	176.2	-178.6	24.3	0	0	0	111.2	A29 L35 G36 R37	A29-D33 VanDerWaalsContact O-CB 3.27Å; A29-D33 WeakPolarHBondContact O-CB 3.12Å; A29-D33 PolarHBondContact O-N 3.14Å; D33-L35 PolarHBondContact O-N 2.92Å; D33-G36 PolarHBondContact O-N 3.5Å; D33-R37 VanDerWaalsContact CG-NE 3.26Å; D33-R37 WeakPolarHBondContact O-CB 3.34Å; D33-R37 VanDerWaalsContact O-CG 3.23Å; D33-R37 WeakPolarHBondContact O-CG 3.43Å; D33-R37 PolarHBondContact O-N 3.27Å; D33-R37 IonicContact OD1-CZ 3.24Å; D33-R37 IonicContact OD1-NE 2.99Å; D33-R37 PolarHBondContact OD1-NE 3.3Å; D33-R37 IonicContact OD1-NH2 2.69Å; D33-R37 IonicContact OD2-CZ 2.69Å; D33-R37 VanDerWaalsContact OD2-CZ 3.24Å; D33-R37 IonicContact OD2-NE 3.37Å; D33-R37 PolarHBondContact OD2-NE 3.06Å; D33-R37 VanDerWaalsContact OD2-NE 3.17Å; D33-R37 IonicContact OD2-NH2 3.77Å; D33-R37 PolarHBondContact OD2-NH2 3.36Å
34	A	87.2	Confident	79.8	Confident	3 Å²	3	61.3 Å²	61.3	3%	0.025	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-45.4	175.4	0	0	0	0	0	112.4	T30 A31 R37 M38 T52 I55 F56	T30-A34 VanDerWaalsContact O-CB 3.31Å; T30-A34 WeakPolarHBondContact O-CB 3.39Å; T30-A34 PolarHBondContact O-N 2.71Å; A31-A34 PolarHBondContact O-N 3.39Å; A34-R37 PolarHBondContact O-N 2.85Å; A34-M38 WeakPolarHBondContact O-CG 3.39Å; A34-M38 PolarHBondContact O-N 3.05Å; A34-T52 HydrophobicContact CB-CG2 4.26Å; A34-T52 WeakPolarHBondContact O-CG2 3.26Å; A34-I55 HydrophobicContact CB-CG2 4.09Å; A34-F56 HydrophobicContact CB-CB 3.92Å
35	L	86.4	Confident	80.4	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-41.5	175.8	179.1	65	0	0	0	112.5	L27 A31 D33 M38 R39 F56 D70 F73	L27-L35 HydrophobicContact CD1-CB 4.29Å; L27-L35 HydrophobicContact CD1-CD2 3.46Å; L27-L35 VanDerWaalsContact CD1-CD2 3.46Å; A31-L35 VanDerWaalsContact O-CB 3.29Å; A31-L35 WeakPolarHBondContact O-CB 3.47Å; A31-L35 PolarHBondContact O-N 3Å; D33-L35 PolarHBondContact O-N 2.92Å; L35-M38 HydrophobicContact CB-CE 4.47Å; L35-M38 HydrophobicContact CD1-CE 4.2Å; L35-M38 PolarHBondContact O-N 3.16Å; L35-R39 WeakPolarHBondContact O-CB 3.32Å; L35-R39 WeakPolarHBondContact O-CG 3.35Å; L35-R39 PolarHBondContact O-N 3.21Å; L35-F56 HydrophobicContact CB-CD2 3.98Å; L35-F56 HydrophobicContact CB-CE2 3.94Å; L35-F56 HydrophobicContact CD1-CE2 4.5Å; L35-F56 HydrophobicContact CD2-CE2 4.4Å; L35-D70 HydrophobicContact CD2-CB 4.28Å; L35-D70 WeakPolarHBondContact CD2-OD1 3.45Å; L35-F73 HydrophobicContact CD1-CD1 3.96Å; L35-F73 HydrophobicContact CD1-CE1 4.06Å
36	G	83.3	Confident	80.5	Confident	40 Å²	40	60.5 Å²	60.5	41%	0.412	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-42.5	174.9	0	0	0	0	0	112.5	A32 D33 R39 S40	A32-G36 PolarHBondContact O-N 3.47Å; D33-G36 PolarHBondContact O-N 3.5Å; G36-R39 PolarHBondContact O-N 3.29Å; G36-S40 WeakPolarHBondContact O-CB 3.23Å; G36-S40 PolarHBondContact O-N 2.82Å
37	R	83.7	Confident	80.6	Confident	135 Å²	135	55.2 Å²	55.2	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-50	172.3	-69	169.7	-169.3	-149.6	8.4	111.3	D33 A34 R39 S40 D41 T52	D33-R37 VanDerWaalsContact CG-NE 3.26Å; D33-R37 WeakPolarHBondContact O-CB 3.34Å; D33-R37 VanDerWaalsContact O-CG 3.23Å; D33-R37 WeakPolarHBondContact O-CG 3.43Å; D33-R37 PolarHBondContact O-N 3.27Å; D33-R37 IonicContact OD1-CZ 3.24Å; D33-R37 IonicContact OD1-NE 2.99Å; D33-R37 PolarHBondContact OD1-NE 3.3Å; D33-R37 IonicContact OD1-NH2 2.69Å; D33-R37 IonicContact OD2-CZ 2.69Å; D33-R37 VanDerWaalsContact OD2-CZ 3.24Å; D33-R37 IonicContact OD2-NE 3.37Å; D33-R37 PolarHBondContact OD2-NE 3.06Å; D33-R37 VanDerWaalsContact OD2-NE 3.17Å; D33-R37 IonicContact OD2-NH2 3.77Å; D33-R37 PolarHBondContact OD2-NH2 3.36Å; A34-R37 PolarHBondContact O-N 2.85Å; R37-R39 PolarHBondContact O-N 2.84Å; R37-S40 CarbonylContact O-C 3.2Å; R37-S40 WeakPolarHBondContact O-CB 3.19Å; R37-S40 PolarHBondContact O-N 2.97Å; R37-S40 VanDerWaalsContact O-N 3.1Å; R37-D41 WeakPolarHBondContact O-CB 3.49Å; R37-D41 VanDerWaalsContact O-CG 3.26Å; R37-D41 PolarHBondContact O-N 3.48Å; R37-T52 HydrophobicContact CB-CG2 4.12Å
38	M	83.7	Confident	80.7	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-45.5	177	-70.4	-171.1	-67.6	0	0	112.3	A34 L35 S40 D41 V42 I48 T52 L53 F56 F73 L74	A34-M38 WeakPolarHBondContact O-CG 3.39Å; A34-M38 PolarHBondContact O-N 3.05Å; L35-M38 HydrophobicContact CB-CE 4.47Å; L35-M38 HydrophobicContact CD1-CE 4.2Å; L35-M38 PolarHBondContact O-N 3.16Å; M38-S40 VanDerWaalsContact C-N 3.34Å; M38-S40 PolarHBondContact O-N 2.76Å; M38-D41 PolarHBondContact O-N 3.24Å; M38-V42 WeakPolarHBondContact O-CG2 3.24Å; M38-V42 PolarHBondContact O-N 3.21Å; M38-I48 HydrophobicContact CG-CG2 4.05Å; M38-I48 HydrophobicContact SD-CG2 3.86Å; M38-T52 HydrophobicContact CG-CG2 3.62Å; M38-T52 HydrophobicContact SD-CG2 4.49Å; M38-L53 HydrophobicContact CE-CD1 4.37Å; M38-L53 HydrophobicContact SD-CB 4.04Å; M38-L53 HydrophobicContact SD-CD1 3.92Å; M38-F56 HydrophobicContact CE-CB 3.67Å; M38-F56 HydrophobicContact CE-CD1 4.23Å; M38-F56 HydrophobicContact CE-CD2 4.03Å; M38-F56 HydrophobicContact CE-CG 3.7Å; M38-F73 HydrophobicContact CB-CE1 4Å; M38-F73 HydrophobicContact CB-CZ 4.23Å; M38-L74 HydrophobicContact CE-CD2 3.88Å
39	R	82.2	Confident	80.5	Confident	83 Å²	83	55 Å²	55	31%	0.313	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-41.1	175.6	-77	171	161.8	-102	6.8	111.9	L35 G36 R37 F43 D70 F73	L35-R39 WeakPolarHBondContact O-CB 3.32Å; L35-R39 WeakPolarHBondContact O-CG 3.35Å; L35-R39 PolarHBondContact O-N 3.21Å; G36-R39 PolarHBondContact O-N 3.29Å; R37-R39 PolarHBondContact O-N 2.84Å; R39-F43 VanDerWaalsContact O-CB 3.26Å; R39-F43 WeakPolarHBondContact O-CB 3.45Å; R39-F43 PolarHBondContact O-N 3.16Å; R39-F43 VanDerWaalsContact O-N 3.08Å; R39-D70 IonicContact CZ-OD1 2.97Å; R39-D70 IonicContact NE-OD1 3.81Å; R39-D70 PolarHBondContact NE-OD1 2.66Å; R39-D70 IonicContact NH2-OD1 2.64Å; R39-D70 PolarHBondContact NH2-OD1 3.25Å; R39-F73 HydrophobicContact CB-CZ 4.32Å; R39-F73 HydrophobicContact CG-CD1 4.25Å; R39-F73 HydrophobicContact CG-CE1 3.77Å; R39-F73 HydrophobicContact CG-CE2 4.15Å; R39-F73 HydrophobicContact CG-CZ 3.73Å
40	S	77.8	Confident	80.4	Confident	38 Å²	38	51.2 Å²	51.2	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-43.4	174.8	173.1	0	0	0	0	112.6	G36 R37 M38 F43 R44	G36-S40 WeakPolarHBondContact O-CB 3.23Å; G36-S40 PolarHBondContact O-N 2.82Å; R37-S40 CarbonylContact O-C 3.2Å; R37-S40 WeakPolarHBondContact O-CB 3.19Å; R37-S40 PolarHBondContact O-N 2.97Å; R37-S40 VanDerWaalsContact O-N 3.1Å; M38-S40 VanDerWaalsContact C-N 3.34Å; M38-S40 PolarHBondContact O-N 2.76Å; S40-F43 PolarHBondContact O-N 2.72Å; S40-R44 WeakPolarHBondContact O-CB 3.33Å; S40-R44 VanDerWaalsContact O-CG 3.32Å; S40-R44 WeakPolarHBondContact O-CG 3.36Å; S40-R44 PolarHBondContact O-N 3.28Å; S40-R44 PolarHBondContact OG-NE 3.08Å
41	D	78.9	Confident	80.3	Confident	36 Å²	36	51.6 Å²	51.6	19%	0.193	26%	0.261	C	S	.	.	H	α-helix	trans	-70.7	-39.5	-177.5	-66.9	-20.8	0	0	0	111.6	R37 M38 M45 G46 V47	R37-D41 WeakPolarHBondContact O-CB 3.49Å; R37-D41 VanDerWaalsContact O-CG 3.26Å; R37-D41 PolarHBondContact O-N 3.48Å; M38-D41 PolarHBondContact O-N 3.24Å; D41-M45 CarbonylContact O-C 3.25Å; D41-M45 VanDerWaalsContact O-CA 3.31Å; D41-M45 WeakPolarHBondContact O-CA 3.47Å; D41-M45 WeakPolarHBondContact O-CB 3.32Å; D41-M45 PolarHBondContact O-N 3.05Å; D41-G46 PolarHBondContact O-N 3.29Å; D41-V47 CarbonylContact C-O 3.6Å; D41-V47 WeakPolarHBondContact CB-O 3.48Å; D41-V47 PolarHBondContact O-N 3.3Å
42	V	78.9	Confident	80.3	Confident	48 Å²	48	52.6 Å²	52.6	29%	0.291	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-46.8	170.7	173.9	0	0	0	0	110.5	M38 R44 G46 V47 I48 F73	M38-V42 WeakPolarHBondContact O-CG2 3.24Å; M38-V42 PolarHBondContact O-N 3.21Å; V42-R44 PolarHBondContact O-N 3.2Å; V42-G46 VanDerWaalsContact O-CA 3.25Å; V42-G46 WeakPolarHBondContact O-CA 3.36Å; V42-G46 PolarHBondContact O-N 2.91Å; V42-V47 PolarHBondContact N-O 3.38Å; V42-I48 HydrophobicContact CG2-CD1 3.62Å; V42-I48 HydrophobicContact CG2-CG1 3.38Å; V42-F73 HydrophobicContact CB-CE2 4.15Å; V42-F73 HydrophobicContact CB-CZ 4.31Å; V42-F73 HydrophobicContact CG1-CE2 4.26Å; V42-F73 HydrophobicContact CG2-CE2 3.98Å; V42-F73 HydrophobicContact CG2-CZ 3.86Å
43	F	73.4	Confident	80.3	Confident	147 Å²	147	50.5 Å²	50.5	65%	0.645	25%	0.25	S	C	*	.	H	α-helix	trans	-66.4	-38.2	-178	-179.6	-102.3	0	0	0	113.6	W14 R39 S40	W14-F43 AromaticContact CD1-CE2 3.49Å; W14-F43 VanDerWaalsContact CD1-CE2 3.49Å; W14-F43 AromaticContact NE1-CE2 3.75Å; W14-F43 AromaticContact NE1-CZ 3.95Å; R39-F43 VanDerWaalsContact O-CB 3.26Å; R39-F43 WeakPolarHBondContact O-CB 3.45Å; R39-F43 PolarHBondContact O-N 3.16Å; R39-F43 VanDerWaalsContact O-N 3.08Å; S40-F43 PolarHBondContact O-N 2.72Å
44	R	69.7	Low	80.4	Confident	175 Å²	175	50.2 Å²	50.2	66%	0.66	25%	0.249	S	C	*	.	H	α-helix	trans	-88.2	-36.2	-177.7	-67.5	177.4	-178.3	-166.8	1.3	113.6	S40 V42	S40-R44 WeakPolarHBondContact O-CB 3.33Å; S40-R44 VanDerWaalsContact O-CG 3.32Å; S40-R44 WeakPolarHBondContact O-CG 3.36Å; S40-R44 PolarHBondContact O-N 3.28Å; S40-R44 PolarHBondContact OG-NE 3.08Å; V42-R44 PolarHBondContact O-N 3.2Å
45	M	67.9	Low	80.3	Confident	53 Å²	53	54.7 Å²	54.7	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-121.5	-17.6	-165.9	-43.5	-69.9	-77.3	0	0	112.9	D41 V47 H326 N330	D41-M45 CarbonylContact O-C 3.25Å; D41-M45 VanDerWaalsContact O-CA 3.31Å; D41-M45 WeakPolarHBondContact O-CA 3.47Å; D41-M45 WeakPolarHBondContact O-CB 3.32Å; D41-M45 PolarHBondContact O-N 3.05Å; M45-V47 VanDerWaalsContact C-N 3.32Å; M45-V47 HydrophobicContact CB-CB 4.35Å; M45-V47 HydrophobicContact CB-CG2 4.15Å; M45-V47 WeakPolarHBondContact O-CG2 3.36Å; M45-H326 VanDerWaalsContact CE-CE1 3.5Å; M45-H326 WeakPolarHBondContact CE-CE1 3.31Å; M45-H326 VanDerWaalsContact CE-ND1 3.3Å; M45-H326 WeakPolarHBondContact CE-ND1 3.18Å; M45-H326 WeakPolarHBondContact O-CB 3.3Å; M45-H326 PolarHBondContact SD-CE1 3.28Å; M45-H326 PolarHBondContact SD-ND1 3.48Å; M45-H326 VanDerWaalsContact SD-ND1 3.38Å; M45-N330 PolarHBondContact O-ND2 2.98Å
46	G	70.5	Confident	80.5	Confident	37 Å²	37	54.4 Å²	54.4	38%	0.381	27%	0.27	S	S	.	.	S	Bend	trans	67.6	29.3	-168.7	0	0	0	0	0	113.3	D41 V42 N330	D41-G46 PolarHBondContact O-N 3.29Å; V42-G46 VanDerWaalsContact O-CA 3.25Å; V42-G46 WeakPolarHBondContact O-CA 3.36Å; V42-G46 PolarHBondContact O-N 2.91Å; G46-N330 PolarHBondContact O-ND2 3.4Å
47	V	78.2	Confident	80.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.			trans	-139.1	152.9	-174	-168.3	0	0	0	0	113.1	D41 V42 M45 A81 P83 N330	D41-V47 CarbonylContact C-O 3.6Å; D41-V47 WeakPolarHBondContact CB-O 3.48Å; D41-V47 PolarHBondContact O-N 3.3Å; V42-V47 PolarHBondContact N-O 3.38Å; M45-V47 VanDerWaalsContact C-N 3.32Å; M45-V47 HydrophobicContact CB-CB 4.35Å; M45-V47 HydrophobicContact CB-CG2 4.15Å; M45-V47 WeakPolarHBondContact O-CG2 3.36Å; V47-A81 CarbonylContact C-O 3.59Å; V47-A81 WeakPolarHBondContact CA-O 3.47Å; V47-P83 HydrophobicContact CG1-CG 3.62Å; V47-P83 HydrophobicContact CG2-CG 4.39Å; V47-N330 HydrophobicContact CG2-CB 4.37Å; V47-N330 WeakPolarHBondContact CG2-ND2 3.45Å; V47-N330 WeakPolarHBondContact CG2-OD1 3.44Å
48	I	81.5	Confident	80.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.266	C	S	.	.			trans	-122.9	143.4	164.8	-62.8	165.5	0	0	0	108.5	M38 V42 L53 C77 A81 L82	M38-I48 HydrophobicContact CG-CG2 4.05Å; M38-I48 HydrophobicContact SD-CG2 3.86Å; V42-I48 HydrophobicContact CG2-CD1 3.62Å; V42-I48 HydrophobicContact CG2-CG1 3.38Å; I48-L53 HydrophobicContact CG2-CB 4.16Å; I48-C77 HydrophobicContact CD1-CB 3.17Å; I48-C77 WeakPolarHBondContact CD1-SG 3.46Å; I48-A81 HydrophobicContact CD1-CB 4.11Å; I48-A81 HydrophobicContact CG1-CB 4.46Å; I48-A81 PolarHBondContact N-O 2.73Å; I48-L82 HydrophobicContact CB-CD2 3.93Å; I48-L82 HydrophobicContact CG2-CD2 3.79Å
49	Y	81.1	Confident	80.8	Confident	60 Å²	60	51.8 Å²	51.8	24%	0.235	27%	0.274	C	S	.	.			trans	-90.7	129.3	173	-64.3	-89.7	0	0	0	108.7	E51 T52 L53 R367	Y49-E51 PolarHBondContact O-N 3.35Å; Y49-E51 VanDerWaalsContact O-N 3.13Å; Y49-T52 PolarHBondContact O-N 2.88Å; Y49-L53 PolarHBondContact O-N 3.44Å; Y49-L53 VanDerWaalsContact O-N 3.08Å; Y49-R367 VanDerWaalsContact CD1-NH2 3.34Å; Y49-R367 PolarHBondContact OH-NH1 2.69Å
50	P	81.9	Confident	80.8	Confident	6 Å²	6	49 Å²	49	4%	0.039	27%	0.266	C	S	.	.	H	α-helix	trans	-53.9	-32.4	176	-25.5	34.1	0	0	0	112.3	N54 L82 E84	P50-N54 WeakPolarHBondContact O-CB 3.42Å; P50-N54 PolarHBondContact O-N 3.25Å; P50-N54 PolarHBondContact O-ND2 2.98Å; P50-L82 HydrophobicContact CG-CD2 4.24Å; P50-E84 HydrophobicContact CG-CB 4.16Å
51	E	83.4	Confident	80.8	Confident	93 Å²	93	49.4 Å²	49.4	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-46.9	175.8	-61.9	71	-155.6	0	0	111.4	Y49 L53 N54 I55 K374	Y49-E51 PolarHBondContact O-N 3.35Å; Y49-E51 VanDerWaalsContact O-N 3.13Å; E51-L53 PolarHBondContact O-N 3.32Å; E51-N54 PolarHBondContact O-N 3.08Å; E51-I55 WeakPolarHBondContact O-CB 3.49Å; E51-I55 VanDerWaalsContact O-CG1 3.22Å; E51-I55 WeakPolarHBondContact O-CG1 3.22Å; E51-I55 PolarHBondContact O-N 3.42Å; E51-K374 IonicContact OE1-NZ 2.91Å
52	T	85.9	Confident	80.6	Confident	21 Å²	21	52.9 Å²	52.9	13%	0.129	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-38.5	177.7	-47.3	0	0	0	0	111.7	A34 R37 M38 Y49 I55 F56	A34-T52 HydrophobicContact CB-CG2 4.26Å; A34-T52 WeakPolarHBondContact O-CG2 3.26Å; R37-T52 HydrophobicContact CB-CG2 4.12Å; M38-T52 HydrophobicContact CG-CG2 3.62Å; M38-T52 HydrophobicContact SD-CG2 4.49Å; Y49-T52 PolarHBondContact O-N 2.88Å; T52-I55 PolarHBondContact O-N 3.04Å; T52-F56 PolarHBondContact O-N 2.78Å
53	L	86.1	Confident	80.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-40.6	174.7	-177.9	61.5	0	0	0	111.8	M38 I48 Y49 E51 F56 L57 L74 L82 L93	M38-L53 HydrophobicContact CE-CD1 4.37Å; M38-L53 HydrophobicContact SD-CB 4.04Å; M38-L53 HydrophobicContact SD-CD1 3.92Å; I48-L53 HydrophobicContact CG2-CB 4.16Å; Y49-L53 PolarHBondContact O-N 3.44Å; Y49-L53 VanDerWaalsContact O-N 3.08Å; E51-L53 PolarHBondContact O-N 3.32Å; L53-F56 WeakPolarHBondContact O-CB 3.43Å; L53-F56 PolarHBondContact O-N 3.18Å; L53-L57 HydrophobicContact CD1-CD1 4.39Å; L53-L57 HydrophobicContact CD1-CG 4.34Å; L53-L57 HydrophobicContact CG-CD1 4.17Å; L53-L57 WeakPolarHBondContact O-CB 3.17Å; L53-L57 VanDerWaalsContact O-CG 3.3Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 2.98Å; L53-L74 HydrophobicContact CD1-CD2 4.05Å; L53-L82 HydrophobicContact CD2-CD1 4.01Å; L53-L82 HydrophobicContact CD2-CD2 4.41Å; L53-L93 HydrophobicContact CD2-CB 4.5Å; L53-L93 HydrophobicContact CD2-CD1 4.35Å; L53-L93 HydrophobicContact CD2-CD2 4.38Å
54	N	85.7	Confident	80.8	Confident	73 Å²	73	50 Å²	50	39%	0.39	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-32.9	174.9	-75.9	-60.9	0	0	0	112.5	P50 E51 G58	P50-N54 WeakPolarHBondContact O-CB 3.42Å; P50-N54 PolarHBondContact O-N 3.25Å; P50-N54 PolarHBondContact O-ND2 2.98Å; E51-N54 PolarHBondContact O-N 3.08Å; N54-G58 WeakPolarHBondContact O-CA 3.31Å; N54-G58 PolarHBondContact O-N 3.36Å
55	I	87	Confident	81.1	Confident	97 Å²	97	46 Å²	46	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-44.1	171.2	-70.7	162.3	0	0	0	109.8	A34 E51 T52 S59	A34-I55 HydrophobicContact CB-CG2 4.09Å; E51-I55 WeakPolarHBondContact O-CB 3.49Å; E51-I55 VanDerWaalsContact O-CG1 3.22Å; E51-I55 WeakPolarHBondContact O-CG1 3.22Å; E51-I55 PolarHBondContact O-N 3.42Å; T52-I55 PolarHBondContact O-N 3.04Å; I55-S59 WeakPolarHBondContact O-CB 3.19Å; I55-S59 PolarHBondContact O-N 3.37Å; I55-S59 PolarHBondContact O-OG 3.36Å
56	F	89.3	Confident	81.6	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-57.5	-59.6	172.7	176.9	-96.1	0	0	0	110.7	L27 A31 A34 L35 M38 T52 L53 G58 S59 L60 I66 L74	L27-F56 HydrophobicContact CD1-CE2 3.88Å; L27-F56 HydrophobicContact CD2-CE2 4.44Å; A31-F56 HydrophobicContact CB-CD2 4.2Å; A31-F56 HydrophobicContact CB-CE2 4.3Å; A31-F56 WeakPolarHBondContact O-CD2 3.39Å; A34-F56 HydrophobicContact CB-CB 3.92Å; L35-F56 HydrophobicContact CB-CD2 3.98Å; L35-F56 HydrophobicContact CB-CE2 3.94Å; L35-F56 HydrophobicContact CD1-CE2 4.5Å; L35-F56 HydrophobicContact CD2-CE2 4.4Å; M38-F56 HydrophobicContact CE-CB 3.67Å; M38-F56 HydrophobicContact CE-CD1 4.23Å; M38-F56 HydrophobicContact CE-CD2 4.03Å; M38-F56 HydrophobicContact CE-CG 3.7Å; T52-F56 PolarHBondContact O-N 2.78Å; L53-F56 WeakPolarHBondContact O-CB 3.43Å; L53-F56 PolarHBondContact O-N 3.18Å; F56-G58 VanDerWaalsContact C-N 3.27Å; F56-G58 PolarHBondContact O-N 2.89Å; F56-S59 PolarHBondContact O-N 3.42Å; F56-S59 VanDerWaalsContact O-N 3.17Å; F56-S59 PolarHBondContact O-OG 3.26Å; F56-L60 HydrophobicContact CD1-CD1 4.4Å; F56-L60 HydrophobicContact CE1-CD1 3.89Å; F56-L60 HydrophobicContact CE1-CG 4.38Å; F56-L60 HydrophobicContact CE2-CD2 4.44Å; F56-L60 HydrophobicContact CZ-CD1 4.28Å; F56-L60 HydrophobicContact CZ-CD2 4.1Å; F56-L60 HydrophobicContact CZ-CG 4.45Å; F56-L60 WeakPolarHBondContact O-CG 3.24Å; F56-L60 PolarHBondContact O-N 2.91Å; F56-I66 HydrophobicContact CE1-CD1 4.19Å; F56-I66 HydrophobicContact CZ-CD1 3.89Å; F56-I66 HydrophobicContact CZ-CG1 4.24Å; F56-L74 HydrophobicContact CD1-CD1 4.44Å; F56-L74 HydrophobicContact CD1-CD2 3.84Å; F56-L74 HydrophobicContact CE1-CD1 3.45Å; F56-L74 VanDerWaalsContact CE1-CD1 3.45Å; F56-L74 HydrophobicContact CE1-CD2 3.66Å; F56-L74 HydrophobicContact CE1-CG 4.21Å; F56-L74 HydrophobicContact CZ-CD1 3.62Å; F56-L74 HydrophobicContact CZ-CD2 4.23Å
57	L	86.1	Confident	81.9	Confident	25 Å²	25	42.4 Å²	42.4	13%	0.131	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-31.8	-177.4	-67.2	176.3	0	0	0	114.1	L53 L60 V97 I100	L53-L57 HydrophobicContact CD1-CD1 4.39Å; L53-L57 HydrophobicContact CD1-CG 4.34Å; L53-L57 HydrophobicContact CG-CD1 4.17Å; L53-L57 WeakPolarHBondContact O-CB 3.17Å; L53-L57 VanDerWaalsContact O-CG 3.3Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 2.98Å; L57-L60 HydrophobicContact CD2-CD1 4.42Å; L57-V97 HydrophobicContact CD1-CG2 4.24Å; L57-V97 HydrophobicContact CD2-CG2 4.15Å; L57-I100 HydrophobicContact CD2-CD1 3.98Å
58	G	85	Confident	81.6	Confident	69 Å²	69	44.8 Å²	44.8	71%	0.711	26%	0.26	S	S	*	.	H	α-helix	trans	-91	-10.9	179.7	0	0	0	0	0	115	N54 F56	N54-G58 WeakPolarHBondContact O-CA 3.31Å; N54-G58 PolarHBondContact O-N 3.36Å; F56-G58 VanDerWaalsContact C-N 3.27Å; F56-G58 PolarHBondContact O-N 2.89Å
59	S	85.6	Confident	81.3	Confident	26 Å²	26	49.1 Å²	49.1	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-96.7	-12.8	171.9	58.2	0	0	0	0	113.1	N28 A31 I55 F56 S61	N28-S59 PolarHBondContact ND2-O 2.98Å; A31-S59 WeakPolarHBondContact CA-OG 3.38Å; A31-S59 PolarHBondContact N-OG 3.42Å; I55-S59 WeakPolarHBondContact O-CB 3.19Å; I55-S59 PolarHBondContact O-N 3.37Å; I55-S59 PolarHBondContact O-OG 3.36Å; F56-S59 PolarHBondContact O-N 3.42Å; F56-S59 VanDerWaalsContact O-N 3.17Å; F56-S59 PolarHBondContact O-OG 3.26Å; S59-S61 PolarHBondContact O-N 3Å
60	L	83.7	Confident	81.4	Confident	24 Å²	24	46.5 Å²	46.5	13%	0.126	27%	0.27	C	S	.	.			trans	-57.6	126.5	171.4	-73.5	172.8	0	0	0	111.1	L27 A31 F56 L57 D64 I66 I100	L27-L60 HydrophobicContact CD2-CD2 3.86Å; A31-L60 HydrophobicContact CB-CD2 4.34Å; F56-L60 HydrophobicContact CD1-CD1 4.4Å; F56-L60 HydrophobicContact CE1-CD1 3.89Å; F56-L60 HydrophobicContact CE1-CG 4.38Å; F56-L60 HydrophobicContact CE2-CD2 4.44Å; F56-L60 HydrophobicContact CZ-CD1 4.28Å; F56-L60 HydrophobicContact CZ-CD2 4.1Å; F56-L60 HydrophobicContact CZ-CG 4.45Å; F56-L60 WeakPolarHBondContact O-CG 3.24Å; F56-L60 PolarHBondContact O-N 2.91Å; L57-L60 HydrophobicContact CD2-CD1 4.42Å; L60-D64 HydrophobicContact CD2-CB 3.9Å; L60-I66 HydrophobicContact CD1-CD1 4.13Å; L60-I66 HydrophobicContact CD2-CD1 4.26Å; L60-I66 HydrophobicContact CD2-CG1 4.47Å; L60-I100 HydrophobicContact CD1-CG2 3.72Å
61	S	77.8	Confident	81.3	Confident	47 Å²	47	46.2 Å²	46.2	33%	0.329	27%	0.268	S	S	.	.			trans	-105.8	161.5	172	71.3	0	0	0	0	110	S59 D63 D64 H104	S59-S61 PolarHBondContact O-N 3Å; S61-D63 PolarHBondContact O-N 3.43Å; S61-D64 WeakPolarHBondContact CA-OD2 3.45Å; S61-D64 WeakPolarHBondContact CB-OD2 3.5Å; S61-D64 PolarHBondContact N-OD2 3.07Å; S61-D64 WeakPolarHBondContact O-CB 3.28Å; S61-D64 PolarHBondContact O-N 2.68Å; S61-D64 VanDerWaalsContact OG-CG 3.29Å; S61-D64 PolarHBondContact OG-OD2 3.45Å; S61-H104 PolarHBondContact O-CD2 3.19Å; S61-H104 PolarHBondContact O-NE2 3.07Å
62	S	74.6	Confident	81.3	Confident	108 Å²	108	45.8 Å²	45.8	76%	0.755	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.5	179.3	52.5	0	0	0	0	115.1
63	D	76.2	Confident	81.2	Confident	126 Å²	126	46.4 Å²	46.4	67%	0.674	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-13.3	-179.2	-61.5	-23	0	0	0	112.5	S61	S61-D63 PolarHBondContact O-N 3.43Å
64	D	80.6	Confident	81.2	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.048	27%	0.267	C	S	.	.			trans	-75.8	134.7	-175.8	-69.1	-56.3	0	0	0	112.2	Q26 L27 N28 L60 S61	Q26-D64 CarbonylContact O-C 3.58Å; Q26-D64 VanDerWaalsContact O-CA 3.27Å; Q26-D64 WeakPolarHBondContact O-CA 3.35Å; L27-D64 VanDerWaalsContact CA-OD1 3.25Å; L27-D64 WeakPolarHBondContact CA-OD1 3.3Å; L27-D64 HydrophobicContact CD2-CB 4.04Å; N28-D64 PolarHBondContact N-OD1 3.33Å; N28-D64 PolarHBondContact ND2-OD1 3.19Å; N28-D64 PolarHBondContact ND2-OD2 3.47Å; L60-D64 HydrophobicContact CD2-CB 3.9Å; S61-D64 WeakPolarHBondContact CA-OD2 3.45Å; S61-D64 WeakPolarHBondContact CB-OD2 3.5Å; S61-D64 PolarHBondContact N-OD2 3.07Å; S61-D64 WeakPolarHBondContact O-CB 3.28Å; S61-D64 PolarHBondContact O-N 2.68Å; S61-D64 VanDerWaalsContact OG-CG 3.29Å; S61-D64 PolarHBondContact OG-OD2 3.45Å
65	K	75.6	Confident	81.2	Confident	91 Å²	91	43 Å²	43	40%	0.396	25%	0.248	S	C	.	.	B	Isolated β-bridge	trans	-122.1	114.3	-179.2	-60.6	177.7	-170.5	163.9	0	111.6	S25 Q26 H104 L107	S25-K65 CarbonylContact C-O 2.88Å; S25-K65 WeakPolarHBondContact CA-O 3.24Å; S25-K65 VanDerWaalsContact CB-O 3.31Å; S25-K65 WeakPolarHBondContact CB-O 3.23Å; Q26-K65 HydrophobicContact CB-CB 4.22Å; Q26-K65 PolarHBondContact N-O 2.87Å; Q26-K65 PolarHBondContact O-N 3.22Å; K65-H104 WeakPolarHBondContact CA-O 3.49Å; K65-L107 HydrophobicContact CB-CD1 3.71Å; K65-L107 HydrophobicContact CB-CG 4.11Å; K65-L107 HydrophobicContact CD-CD1 3.93Å; K65-L107 HydrophobicContact CD-CG 4.14Å; K65-L107 HydrophobicContact CG-CD1 4.48Å
66	I	78.4	Confident	81	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	24%	0.238	C	C	.	.			trans	-77.3	150.7	175.5	-61.6	170.7	0	0	0	107.8	L27 F56 L60 D70 A71 L74 L101 H104 I106 L107	L27-I66 HydrophobicContact CD2-CG1 4.15Å; F56-I66 HydrophobicContact CE1-CD1 4.19Å; F56-I66 HydrophobicContact CZ-CD1 3.89Å; F56-I66 HydrophobicContact CZ-CG1 4.24Å; L60-I66 HydrophobicContact CD1-CD1 4.13Å; L60-I66 HydrophobicContact CD2-CD1 4.26Å; L60-I66 HydrophobicContact CD2-CG1 4.47Å; I66-D70 HydrophobicContact CG2-CB 3.63Å; I66-A71 HydrophobicContact CG2-CB 4.33Å; I66-L74 HydrophobicContact CD1-CD1 4.18Å; I66-L74 HydrophobicContact CG2-CD1 4.15Å; I66-L101 HydrophobicContact CB-CD2 4.33Å; I66-L101 HydrophobicContact CD1-CD2 3.74Å; I66-L101 HydrophobicContact CG2-CD2 3.86Å; I66-H104 HydrophobicContact CD1-CB 4.04Å; I66-H104 HydrophobicContact CG1-CB 4.37Å; I66-H104 PolarHBondContact N-O 2.9Å; I66-I106 CarbonylContact O-C 3.56Å; I66-I106 VanDerWaalsContact O-CA 3.24Å; I66-I106 WeakPolarHBondContact O-CA 3.45Å; I66-L107 PolarHBondContact O-N 3.33Å
67	N	76.1	Confident	80.8	Confident	14 Å²	14	40.5 Å²	40.5	8%	0.075	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-101	168.5	173	70.4	45.1	0	0	0	110.6	I23 S25 Q69 D70 A71	I23-N67 PolarHBondContact O-ND2 2.93Å; S25-N67 PolarHBondContact N-ND2 3.38Å; S25-N67 VanDerWaalsContact N-ND2 3.17Å; N67-Q69 VanDerWaalsContact C-N 3.26Å; N67-Q69 PolarHBondContact O-N 3.46Å; N67-Q69 WeakPolarHBondContact OD1-CA 3.4Å; N67-Q69 WeakPolarHBondContact OD1-CB 3.24Å; N67-Q69 PolarHBondContact OD1-N 2.85Å; N67-D70 PolarHBondContact ND2-OD2 3.32Å; N67-D70 PolarHBondContact O-N 3.49Å; N67-D70 VanDerWaalsContact O-N 3.11Å; N67-D70 PolarHBondContact OD1-N 3.41Å; N67-D70 PolarHBondContact OD1-OD2 2.82Å; N67-A71 PolarHBondContact O-N 3.33Å
68	V	72.1	Confident	80.7	Confident	49 Å²	49	39.3 Å²	39.3	30%	0.297	23%	0.233	S	C	.	.	H	α-helix	trans	-56.8	-38.1	-177.2	-175.3	0	0	0	0	112.9	F72 I106 N128	V68-F72 WeakPolarHBondContact O-CB 3.49Å; V68-F72 PolarHBondContact O-N 3.02Å; V68-F72 VanDerWaalsContact O-N 3.12Å; V68-I106 HydrophobicContact CB-CG2 4.04Å; V68-I106 HydrophobicContact CG2-CG2 3.61Å; V68-I106 VanDerWaalsContact N-CG2 3.35Å; V68-N128 WeakPolarHBondContact CG1-ND2 3.36Å
69	Q	75.2	Confident	80.5	Confident	92 Å²	92	36 Å²	36	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-73.3	-33.6	-179.5	-61.3	-178.8	-1.7	0	0	111.9	N67 F73	N67-Q69 VanDerWaalsContact C-N 3.26Å; N67-Q69 PolarHBondContact O-N 3.46Å; N67-Q69 WeakPolarHBondContact OD1-CA 3.4Å; N67-Q69 WeakPolarHBondContact OD1-CB 3.24Å; N67-Q69 PolarHBondContact OD1-N 2.85Å; Q69-F73 WeakPolarHBondContact O-CB 3.46Å; Q69-F73 PolarHBondContact O-N 3.13Å
70	D	82.4	Confident	79.9	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-73.8	-37	174.8	-71.6	-41	0	0	0	111.7	S25 L35 R39 I66 N67 F73 L74	S25-D70 VanDerWaalsContact CB-OD2 3.23Å; S25-D70 WeakPolarHBondContact CB-OD2 3.31Å; S25-D70 PolarHBondContact OG-OD2 3.41Å; L35-D70 HydrophobicContact CD2-CB 4.28Å; L35-D70 WeakPolarHBondContact CD2-OD1 3.45Å; R39-D70 IonicContact CZ-OD1 2.97Å; R39-D70 IonicContact NE-OD1 3.81Å; R39-D70 PolarHBondContact NE-OD1 2.66Å; R39-D70 IonicContact NH2-OD1 2.64Å; R39-D70 PolarHBondContact NH2-OD1 3.25Å; I66-D70 HydrophobicContact CG2-CB 3.63Å; N67-D70 PolarHBondContact ND2-OD2 3.32Å; N67-D70 PolarHBondContact O-N 3.49Å; N67-D70 VanDerWaalsContact O-N 3.11Å; N67-D70 PolarHBondContact OD1-N 3.41Å; N67-D70 PolarHBondContact OD1-OD2 2.82Å; D70-F73 PolarHBondContact O-N 3.22Å; D70-L74 WeakPolarHBondContact O-CB 3.47Å; D70-L74 WeakPolarHBondContact O-CD1 2.8Å; D70-L74 WeakPolarHBondContact O-CG 3.44Å; D70-L74 PolarHBondContact O-N 3.4Å
71	A	81.6	Confident	79.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-54.3	172.9	0	0	0	0	0	111.5	I66 N67 F73 L74 I75 L101 I106	I66-A71 HydrophobicContact CG2-CB 4.33Å; N67-A71 PolarHBondContact O-N 3.33Å; A71-F73 VanDerWaalsContact C-N 3.28Å; A71-F73 PolarHBondContact O-N 3Å; A71-L74 PolarHBondContact O-N 3.33Å; A71-I75 WeakPolarHBondContact O-CG1 3.32Å; A71-I75 PolarHBondContact O-N 3Å; A71-L101 HydrophobicContact CB-CD1 4.1Å; A71-L101 HydrophobicContact CB-CD2 3.75Å; A71-I106 HydrophobicContact CB-CD1 3.84Å; A71-I106 HydrophobicContact CB-CG1 4.18Å; A71-I106 HydrophobicContact CB-CG2 4.11Å
72	F	81.9	Confident	80.1	Confident	84 Å²	84	34.2 Å²	34.2	37%	0.368	19%	0.19	S	C	.	.	H	α-helix	trans	-56.5	-41.8	174.8	172.2	-95.2	0	0	0	112.3	V68 S76 D130 D131 A134	V68-F72 WeakPolarHBondContact O-CB 3.49Å; V68-F72 PolarHBondContact O-N 3.02Å; V68-F72 VanDerWaalsContact O-N 3.12Å; F72-S76 WeakPolarHBondContact O-CB 3.35Å; F72-S76 PolarHBondContact O-N 3.01Å; F72-S76 PolarHBondContact O-OG 3Å; F72-D130 HydrophobicContact CD2-CB 3.74Å; F72-D130 HydrophobicContact CE2-CB 3.99Å; F72-D131 WeakPolarHBondContact CA-OD1 3.45Å; F72-D131 PolarHBondContact N-OD1 2.86Å; F72-A134 HydrophobicContact CD2-CB 4.05Å; F72-A134 HydrophobicContact CE2-CB 3.85Å
73	F	84.8	Confident	80.2	Confident	34 Å²	34	29.1 Å²	29.1	15%	0.149	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-57.5	174.1	177	-104.5	0	0	0	110.1	L35 M38 R39 V42 Q69 D70 A71 I75 S76 C77	L35-F73 HydrophobicContact CD1-CD1 3.96Å; L35-F73 HydrophobicContact CD1-CE1 4.06Å; M38-F73 HydrophobicContact CB-CE1 4Å; M38-F73 HydrophobicContact CB-CZ 4.23Å; R39-F73 HydrophobicContact CB-CZ 4.32Å; R39-F73 HydrophobicContact CG-CD1 4.25Å; R39-F73 HydrophobicContact CG-CE1 3.77Å; R39-F73 HydrophobicContact CG-CE2 4.15Å; R39-F73 HydrophobicContact CG-CZ 3.73Å; V42-F73 HydrophobicContact CB-CE2 4.15Å; V42-F73 HydrophobicContact CB-CZ 4.31Å; V42-F73 HydrophobicContact CG1-CE2 4.26Å; V42-F73 HydrophobicContact CG2-CE2 3.98Å; V42-F73 HydrophobicContact CG2-CZ 3.86Å; Q69-F73 WeakPolarHBondContact O-CB 3.46Å; Q69-F73 PolarHBondContact O-N 3.13Å; D70-F73 PolarHBondContact O-N 3.22Å; A71-F73 VanDerWaalsContact C-N 3.28Å; A71-F73 PolarHBondContact O-N 3Å; F73-I75 VanDerWaalsContact C-N 3.29Å; F73-I75 PolarHBondContact O-N 3.34Å; F73-S76 CarbonylContact O-C 3.35Å; F73-S76 WeakPolarHBondContact O-CA 3.25Å; F73-S76 WeakPolarHBondContact O-CB 3.37Å; F73-S76 PolarHBondContact O-N 2.95Å; F73-C77 VanDerWaalsContact C-SG 3.51Å; F73-C77 WeakPolarHBondContact CE1-SG 3.43Å; F73-C77 PolarHBondContact O-N 3Å; F73-C77 PolarHBondContact O-SG 3.17Å
74	L	85.7	Confident	80.1	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-32.9	-178.2	-70.9	162.8	0	0	0	114	M38 L53 F56 I66 D70 A71 C77 C78 V97 L101	M38-L74 HydrophobicContact CE-CD2 3.88Å; L53-L74 HydrophobicContact CD1-CD2 4.05Å; F56-L74 HydrophobicContact CD1-CD1 4.44Å; F56-L74 HydrophobicContact CD1-CD2 3.84Å; F56-L74 HydrophobicContact CE1-CD1 3.45Å; F56-L74 VanDerWaalsContact CE1-CD1 3.45Å; F56-L74 HydrophobicContact CE1-CD2 3.66Å; F56-L74 HydrophobicContact CE1-CG 4.21Å; F56-L74 HydrophobicContact CZ-CD1 3.62Å; F56-L74 HydrophobicContact CZ-CD2 4.23Å; I66-L74 HydrophobicContact CD1-CD1 4.18Å; I66-L74 HydrophobicContact CG2-CD1 4.15Å; D70-L74 WeakPolarHBondContact O-CB 3.47Å; D70-L74 WeakPolarHBondContact O-CD1 2.8Å; D70-L74 WeakPolarHBondContact O-CG 3.44Å; D70-L74 PolarHBondContact O-N 3.4Å; A71-L74 PolarHBondContact O-N 3.33Å; L74-C77 WeakPolarHBondContact O-CB 3.44Å; L74-C78 PolarHBondContact O-SG 3.16Å; L74-C78 VanDerWaalsContact O-SG 3.37Å; L74-V97 HydrophobicContact CB-CG1 3.95Å; L74-L101 HydrophobicContact CD1-CD2 4.21Å
75	I	85.3	Confident	80	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.9	-53.2	172	-67.4	163.8	0	0	0	109.4	A71 F73 C77 C78 L94 V97 W98 L101 Y127 D131 A134 V138	A71-I75 WeakPolarHBondContact O-CG1 3.32Å; A71-I75 PolarHBondContact O-N 3Å; F73-I75 VanDerWaalsContact C-N 3.29Å; F73-I75 PolarHBondContact O-N 3.34Å; I75-C77 PolarHBondContact O-N 3.3Å; I75-C78 WeakPolarHBondContact O-CB 3.35Å; I75-C78 PolarHBondContact O-N 2.87Å; I75-L94 HydrophobicContact CG2-CD1 3.91Å; I75-V97 HydrophobicContact CG1-CG1 4.18Å; I75-W98 HydrophobicContact CD1-CE3 4.02Å; I75-W98 HydrophobicContact CD1-CZ3 3.87Å; I75-W98 HydrophobicContact CG1-CE3 4.34Å; I75-L101 HydrophobicContact CD1-CD1 3.85Å; I75-L101 HydrophobicContact CG1-CD1 3.82Å; I75-Y127 HydrophobicContact CD1-CD1 4.34Å; I75-Y127 HydrophobicContact CD1-CE1 4.11Å; I75-D131 HydrophobicContact CD1-CB 3.62Å; I75-A134 HydrophobicContact CB-CB 4.31Å; I75-A134 HydrophobicContact CG2-CB 3.61Å; I75-V138 WeakPolarHBondContact O-CG2 3.44Å
76	S	83	Confident	80	Confident	42 Å²	42	21 Å²	21	29%	0.294	12%	0.116	S	C	.	.	H	α-helix	trans	-58	-30.4	177.8	-55.4	0	0	0	0	113	F72 F73 C78 G79	F72-S76 WeakPolarHBondContact O-CB 3.35Å; F72-S76 PolarHBondContact O-N 3.01Å; F72-S76 PolarHBondContact O-OG 3Å; F73-S76 CarbonylContact O-C 3.35Å; F73-S76 WeakPolarHBondContact O-CA 3.25Å; F73-S76 WeakPolarHBondContact O-CB 3.37Å; F73-S76 PolarHBondContact O-N 2.95Å; S76-C78 PolarHBondContact O-N 2.94Å; S76-G79 PolarHBondContact O-N 3.24Å
77	C	84.8	Confident	80	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.027	13%	0.128	C	C	.	.	H	α-helix	trans	-57.4	-30.5	174.2	-68	0	0	0	0	113	I48 F73 L74 I75 G79 L82	I48-C77 HydrophobicContact CD1-CB 3.17Å; I48-C77 WeakPolarHBondContact CD1-SG 3.46Å; F73-C77 VanDerWaalsContact C-SG 3.51Å; F73-C77 WeakPolarHBondContact CE1-SG 3.43Å; F73-C77 PolarHBondContact O-N 3Å; F73-C77 PolarHBondContact O-SG 3.17Å; L74-C77 WeakPolarHBondContact O-CB 3.44Å; I75-C77 PolarHBondContact O-N 3.3Å; C77-G79 PolarHBondContact O-N 3.19Å; C77-L82 WeakPolarHBondContact O-CG 3.19Å
78	C	83.9	Confident	80.2	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.8	-175.5	-61.5	0	0	0	0	114	L74 I75 S76 R90 L94 V138 N142	L74-C78 PolarHBondContact O-SG 3.16Å; L74-C78 VanDerWaalsContact O-SG 3.37Å; I75-C78 WeakPolarHBondContact O-CB 3.35Å; I75-C78 PolarHBondContact O-N 2.87Å; S76-C78 PolarHBondContact O-N 2.94Å; C78-R90 WeakPolarHBondContact O-CB 3.03Å; C78-L94 HydrophobicContact CB-CB 3.77Å; C78-L94 HydrophobicContact CB-CD1 4Å; C78-L94 HydrophobicContact CB-CG 4.48Å; C78-V138 HydrophobicContact CB-CG1 4.17Å; C78-V138 WeakPolarHBondContact O-CG1 3.31Å; C78-N142 PolarHBondContact O-ND2 2.91Å
79	G	80.6	Confident	80.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-89.1	-139.5	176.8	0	0	0	0	0	114.4	S76 C77 A81 L82 R90 E141	S76-G79 PolarHBondContact O-N 3.24Å; C77-G79 PolarHBondContact O-N 3.19Å; G79-A81 PolarHBondContact O-N 2.73Å; G79-A81 VanDerWaalsContact O-N 3.1Å; G79-L82 PolarHBondContact O-N 2.88Å; G79-R90 WeakPolarHBondContact O-CD 3.48Å; G79-E141 WeakPolarHBondContact CA-OE2 3.27Å
80	S	74.7	Confident	81.2	Confident	44 Å²	44	24.2 Å²	24.2	31%	0.308	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.6	178.2	54	0	0	0	0	114.4	L82 E141	S80-L82 VanDerWaalsContact C-N 3.26Å; S80-L82 PolarHBondContact O-N 3.11Å; S80-E141 WeakPolarHBondContact CB-OE1 3.25Å; S80-E141 PolarHBondContact N-OE2 3.5Å; S80-E141 PolarHBondContact OG-OE1 3.47Å
81	A	81.9	Confident	81.4	Confident	15 Å²	15	26.3 Å²	26.3	12%	0.124	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.6	177.7	0	0	0	0	0	115.3	V47 I48 G79 P83	V47-A81 CarbonylContact C-O 3.59Å; V47-A81 WeakPolarHBondContact CA-O 3.47Å; I48-A81 HydrophobicContact CD1-CB 4.11Å; I48-A81 HydrophobicContact CG1-CB 4.46Å; I48-A81 PolarHBondContact N-O 2.73Å; G79-A81 PolarHBondContact O-N 2.73Å; G79-A81 VanDerWaalsContact O-N 3.1Å; A81-P83 WeakPolarHBondContact O-CD 3.47Å
82	L	82.9	Confident	81.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.			trans	-105.4	67.6	173	-74.6	171	0	0	0	111.7	I48 P50 L53 C77 G79 S80 E84 C85 R90 L93	I48-L82 HydrophobicContact CB-CD2 3.93Å; I48-L82 HydrophobicContact CG2-CD2 3.79Å; P50-L82 HydrophobicContact CG-CD2 4.24Å; L53-L82 HydrophobicContact CD2-CD1 4.01Å; L53-L82 HydrophobicContact CD2-CD2 4.41Å; C77-L82 WeakPolarHBondContact O-CG 3.19Å; G79-L82 PolarHBondContact O-N 2.88Å; S80-L82 VanDerWaalsContact C-N 3.26Å; S80-L82 PolarHBondContact O-N 3.11Å; L82-E84 PolarHBondContact O-N 3.23Å; L82-E84 VanDerWaalsContact O-N 3.14Å; L82-C85 HydrophobicContact CB-CB 4.36Å; L82-C85 PolarHBondContact O-N 3.12Å; L82-C85 VanDerWaalsContact O-N 3.1Å; L82-R90 HydrophobicContact CB-CG 4.1Å; L82-R90 HydrophobicContact CD1-CG 4.47Å; L82-R90 VanDerWaalsContact O-CZ 3.28Å; L82-R90 PolarHBondContact O-NE 3.3Å; L82-R90 PolarHBondContact O-NH2 2.81Å; L82-R90 VanDerWaalsContact O-NH2 3.07Å; L82-L93 HydrophobicContact CD1-CD1 3.76Å
83	P	76.4	Confident	81.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.6	-171.1	29.5	-37.5	0	0	0	113.2	V47 A81 C85 I333 R334 S337	V47-P83 HydrophobicContact CG1-CG 3.62Å; V47-P83 HydrophobicContact CG2-CG 4.39Å; A81-P83 WeakPolarHBondContact O-CD 3.47Å; P83-C85 VanDerWaalsContact C-N 3.33Å; P83-C85 PolarHBondContact O-N 3.34Å; P83-I333 HydrophobicContact CB-CB 4.02Å; P83-I333 HydrophobicContact CB-CG2 3.76Å; P83-I333 HydrophobicContact CG-CG2 4.14Å; P83-R334 HydrophobicContact CB-CG 3.67Å; P83-S337 PolarHBondContact O-OG 3.41Å
84	E	75.2	Confident	82.1	Confident	17 Å²	17	28.5 Å²	28.5	8%	0.079	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.3	179.5	-67.4	-177.6	-144.4	0	0	115	P50 L82 I333 R367 H371	P50-E84 HydrophobicContact CG-CB 4.16Å; L82-E84 PolarHBondContact O-N 3.23Å; L82-E84 VanDerWaalsContact O-N 3.14Å; E84-I333 HydrophobicContact CB-CG2 4.44Å; E84-I333 HydrophobicContact CG-CG2 3.66Å; E84-R367 IonicContact OE1-CZ 3.85Å; E84-R367 IonicContact OE1-NE 3.83Å; E84-R367 PolarHBondContact OE1-NE 3Å; E84-R367 IonicContact OE1-NH2 3.17Å; E84-R367 PolarHBondContact OE1-NH2 3.42Å; E84-H371 VanDerWaalsContact CA-CE1 3.44Å; E84-H371 WeakPolarHBondContact CA-CE1 3.46Å; E84-H371 PolarHBondContact O-CE1 3.48Å
85	C	77.4	Confident	82.1	Confident	6 Å²	6	33.1 Å²	33.1	4%	0.041	18%	0.18	C	C	.	.	S	Bend	trans	-99.6	139.8	173.2	-76.2	0	0	0	0	110.3	L82 P83 E89 R90	L82-C85 HydrophobicContact CB-CB 4.36Å; L82-C85 PolarHBondContact O-N 3.12Å; L82-C85 VanDerWaalsContact O-N 3.1Å; P83-C85 VanDerWaalsContact C-N 3.33Å; P83-C85 PolarHBondContact O-N 3.34Å; C85-E89 HydrophobicContact CB-CB 3.94Å; C85-R90 HydrophobicContact CB-CG 3.59Å; C85-R90 PolarHBondContact O-NE 3.1Å; C85-R90 VanDerWaalsContact O-NE 3.09Å; C85-R90 PolarHBondContact O-NH2 3.4Å
86	V	76.9	Confident	82.2	Confident	34 Å²	34	38.5 Å²	38.5	21%	0.206	20%	0.204	C	C	.	.			trans	-66.7	154.9	166.1	-70.9	0	0	0	0	110.2	S88 E89 R90 S337	V86-S88 WeakPolarHBondContact CG2-OG 3.14Å; V86-S88 PolarHBondContact O-N 2.71Å; V86-S88 VanDerWaalsContact O-N 3.09Å; V86-E89 HydrophobicContact CG2-CB 3.93Å; V86-E89 HydrophobicContact CG2-CG 3.57Å; V86-E89 PolarHBondContact N-OE2 3.37Å; V86-E89 WeakPolarHBondContact O-CB 3.12Å; V86-E89 PolarHBondContact O-N 2.99Å; V86-R90 PolarHBondContact O-N 2.78Å; V86-S337 VanDerWaalsContact CG1-O 3.23Å; V86-S337 WeakPolarHBondContact CG1-O 3.47Å
87	P	77.8	Confident	82.4	Confident	39 Å²	39	36.6 Å²	36.6	25%	0.253	19%	0.19	S	C	.	.	H	α-helix	trans	-52.5	-36.4	-178.7	-29.2	36.1	0	0	0	113.9	E89 R90 M91 N142 L338	P87-E89 PolarHBondContact O-N 3.45Å; P87-R90 PolarHBondContact O-N 2.79Å; P87-M91 VanDerWaalsContact O-CG 3.26Å; P87-M91 WeakPolarHBondContact O-CG 3.43Å; P87-M91 PolarHBondContact O-N 3.24Å; P87-N142 HydrophobicContact CB-CB 4.13Å; P87-L338 HydrophobicContact CG-CD2 4.36Å
88	S	79.1	Confident	82.4	Confident	78 Å²	78	37.5 Å²	37.5	55%	0.545	19%	0.193	S	C	.	.	H	α-helix	trans	-69.5	-27.2	176.5	56.5	0	0	0	0	114.5	V86 K92	V86-S88 WeakPolarHBondContact CG2-OG 3.14Å; V86-S88 PolarHBondContact O-N 2.71Å; V86-S88 VanDerWaalsContact O-N 3.09Å; S88-K92 WeakPolarHBondContact O-CG 3.27Å; S88-K92 PolarHBondContact O-N 3.46Å
89	E	83.1	Confident	82.4	Confident	91 Å²	91	42.1 Å²	42.1	43%	0.425	22%	0.218	S	C	.	.	H	α-helix	trans	-78.7	-40.5	172	-76	174	173.4	0	0	111.2	C85 V86 P87 M91 K92 L93	C85-E89 HydrophobicContact CB-CB 3.94Å; V86-E89 HydrophobicContact CG2-CB 3.93Å; V86-E89 HydrophobicContact CG2-CG 3.57Å; V86-E89 PolarHBondContact N-OE2 3.37Å; V86-E89 WeakPolarHBondContact O-CB 3.12Å; V86-E89 PolarHBondContact O-N 2.99Å; P87-E89 PolarHBondContact O-N 3.45Å; E89-M91 VanDerWaalsContact C-N 3.29Å; E89-M91 PolarHBondContact O-N 2.94Å; E89-K92 WeakPolarHBondContact O-CB 3.37Å; E89-K92 PolarHBondContact O-N 3.33Å; E89-K92 VanDerWaalsContact O-N 3.11Å; E89-L93 PolarHBondContact O-N 2.8Å
90	R	85.4	Confident	82.5	Confident	15 Å²	15	44.1 Å²	44.1	6%	0.057	23%	0.228	C	C	.	.	H	α-helix	trans	-58.2	-41.9	174	-70.2	-177.5	-167.7	156.3	13.5	112.2	C78 G79 L82 C85 V86 P87 L93 L94 N142	C78-R90 WeakPolarHBondContact O-CB 3.03Å; G79-R90 WeakPolarHBondContact O-CD 3.48Å; L82-R90 HydrophobicContact CB-CG 4.1Å; L82-R90 HydrophobicContact CD1-CG 4.47Å; L82-R90 VanDerWaalsContact O-CZ 3.28Å; L82-R90 PolarHBondContact O-NE 3.3Å; L82-R90 PolarHBondContact O-NH2 2.81Å; L82-R90 VanDerWaalsContact O-NH2 3.07Å; C85-R90 HydrophobicContact CB-CG 3.59Å; C85-R90 PolarHBondContact O-NE 3.1Å; C85-R90 VanDerWaalsContact O-NE 3.09Å; C85-R90 PolarHBondContact O-NH2 3.4Å; V86-R90 PolarHBondContact O-N 2.78Å; P87-R90 PolarHBondContact O-N 2.79Å; R90-L93 PolarHBondContact O-N 3.05Å; R90-L94 WeakPolarHBondContact O-CB 3.41Å; R90-L94 PolarHBondContact O-N 3.06Å; R90-N142 WeakPolarHBondContact CD-OD1 3.35Å; R90-N142 PolarHBondContact NH1-OD1 2.93Å
91	M	87.4	Confident	82.7	Confident	47 Å²	47	42.1 Å²	42.1	23%	0.232	21%	0.214	C	C	.	.	H	α-helix	trans	-68.7	-31.8	175.6	-66.1	-60.3	-56	0	0	113	P87 E89 L94 Q95 V138 N142 V144	P87-M91 VanDerWaalsContact O-CG 3.26Å; P87-M91 WeakPolarHBondContact O-CG 3.43Å; P87-M91 PolarHBondContact O-N 3.24Å; E89-M91 VanDerWaalsContact C-N 3.29Å; E89-M91 PolarHBondContact O-N 2.94Å; M91-L94 HydrophobicContact CE-CD2 3.69Å; M91-L94 HydrophobicContact SD-CD2 4.01Å; M91-Q95 WeakPolarHBondContact O-CB 3.44Å; M91-Q95 PolarHBondContact O-N 3.28Å; M91-V138 HydrophobicContact SD-CG1 4.42Å; M91-N142 HydrophobicContact CG-CB 4.05Å; M91-N142 HydrophobicContact SD-CB 3.86Å; M91-V144 HydrophobicContact CE-CB 4.41Å; M91-V144 HydrophobicContact CE-CG1 4.4Å; M91-V144 HydrophobicContact CE-CG2 4.02Å; M91-V144 HydrophobicContact CG-CG2 3.69Å; M91-V144 HydrophobicContact SD-CG2 3.85Å
92	K	86.7	Confident	82.5	Confident	145 Å²	145	43.2 Å²	43.2	63%	0.63	22%	0.22	S	C	*	.	H	α-helix	trans	-68	-36.7	169.7	-72.8	172.4	-179.1	-178.2	0	112.2	S88 E89 K96	S88-K92 WeakPolarHBondContact O-CG 3.27Å; S88-K92 PolarHBondContact O-N 3.46Å; E89-K92 WeakPolarHBondContact O-CB 3.37Å; E89-K92 PolarHBondContact O-N 3.33Å; E89-K92 VanDerWaalsContact O-N 3.11Å; K92-K96 WeakPolarHBondContact O-CG 3.2Å; K92-K96 PolarHBondContact O-N 3.41Å
93	L	86.8	Confident	81.9	Confident	15 Å²	15	47 Å²	47	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-42.7	174.8	-73	169.4	0	0	0	111.3	L53 L82 E89 R90 Q95 K96 V97	L53-L93 HydrophobicContact CD2-CB 4.5Å; L53-L93 HydrophobicContact CD2-CD1 4.35Å; L53-L93 HydrophobicContact CD2-CD2 4.38Å; L82-L93 HydrophobicContact CD1-CD1 3.76Å; E89-L93 PolarHBondContact O-N 2.8Å; R90-L93 PolarHBondContact O-N 3.05Å; L93-Q95 VanDerWaalsContact C-N 3.34Å; L93-Q95 PolarHBondContact O-N 3.38Å; L93-K96 PolarHBondContact O-N 3.29Å; L93-V97 WeakPolarHBondContact O-CG2 3.23Å; L93-V97 PolarHBondContact O-N 2.73Å
94	L	88.8	Confident	81.4	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-48.8	171.2	179	68.5	0	0	0	110.7	I75 C78 R90 M91 K96 V97 W98 R135 V138	I75-L94 HydrophobicContact CG2-CD1 3.91Å; C78-L94 HydrophobicContact CB-CB 3.77Å; C78-L94 HydrophobicContact CB-CD1 4Å; C78-L94 HydrophobicContact CB-CG 4.48Å; R90-L94 WeakPolarHBondContact O-CB 3.41Å; R90-L94 PolarHBondContact O-N 3.06Å; M91-L94 HydrophobicContact CE-CD2 3.69Å; M91-L94 HydrophobicContact SD-CD2 4.01Å; L94-K96 PolarHBondContact O-N 3.19Å; L94-V97 PolarHBondContact O-N 2.81Å; L94-W98 VanDerWaalsContact O-CB 3.24Å; L94-W98 WeakPolarHBondContact O-CB 3.38Å; L94-W98 PolarHBondContact O-N 3.2Å; L94-R135 HydrophobicContact CD2-CG 4.41Å; L94-V138 HydrophobicContact CD1-CG1 4.29Å; L94-V138 HydrophobicContact CD2-CB 4.38Å; L94-V138 HydrophobicContact CD2-CG1 3.81Å; L94-V138 HydrophobicContact CG-CG1 4.45Å
95	Q	87.2	Confident	80.5	Confident	99 Å²	99	48.3 Å²	48.3	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-46.8	178.1	-169.4	63.5	50.2	0	0	111.1	M91 L93 V97 W98 D99	M91-Q95 WeakPolarHBondContact O-CB 3.44Å; M91-Q95 PolarHBondContact O-N 3.28Å; L93-Q95 VanDerWaalsContact C-N 3.34Å; L93-Q95 PolarHBondContact O-N 3.38Å; Q95-V97 PolarHBondContact O-N 2.97Å; Q95-W98 CarbonylContact O-C 3.53Å; Q95-W98 WeakPolarHBondContact O-CA 3.45Å; Q95-W98 PolarHBondContact O-N 2.46Å; Q95-W98 VanDerWaalsContact O-N 3.1Å; Q95-D99 PolarHBondContact NE2-OD1 3.31Å; Q95-D99 WeakPolarHBondContact O-CB 3.44Å; Q95-D99 PolarHBondContact O-N 3.11Å
96	K	86.7	Confident	79.4	Confident	112 Å²	112	48.4 Å²	48.4	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-57.9	-44.9	175	-75.8	178.5	174.2	-168.3	0	112.9	K92 L93 L94 W98 D99 I100	K92-K96 WeakPolarHBondContact O-CG 3.2Å; K92-K96 PolarHBondContact O-N 3.41Å; L93-K96 PolarHBondContact O-N 3.29Å; L94-K96 PolarHBondContact O-N 3.19Å; K96-W98 VanDerWaalsContact C-N 3.31Å; K96-D99 PolarHBondContact O-N 2.9Å; K96-I100 VanDerWaalsContact O-CB 3.28Å; K96-I100 WeakPolarHBondContact O-CB 3.48Å; K96-I100 WeakPolarHBondContact O-CD1 3.37Å; K96-I100 WeakPolarHBondContact O-CG1 3.19Å; K96-I100 PolarHBondContact O-N 3.27Å
97	V	86.1	Confident	77.9	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-42.2	175.5	170.1	0	0	0	0	110.2	L57 L74 I75 L93 L94 Q95 D99 I100 L101	L57-V97 HydrophobicContact CD1-CG2 4.24Å; L57-V97 HydrophobicContact CD2-CG2 4.15Å; L74-V97 HydrophobicContact CB-CG1 3.95Å; I75-V97 HydrophobicContact CG1-CG1 4.18Å; L93-V97 WeakPolarHBondContact O-CG2 3.23Å; L93-V97 PolarHBondContact O-N 2.73Å; L94-V97 PolarHBondContact O-N 2.81Å; Q95-V97 PolarHBondContact O-N 2.97Å; V97-D99 VanDerWaalsContact C-N 3.31Å; V97-D99 PolarHBondContact O-N 1.98Å; V97-I100 PolarHBondContact O-N 2.93Å; V97-L101 HydrophobicContact CG1-CD1 3.61Å; V97-L101 HydrophobicContact CG1-CG 4.07Å; V97-L101 WeakPolarHBondContact O-CB 3.4Å; V97-L101 VanDerWaalsContact O-CG 3.23Å; V97-L101 WeakPolarHBondContact O-CG 3.44Å; V97-L101 PolarHBondContact O-N 3.44Å
98	W	85.9	Confident	76.1	Confident	24 Å²	24	50.8 Å²	50.8	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-71.8	-18.9	178.4	-162.5	-81.1	0	0	0	114	I75 L94 Q95 K96 Y127 D131 Y132 R135	I75-W98 HydrophobicContact CD1-CE3 4.02Å; I75-W98 HydrophobicContact CD1-CZ3 3.87Å; I75-W98 HydrophobicContact CG1-CE3 4.34Å; L94-W98 VanDerWaalsContact O-CB 3.24Å; L94-W98 WeakPolarHBondContact O-CB 3.38Å; L94-W98 PolarHBondContact O-N 3.2Å; Q95-W98 CarbonylContact O-C 3.53Å; Q95-W98 WeakPolarHBondContact O-CA 3.45Å; Q95-W98 PolarHBondContact O-N 2.46Å; Q95-W98 VanDerWaalsContact O-N 3.1Å; K96-W98 VanDerWaalsContact C-N 3.31Å; W98-Y127 VanDerWaalsContact C-OH 3.26Å; W98-Y127 VanDerWaalsContact CA-OH 3.24Å; W98-Y127 WeakPolarHBondContact CA-OH 3.37Å; W98-Y127 AromaticContact CD1-CE2 3.99Å; W98-Y127 HydrophobicContact CD2-CD2 4.49Å; W98-Y127 HydrophobicContact CD2-CE1 4.2Å; W98-Y127 AromaticContact CD2-CE2 3.9Å; W98-Y127 HydrophobicContact CD2-CE2 3.9Å; W98-Y127 AromaticContact CD2-CZ 3.74Å; W98-Y127 AromaticContact CE2-CD2 3.74Å; W98-Y127 AromaticContact CE2-CE2 3.43Å; W98-Y127 VanDerWaalsContact CE2-CE2 3.43Å; W98-Y127 AromaticContact CE2-CZ 3.79Å; W98-Y127 HydrophobicContact CE3-CE1 4.09Å; W98-Y127 HydrophobicContact CG-CE2 4.23Å; W98-Y127 HydrophobicContact CH2-CD1 4.03Å; W98-Y127 HydrophobicContact CH2-CD2 4.04Å; W98-Y127 HydrophobicContact CH2-CE1 4.38Å; W98-Y127 HydrophobicContact CH2-CE2 4.39Å; W98-Y127 AromaticContact CH2-CG 3.86Å; W98-Y127 HydrophobicContact CH2-CG 3.86Å; W98-Y127 HydrophobicContact CZ2-CD1 4.3Å; W98-Y127 AromaticContact CZ2-CD2 3.49Å; W98-Y127 HydrophobicContact CZ2-CD2 3.49Å; W98-Y127 VanDerWaalsContact CZ2-CD2 3.49Å; W98-Y127 HydrophobicContact CZ2-CE1 4.48Å; W98-Y127 AromaticContact CZ2-CE2 3.72Å; W98-Y127 HydrophobicContact CZ2-CE2 3.72Å; W98-Y127 AromaticContact CZ2-CG 3.82Å; W98-Y127 HydrophobicContact CZ2-CG 3.82Å; W98-Y127 HydrophobicContact CZ3-CD1 4.15Å; W98-Y127 HydrophobicContact CZ3-CE1 4.19Å; W98-Y127 HydrophobicContact CZ3-CG 4.43Å; W98-Y127 AromaticContact NE1-CE2 3.51Å; W98-Y127 PolarHBondContact O-OH 2.84Å; W98-D131 HydrophobicContact CZ3-CB 4.46Å; W98-Y132 HydrophobicContact CH2-CD1 4.12Å; W98-Y132 HydrophobicContact CH2-CD2 4.25Å; W98-Y132 HydrophobicContact CH2-CE1 4.16Å; W98-Y132 HydrophobicContact CH2-CE2 4.29Å; W98-Y132 HydrophobicContact CH2-CG 4.16Å; W98-Y132 HydrophobicContact CZ2-CD1 4.37Å; W98-Y132 AromaticContact CZ2-CE1 3.95Å; W98-Y132 HydrophobicContact CZ2-CE1 3.95Å; W98-Y132 HydrophobicContact CZ2-CE2 4.25Å; W98-Y132 AromaticContact CZ2-CZ 3.87Å; W98-R135 VanDerWaalsContact CE2-NH1 3.28Å; W98-R135 HydrophobicContact CE3-CB 4.36Å; W98-R135 HydrophobicContact CH2-CB 4.28Å; W98-R135 HydrophobicContact CZ3-CB 3.76Å; W98-R135 HydrophobicContact CZ3-CG 4.29Å
99	D	84.3	Confident	74	Confident	97 Å²	97	54.1 Å²	54.1	52%	0.519	28%	0.281	S	S	.	.	H	α-helix	trans	-90.5	-28.1	173	-60.9	-25.4	0	0	0	111.3	Q95 K96 V97	Q95-D99 PolarHBondContact NE2-OD1 3.31Å; Q95-D99 WeakPolarHBondContact O-CB 3.44Å; Q95-D99 PolarHBondContact O-N 3.11Å; K96-D99 PolarHBondContact O-N 2.9Å; V97-D99 VanDerWaalsContact C-N 3.31Å; V97-D99 PolarHBondContact O-N 1.98Å
100	I	82.1	Confident	71.8	Confident	42 Å²	42	56.5 Å²	56.5	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-87.5	-40	-174.9	-71.5	168.3	0	0	0	112.5	L57 L60 K96 V97 P102 S103 H104	L57-I100 HydrophobicContact CD2-CD1 3.98Å; L60-I100 HydrophobicContact CD1-CG2 3.72Å; K96-I100 VanDerWaalsContact O-CB 3.28Å; K96-I100 WeakPolarHBondContact O-CB 3.48Å; K96-I100 WeakPolarHBondContact O-CD1 3.37Å; K96-I100 WeakPolarHBondContact O-CG1 3.19Å; K96-I100 PolarHBondContact O-N 3.27Å; V97-I100 PolarHBondContact O-N 2.93Å; I100-P102 VanDerWaalsContact C-CD 3.42Å; I100-S103 PolarHBondContact O-N 3.28Å; I100-S103 PolarHBondContact O-OG 2.94Å; I100-H104 WeakPolarHBondContact CG2-ND1 3.48Å; I100-H104 PolarHBondContact O-N 3.48Å; I100-H104 PolarHBondContact O-ND1 3.16Å
101	L	79.6	Confident	69.2	Low	2 Å²	2	62.4 Å²	62.4	1%	0.01	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-39	-176.8	-76.9	169.4	0	0	0	115.2	I66 A71 L74 I75 V97 S103 H104 Y127	I66-L101 HydrophobicContact CB-CD2 4.33Å; I66-L101 HydrophobicContact CD1-CD2 3.74Å; I66-L101 HydrophobicContact CG2-CD2 3.86Å; A71-L101 HydrophobicContact CB-CD1 4.1Å; A71-L101 HydrophobicContact CB-CD2 3.75Å; L74-L101 HydrophobicContact CD1-CD2 4.21Å; I75-L101 HydrophobicContact CD1-CD1 3.85Å; I75-L101 HydrophobicContact CG1-CD1 3.82Å; V97-L101 HydrophobicContact CG1-CD1 3.61Å; V97-L101 HydrophobicContact CG1-CG 4.07Å; V97-L101 WeakPolarHBondContact O-CB 3.4Å; V97-L101 VanDerWaalsContact O-CG 3.23Å; V97-L101 WeakPolarHBondContact O-CG 3.44Å; V97-L101 PolarHBondContact O-N 3.44Å; L101-S103 VanDerWaalsContact C-N 3.27Å; L101-S103 PolarHBondContact O-N 2.99Å; L101-H104 PolarHBondContact O-N 3.32Å; L101-Y127 HydrophobicContact CB-CE1 4.11Å; L101-Y127 WeakPolarHBondContact CB-OH 3.27Å; L101-Y127 HydrophobicContact CD1-CE1 3.98Å
102	P	76.2	Confident	66.6	Low	37 Å²	37	67.2 Å²	67.2	24%	0.24	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-25	179.6	-19.8	35	0	0	0	113	I100 V125 Y127	I100-P102 VanDerWaalsContact C-CD 3.42Å; P102-V125 PolarHBondContact O-N 3.03Å; P102-Y127 WeakPolarHBondContact CD-OH 3.22Å; P102-Y127 HydrophobicContact CG-CE2 3.87Å; P102-Y127 WeakPolarHBondContact CG-OH 3.4Å
103	S	70.7	Confident	64.1	Low	79 Å²	79	67 Å²	67	55%	0.552	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-27.1	179.6	62.9	0	0	0	0	113.5	I100 L101 G105	I100-S103 PolarHBondContact O-N 3.28Å; I100-S103 PolarHBondContact O-OG 2.94Å; L101-S103 VanDerWaalsContact C-N 3.27Å; L101-S103 PolarHBondContact O-N 2.99Å; S103-G105 VanDerWaalsContact C-N 3.31Å; S103-G105 PolarHBondContact O-N 3.23Å
104	H	66.5	Low	61.5	Low	26 Å²	26	71.9 Å²	71.9	12%	0.12	38%	0.381	C	S	.	.	S	Bend	trans	-101.2	36.6	177.6	-63.9	73.4	0	0	0	111.9	S61 K65 I66 I100 L101	S61-H104 PolarHBondContact O-CD2 3.19Å; S61-H104 PolarHBondContact O-NE2 3.07Å; K65-H104 WeakPolarHBondContact CA-O 3.49Å; I66-H104 HydrophobicContact CD1-CB 4.04Å; I66-H104 HydrophobicContact CG1-CB 4.37Å; I66-H104 PolarHBondContact N-O 2.9Å; I100-H104 WeakPolarHBondContact CG2-ND1 3.48Å; I100-H104 PolarHBondContact O-N 3.48Å; I100-H104 PolarHBondContact O-ND1 3.16Å; L101-H104 PolarHBondContact O-N 3.32Å
105	G	56.8	Low	58.9	Low	20 Å²	20	77.2 Å²	77.2	21%	0.206	42%	0.415	C	S	.	.			trans	32.8	94.7	169.7	0	0	0	0	0	117.6	S103 L107	S103-G105 VanDerWaalsContact C-N 3.31Å; S103-G105 PolarHBondContact O-N 3.23Å; G105-L107 PolarHBondContact O-N 3.19Å
106	I	54	Low	56.4	Low	8 Å²	8	78.1 Å²	78.1	4%	0.041	43%	0.433	C	S	.	.			trans	-62	104.5	171.5	-43.1	177.9	0	0	0	109.7	I66 V68 A71 A108 V125 Y127	I66-I106 CarbonylContact O-C 3.56Å; I66-I106 VanDerWaalsContact O-CA 3.24Å; I66-I106 WeakPolarHBondContact O-CA 3.45Å; V68-I106 HydrophobicContact CB-CG2 4.04Å; V68-I106 HydrophobicContact CG2-CG2 3.61Å; V68-I106 VanDerWaalsContact N-CG2 3.35Å; A71-I106 HydrophobicContact CB-CD1 3.84Å; A71-I106 HydrophobicContact CB-CG1 4.18Å; A71-I106 HydrophobicContact CB-CG2 4.11Å; I106-A108 PolarHBondContact O-N 3.07Å; I106-V125 HydrophobicContact CB-CB 4.33Å; I106-V125 HydrophobicContact CB-CG1 3.58Å; I106-V125 HydrophobicContact CD1-CG1 4.41Å; I106-V125 HydrophobicContact CG1-CB 4.4Å; I106-V125 HydrophobicContact CG1-CG1 4.01Å; I106-V125 WeakPolarHBondContact O-CG1 3.43Å; I106-Y127 HydrophobicContact CD1-CD1 4.45Å
107	L	44.5	Very low	54	Low	54 Å²	54	82.5 Å²	82.5	28%	0.283	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-67.8	89	-174	-108.7	169.7	0	0	0	112	I23 Q26 K65 I66 G105	I23-L107 HydrophobicContact CG2-CB 4.07Å; I23-L107 HydrophobicContact CG2-CD1 4.01Å; I23-L107 HydrophobicContact CG2-CG 4.49Å; Q26-L107 HydrophobicContact CG-CD1 4.11Å; K65-L107 HydrophobicContact CB-CD1 3.71Å; K65-L107 HydrophobicContact CB-CG 4.11Å; K65-L107 HydrophobicContact CD-CD1 3.93Å; K65-L107 HydrophobicContact CD-CG 4.14Å; K65-L107 HydrophobicContact CG-CD1 4.48Å; I66-L107 PolarHBondContact O-N 3.33Å; G105-L107 PolarHBondContact O-N 3.19Å
108	A	40.7	Very low	51.4	Low	68 Å²	68	90.9 Å²	90.9	56%	0.562	49%	0.491	S	S	*	.			trans	-90.3	127.5	169.3	0	0	0	0	0	110.6	I106 L110	I106-A108 PolarHBondContact O-N 3.07Å; A108-L110 PolarHBondContact O-N 3.45Å; A108-L110 VanDerWaalsContact O-N 3.12Å
109	F	35.3	Very low	48.5	Very low	148 Å²	148	97.5 Å²	97.5	65%	0.649	53%	0.527	S	S	*	.			trans	-79.5	93.8	-174.8	-171.4	-110.7	0	0	0	111.8	I23 M111	I23-F109 HydrophobicContact CD1-CB 3.73Å; I23-F109 HydrophobicContact CD1-CD2 3.61Å; I23-F109 HydrophobicContact CD1-CG 3.98Å; F109-M111 HydrophobicContact CD1-CB 3.94Å; F109-M111 HydrophobicContact CD1-CG 4.45Å; F109-M111 HydrophobicContact CE1-CB 3.57Å; F109-M111 HydrophobicContact CE1-CG 3.59Å; F109-M111 HydrophobicContact CE1-SD 3.71Å; F109-M111 HydrophobicContact CZ-CB 4.3Å; F109-M111 HydrophobicContact CZ-CG 3.95Å; F109-M111 HydrophobicContact CZ-SD 4.16Å; F109-M111 PolarHBondContact O-N 3.16Å; F109-M111 VanDerWaalsContact O-N 3.15Å
110	L	35.7	Very low	45.9	Very low	142 Å²	142	98.2 Å²	98.2	74%	0.743	54%	0.535	S	S	*	.			trans	-77.5	90.1	167.2	-80.8	175.7	0	0	0	110.6	A108 F112	A108-L110 PolarHBondContact O-N 3.45Å; A108-L110 VanDerWaalsContact O-N 3.12Å; L110-F112 VanDerWaalsContact C-N 3.25Å; L110-F112 HydrophobicContact CB-CD2 4.25Å; L110-F112 HydrophobicContact CD1-CE2 4.4Å; L110-F112 HydrophobicContact CD2-CD2 4.31Å; L110-F112 HydrophobicContact CD2-CE2 4.1Å; L110-F112 PolarHBondContact O-N 3.37Å
111	M	31.7	Very low	43.2	Very low	138 Å²	138	101.6 Å²	101.6	68%	0.68	56%	0.557	S	S	*	*			trans	-79.3	74.9	168.9	-144.1	-177.1	82.7	0	0	110.5	F109 I113	F109-M111 HydrophobicContact CD1-CB 3.94Å; F109-M111 HydrophobicContact CD1-CG 4.45Å; F109-M111 HydrophobicContact CE1-CB 3.57Å; F109-M111 HydrophobicContact CE1-CG 3.59Å; F109-M111 HydrophobicContact CE1-SD 3.71Å; F109-M111 HydrophobicContact CZ-CB 4.3Å; F109-M111 HydrophobicContact CZ-CG 3.95Å; F109-M111 HydrophobicContact CZ-SD 4.16Å; F109-M111 PolarHBondContact O-N 3.16Å; F109-M111 VanDerWaalsContact O-N 3.15Å; M111-I113 PolarHBondContact O-N 3.03Å
112	F	32.9	Very low	40.9	Very low	148 Å²	148	106.7 Å²	106.7	65%	0.649	59%	0.592	S	S	*	*			trans	-73.4	116.1	171.5	-101.4	-83	0	0	0	110.9	L110	L110-F112 VanDerWaalsContact C-N 3.25Å; L110-F112 HydrophobicContact CB-CD2 4.25Å; L110-F112 HydrophobicContact CD1-CE2 4.4Å; L110-F112 HydrophobicContact CD2-CD2 4.31Å; L110-F112 HydrophobicContact CD2-CE2 4.1Å; L110-F112 PolarHBondContact O-N 3.37Å
113	I	33.3	Very low	38.8	Very low	140 Å²	140	113.8 Å²	113.8	72%	0.718	62%	0.622	S	S	*	*			trans	-125.2	83.9	153.9	-56.7	-179.2	0	0	0	107.8	M111	M111-I113 PolarHBondContact O-N 3.03Å
114	T	32.7	Very low	37.3	Very low	118 Å²	118	112.5 Å²	112.5	72%	0.724	62%	0.621	S	S	*	*	S	Bend	trans	-175.4	142.4	139.1	18.6	0	0	0	0	109.9
115	P	33.1	Very low	36.5	Very low	117 Å²	117	113.5 Å²	113.5	76%	0.76	63%	0.629	S	S	*	*			trans	-103.2	117.3	-165.5	35.3	-27.3	0	0	0	112.7
116	S	35.4	Very low	36.8	Very low	119 Å²	119	119.8 Å²	119.8	83%	0.832	65%	0.653	S	S	*	*			trans	-169.8	-16.6	162	-83.8	0	0	0	0	115.5
117	F	36.1	Very low	37.7	Very low	204 Å²	204	120.5 Å²	120.5	90%	0.895	66%	0.655	S	S	*	*			trans	-86.8	139.6	-171.8	-95.3	-93.4	0	0	0	114.8
118	H	31.8	Very low	39.2	Very low	178 Å²	178	120 Å²	120	82%	0.824	65%	0.653	S	S	*	*			trans	-62.6	151.1	-175.2	-104.9	-1.5	0	0	0	113.7	V120	H118-V120 PolarHBondContact O-N 3.45Å
119	L	24.8	Very low	41.3	Very low	163 Å²	163	119.3 Å²	119.3	85%	0.853	64%	0.639	S	S	*	*			trans	-65.4	97.4	172.5	-162	93.7	0	0	0	110.2
120	V	30.4	Very low	43.6	Very low	112 Å²	112	116.7 Å²	116.7	68%	0.679	63%	0.632	S	S	*	*			trans	-117.4	103.4	165.6	-176.2	0	0	0	0	108.9	H118 C122	H118-V120 PolarHBondContact O-N 3.45Å; V120-C122 VanDerWaalsContact C-N 3.34Å; V120-C122 VanDerWaalsContact CG1-SG 3.6Å; V120-C122 PolarHBondContact O-N 3.39Å; V120-C122 VanDerWaalsContact O-N 3.08Å
121	V	25.3	Very low	45.9	Very low	113 Å²	113	110 Å²	110	69%	0.685	60%	0.597	S	S	*	*			trans	-74.9	88.1	169.5	178.9	0	0	0	0	107.7	Q123	V121-Q123 HydrophobicContact CG1-CG 4.29Å
122	C	31.1	Very low	48.6	Very low	108 Å²	108	104 Å²	104	73%	0.73	57%	0.567	S	S	*	*			trans	-90.1	103.6	165.4	-80.2	0	0	0	0	109.3	V120	V120-C122 VanDerWaalsContact C-N 3.34Å; V120-C122 VanDerWaalsContact CG1-SG 3.6Å; V120-C122 PolarHBondContact O-N 3.39Å; V120-C122 VanDerWaalsContact O-N 3.08Å
123	Q	31.4	Very low	51.2	Low	187 Å²	187	97.5 Å²	97.5	87%	0.874	54%	0.539	S	S	*	.			trans	-71.5	125.9	166.5	-65.2	165.1	-42.2	0	0	108.6	V121	V121-Q123 HydrophobicContact CG1-CG 4.29Å
124	G	39.6	Very low	53.8	Low	52 Å²	52	91 Å²	91	54%	0.536	51%	0.507	S	S	.	.			trans	127.1	110.3	179.6	0	0	0	0	0	110.5
125	V	50.2	Low	56.5	Low	47 Å²	47	87.8 Å²	87.8	29%	0.285	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-93	127.1	179.8	-176.6	0	0	0	0	110.7	P102 I106	P102-V125 PolarHBondContact O-N 3.03Å; I106-V125 HydrophobicContact CB-CB 4.33Å; I106-V125 HydrophobicContact CB-CG1 3.58Å; I106-V125 HydrophobicContact CD1-CG1 4.41Å; I106-V125 HydrophobicContact CG1-CB 4.4Å; I106-V125 HydrophobicContact CG1-CG1 4.01Å; I106-V125 WeakPolarHBondContact O-CG1 3.43Å
126	E	62.2	Low	59.1	Low	152 Å²	152	82.3 Å²	82.3	71%	0.71	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-75	140.9	-179.5	-64.1	176.8	159	0	0	111.5
127	Y	73.3	Confident	61.6	Low	23 Å²	23	79.5 Å²	79.5	9%	0.09	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-63.4	155.1	170.4	-73.7	-67.9	0	0	0	111.7	I75 W98 L101 P102 I106 D131 Y132 I160	I75-Y127 HydrophobicContact CD1-CD1 4.34Å; I75-Y127 HydrophobicContact CD1-CE1 4.11Å; W98-Y127 VanDerWaalsContact C-OH 3.26Å; W98-Y127 VanDerWaalsContact CA-OH 3.24Å; W98-Y127 WeakPolarHBondContact CA-OH 3.37Å; W98-Y127 AromaticContact CD1-CE2 3.99Å; W98-Y127 HydrophobicContact CD2-CD2 4.49Å; W98-Y127 HydrophobicContact CD2-CE1 4.2Å; W98-Y127 AromaticContact CD2-CE2 3.9Å; W98-Y127 HydrophobicContact CD2-CE2 3.9Å; W98-Y127 AromaticContact CD2-CZ 3.74Å; W98-Y127 AromaticContact CE2-CD2 3.74Å; W98-Y127 AromaticContact CE2-CE2 3.43Å; W98-Y127 VanDerWaalsContact CE2-CE2 3.43Å; W98-Y127 AromaticContact CE2-CZ 3.79Å; W98-Y127 HydrophobicContact CE3-CE1 4.09Å; W98-Y127 HydrophobicContact CG-CE2 4.23Å; W98-Y127 HydrophobicContact CH2-CD1 4.03Å; W98-Y127 HydrophobicContact CH2-CD2 4.04Å; W98-Y127 HydrophobicContact CH2-CE1 4.38Å; W98-Y127 HydrophobicContact CH2-CE2 4.39Å; W98-Y127 AromaticContact CH2-CG 3.86Å; W98-Y127 HydrophobicContact CH2-CG 3.86Å; W98-Y127 HydrophobicContact CZ2-CD1 4.3Å; W98-Y127 AromaticContact CZ2-CD2 3.49Å; W98-Y127 HydrophobicContact CZ2-CD2 3.49Å; W98-Y127 VanDerWaalsContact CZ2-CD2 3.49Å; W98-Y127 HydrophobicContact CZ2-CE1 4.48Å; W98-Y127 AromaticContact CZ2-CE2 3.72Å; W98-Y127 HydrophobicContact CZ2-CE2 3.72Å; W98-Y127 AromaticContact CZ2-CG 3.82Å; W98-Y127 HydrophobicContact CZ2-CG 3.82Å; W98-Y127 HydrophobicContact CZ3-CD1 4.15Å; W98-Y127 HydrophobicContact CZ3-CE1 4.19Å; W98-Y127 HydrophobicContact CZ3-CG 4.43Å; W98-Y127 AromaticContact NE1-CE2 3.51Å; W98-Y127 PolarHBondContact O-OH 2.84Å; L101-Y127 HydrophobicContact CB-CE1 4.11Å; L101-Y127 WeakPolarHBondContact CB-OH 3.27Å; L101-Y127 HydrophobicContact CD1-CE1 3.98Å; P102-Y127 WeakPolarHBondContact CD-OH 3.22Å; P102-Y127 HydrophobicContact CG-CE2 3.87Å; P102-Y127 WeakPolarHBondContact CG-OH 3.4Å; I106-Y127 HydrophobicContact CD1-CD1 4.45Å; Y127-D131 HydrophobicContact CD1-CB 3.76Å; Y127-D131 HydrophobicContact CG-CB 4.41Å; Y127-Y132 HydrophobicContact CG-CE2 4.46Å; Y127-I160 WeakPolarHBondContact O-CD1 3.44Å
128	N	76.3	Confident	63.9	Low	44 Å²	44	69.9 Å²	69.9	24%	0.235	38%	0.381	C	S	.	.			trans	-101.8	176.4	171.9	76.1	32.7	0	0	0	112.4	V68 D130 D131 Y132	V68-N128 WeakPolarHBondContact CG1-ND2 3.36Å; N128-D130 VanDerWaalsContact C-N 3.32Å; N128-D130 PolarHBondContact O-N 3.42Å; N128-D130 VanDerWaalsContact OD1-CA 3.3Å; N128-D130 WeakPolarHBondContact OD1-CA 3.26Å; N128-D130 WeakPolarHBondContact OD1-CB 3.23Å; N128-D130 PolarHBondContact OD1-N 3.38Å; N128-D131 VanDerWaalsContact CG-OD2 3.22Å; N128-D131 PolarHBondContact N-OD2 3.25Å; N128-D131 WeakPolarHBondContact O-CB 3.37Å; N128-D131 PolarHBondContact O-N 3.15Å; N128-D131 PolarHBondContact OD1-N 3.28Å; N128-D131 PolarHBondContact OD1-OD2 3.31Å; N128-Y132 WeakPolarHBondContact O-CD2 3.5Å; N128-Y132 PolarHBondContact O-N 2.83Å
129	L	84.6	Confident	66.5	Low	53 Å²	53	61.5 Å²	61.5	28%	0.277	34%	0.342	S	S	.	.	H	α-helix	trans	-57.3	-38.9	176.5	173.4	63.5	0	0	0	113.9	N133 M155 I160 T166	L129-N133 WeakPolarHBondContact O-CB 3.37Å; L129-N133 PolarHBondContact O-N 2.92Å; L129-N133 PolarHBondContact O-ND2 3.42Å; L129-M155 HydrophobicContact CD1-CE 3.75Å; L129-I160 HydrophobicContact CB-CG2 3.95Å; L129-I160 HydrophobicContact CD1-CG2 4.26Å; L129-T166 WeakPolarHBondContact CD1-OG1 3.38Å
130	D	83.7	Confident	69.4	Low	93 Å²	93	57.1 Å²	57.1	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-70.8	-34.5	179.8	-69.1	-32.8	0	0	0	111.7	F72 N128 N133 A134	F72-D130 HydrophobicContact CD2-CB 3.74Å; F72-D130 HydrophobicContact CE2-CB 3.99Å; N128-D130 VanDerWaalsContact C-N 3.32Å; N128-D130 PolarHBondContact O-N 3.42Å; N128-D130 VanDerWaalsContact OD1-CA 3.3Å; N128-D130 WeakPolarHBondContact OD1-CA 3.26Å; N128-D130 WeakPolarHBondContact OD1-CB 3.23Å; N128-D130 PolarHBondContact OD1-N 3.38Å; D130-N133 PolarHBondContact O-N 3.48Å; D130-A134 VanDerWaalsContact O-CB 3.31Å; D130-A134 WeakPolarHBondContact O-CB 3.33Å; D130-A134 PolarHBondContact O-N 2.82Å
131	D	84.2	Confident	71.6	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-46	174.6	-60.7	-40.1	0	0	0	111.3	F72 I75 W98 Y127 N128 A134 R135	F72-D131 WeakPolarHBondContact CA-OD1 3.45Å; F72-D131 PolarHBondContact N-OD1 2.86Å; I75-D131 HydrophobicContact CD1-CB 3.62Å; W98-D131 HydrophobicContact CZ3-CB 4.46Å; Y127-D131 HydrophobicContact CD1-CB 3.76Å; Y127-D131 HydrophobicContact CG-CB 4.41Å; N128-D131 VanDerWaalsContact CG-OD2 3.22Å; N128-D131 PolarHBondContact N-OD2 3.25Å; N128-D131 WeakPolarHBondContact O-CB 3.37Å; N128-D131 PolarHBondContact O-N 3.15Å; N128-D131 PolarHBondContact OD1-N 3.28Å; N128-D131 PolarHBondContact OD1-OD2 3.31Å; D131-A134 PolarHBondContact O-N 3.3Å; D131-R135 PolarHBondContact O-N 2.84Å
132	Y	87.3	Confident	74.2	Confident	11 Å²	11	50.7 Å²	50.7	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-43.7	173.1	-87	-83	0	0	0	111.8	W98 Y127 N128 A134 R135 L136 F151 E154 M155 A158 I160	W98-Y132 HydrophobicContact CH2-CD1 4.12Å; W98-Y132 HydrophobicContact CH2-CD2 4.25Å; W98-Y132 HydrophobicContact CH2-CE1 4.16Å; W98-Y132 HydrophobicContact CH2-CE2 4.29Å; W98-Y132 HydrophobicContact CH2-CG 4.16Å; W98-Y132 HydrophobicContact CZ2-CD1 4.37Å; W98-Y132 AromaticContact CZ2-CE1 3.95Å; W98-Y132 HydrophobicContact CZ2-CE1 3.95Å; W98-Y132 HydrophobicContact CZ2-CE2 4.25Å; W98-Y132 AromaticContact CZ2-CZ 3.87Å; Y127-Y132 HydrophobicContact CG-CE2 4.46Å; N128-Y132 WeakPolarHBondContact O-CD2 3.5Å; N128-Y132 PolarHBondContact O-N 2.83Å; Y132-A134 VanDerWaalsContact C-N 3.34Å; Y132-A134 PolarHBondContact O-N 2.83Å; Y132-R135 PolarHBondContact O-N 3.39Å; Y132-L136 PolarHBondContact O-N 3.47Å; Y132-F151 HydrophobicContact CD1-CE1 4.14Å; Y132-F151 AromaticContact CD1-CE2 3.96Å; Y132-F151 HydrophobicContact CD1-CE2 3.96Å; Y132-F151 AromaticContact CD1-CZ 3.55Å; Y132-F151 HydrophobicContact CD1-CZ 3.55Å; Y132-F151 HydrophobicContact CG-CZ 4.3Å; Y132-F151 WeakPolarHBondContact O-CZ 3.16Å; Y132-E154 HydrophobicContact CE1-CG 4.23Å; Y132-E154 WeakPolarHBondContact CE1-OE1 3.25Å; Y132-E154 PolarHBondContact OH-OE1 2.88Å; Y132-M155 HydrophobicContact CD1-CG 3.58Å; Y132-M155 HydrophobicContact CD1-SD 4.43Å; Y132-M155 HydrophobicContact CD2-CG 4.4Å; Y132-M155 HydrophobicContact CE1-CG 3.94Å; Y132-M155 HydrophobicContact CG-CG 3.85Å; Y132-M155 HydrophobicContact CG-SD 4.43Å; Y132-A158 HydrophobicContact CE2-CB 4.31Å; Y132-I160 HydrophobicContact CD2-CD1 3.47Å; Y132-I160 VanDerWaalsContact CD2-CD1 3.47Å; Y132-I160 HydrophobicContact CE2-CD1 3.34Å
133	N	89.2	Confident	76.5	Confident	12 Å²	12	48 Å²	48	6%	0.064	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175.5	-70.8	-32.3	0	0	0	112	L129 D130 L136 V137 T166 L169	L129-N133 WeakPolarHBondContact O-CB 3.37Å; L129-N133 PolarHBondContact O-N 2.92Å; L129-N133 PolarHBondContact O-ND2 3.42Å; D130-N133 PolarHBondContact O-N 3.48Å; N133-L136 PolarHBondContact O-N 3.42Å; N133-V137 WeakPolarHBondContact O-CG2 3.12Å; N133-V137 PolarHBondContact O-N 3.41Å; N133-T166 WeakPolarHBondContact OD1-CA 3.43Å; N133-T166 WeakPolarHBondContact OD1-CB 3.35Å; N133-T166 PolarHBondContact OD1-OG1 3.19Å; N133-L169 HydrophobicContact CB-CD1 3.99Å
134	A	86.4	Confident	78.9	Confident	5 Å²	5	41.7 Å²	41.7	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-40.4	174.4	0	0	0	0	0	111.6	F72 I75 D130 D131 Y132 L136 V137 V138	F72-A134 HydrophobicContact CD2-CB 4.05Å; F72-A134 HydrophobicContact CE2-CB 3.85Å; I75-A134 HydrophobicContact CB-CB 4.31Å; I75-A134 HydrophobicContact CG2-CB 3.61Å; D130-A134 VanDerWaalsContact O-CB 3.31Å; D130-A134 WeakPolarHBondContact O-CB 3.33Å; D130-A134 PolarHBondContact O-N 2.82Å; D131-A134 PolarHBondContact O-N 3.3Å; Y132-A134 VanDerWaalsContact C-N 3.34Å; Y132-A134 PolarHBondContact O-N 2.83Å; A134-L136 PolarHBondContact O-N 3.24Å; A134-V137 PolarHBondContact O-N 3.05Å; A134-V137 VanDerWaalsContact O-N 3.16Å; A134-V138 WeakPolarHBondContact O-CG2 3.22Å; A134-V138 PolarHBondContact O-N 3.39Å
135	R	89.3	Confident	80.9	Confident	50 Å²	50	45.7 Å²	45.7	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-38.1	173.5	174.7	168.6	159.7	-149.7	-12.4	112.8	L94 W98 D131 Y132 A139 F151 E154	L94-R135 HydrophobicContact CD2-CG 4.41Å; W98-R135 VanDerWaalsContact CE2-NH1 3.28Å; W98-R135 HydrophobicContact CE3-CB 4.36Å; W98-R135 HydrophobicContact CH2-CB 4.28Å; W98-R135 HydrophobicContact CZ3-CB 3.76Å; W98-R135 HydrophobicContact CZ3-CG 4.29Å; D131-R135 PolarHBondContact O-N 2.84Å; Y132-R135 PolarHBondContact O-N 3.39Å; R135-A139 VanDerWaalsContact O-CB 3.32Å; R135-A139 WeakPolarHBondContact O-CB 3.42Å; R135-A139 PolarHBondContact O-N 2.91Å; R135-F151 HydrophobicContact CG-CE2 4.44Å; R135-E154 IonicContact CZ-OE1 3.06Å; R135-E154 IonicContact CZ-OE2 3.69Å; R135-E154 IonicContact NH1-OE1 3.09Å; R135-E154 PolarHBondContact NH1-OE1 2.93Å; R135-E154 IonicContact NH1-OE2 2.85Å; R135-E154 PolarHBondContact NH1-OE2 3.18Å; R135-E154 IonicContact NH2-OE1 3.88Å; R135-E154 IonicContact NH2-OE2 3.6Å; R135-E154 PolarHBondContact NH2-OE2 3.03Å
136	L	88.7	Confident	82.5	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-44.2	170.9	-70.7	-178.9	0	0	0	112	Y132 N133 A134 A139 K140 I146 F151 T166 L169 L170	Y132-L136 PolarHBondContact O-N 3.47Å; N133-L136 PolarHBondContact O-N 3.42Å; A134-L136 PolarHBondContact O-N 3.24Å; L136-A139 PolarHBondContact O-N 2.72Å; L136-K140 WeakPolarHBondContact O-CB 3.07Å; L136-K140 PolarHBondContact O-N 3.5Å; L136-I146 HydrophobicContact CD2-CD1 3.76Å; L136-I146 HydrophobicContact CD2-CG2 4.42Å; L136-F151 HydrophobicContact CD1-CD1 4.24Å; L136-F151 HydrophobicContact CD1-CE1 3.64Å; L136-F151 HydrophobicContact CD1-CZ 4.04Å; L136-F151 HydrophobicContact CD2-CD1 3.87Å; L136-F151 HydrophobicContact CD2-CD2 3.89Å; L136-F151 HydrophobicContact CD2-CE1 3.64Å; L136-F151 HydrophobicContact CD2-CE2 3.67Å; L136-F151 HydrophobicContact CD2-CG 3.98Å; L136-F151 HydrophobicContact CD2-CZ 3.52Å; L136-F151 HydrophobicContact CG-CD1 4.26Å; L136-F151 HydrophobicContact CG-CE1 3.56Å; L136-F151 HydrophobicContact CG-CE2 4.05Å; L136-F151 HydrophobicContact CG-CZ 3.43Å; L136-F151 VanDerWaalsContact CG-CZ 3.43Å; L136-T166 HydrophobicContact CD1-CG2 4.06Å; L136-L169 HydrophobicContact CB-CB 4.09Å; L136-L169 HydrophobicContact CB-CD1 4.12Å; L136-L169 HydrophobicContact CD1-CB 3.72Å; L136-L169 HydrophobicContact CD1-CD1 4.32Å; L136-L170 HydrophobicContact CD1-CD2 4.01Å; L136-L170 HydrophobicContact CD1-CG 4Å; L136-L170 HydrophobicContact CD2-CD2 3.8Å
137	V	86.8	Confident	83.7	Confident	60 Å²	60	40 Å²	40	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-60.6	-49.2	177	172.5	0	0	0	0	111	N133 A134 A139 K140 E141 L169	N133-V137 WeakPolarHBondContact O-CG2 3.12Å; N133-V137 PolarHBondContact O-N 3.41Å; A134-V137 PolarHBondContact O-N 3.05Å; A134-V137 VanDerWaalsContact O-N 3.16Å; V137-A139 PolarHBondContact O-N 2.83Å; V137-K140 WeakPolarHBondContact O-CB 3.19Å; V137-K140 PolarHBondContact O-N 2.73Å; V137-E141 HydrophobicContact CG1-CG 4.48Å; V137-E141 WeakPolarHBondContact O-CG 3.29Å; V137-E141 PolarHBondContact O-N 3.32Å; V137-L169 HydrophobicContact CG2-CD1 4.02Å; V137-L169 HydrophobicContact CG2-CD2 3.68Å
138	V	86.1	Confident	84.4	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-40.6	-179.9	173.3	0	0	0	0	111.8	I75 C78 M91 L94 A134 E141 N142	I75-V138 WeakPolarHBondContact O-CG2 3.44Å; C78-V138 HydrophobicContact CB-CG1 4.17Å; C78-V138 WeakPolarHBondContact O-CG1 3.31Å; M91-V138 HydrophobicContact SD-CG1 4.42Å; L94-V138 HydrophobicContact CD1-CG1 4.29Å; L94-V138 HydrophobicContact CD2-CB 4.38Å; L94-V138 HydrophobicContact CD2-CG1 3.81Å; L94-V138 HydrophobicContact CG-CG1 4.45Å; A134-V138 WeakPolarHBondContact O-CG2 3.22Å; A134-V138 PolarHBondContact O-N 3.39Å; V138-E141 PolarHBondContact O-N 2.7Å; V138-N142 WeakPolarHBondContact CG1-ND2 3.33Å; V138-N142 WeakPolarHBondContact O-CB 3.34Å; V138-N142 PolarHBondContact O-N 2.69Å; V138-N142 PolarHBondContact O-ND2 3.37Å; V138-N142 VanDerWaalsContact O-ND2 3.1Å
139	A	86.5	Confident	84.9	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-40.2	175.7	0	0	0	0	0	112.1	R135 L136 V137 N142 G143 V144 I146 H173	R135-A139 VanDerWaalsContact O-CB 3.32Å; R135-A139 WeakPolarHBondContact O-CB 3.42Å; R135-A139 PolarHBondContact O-N 2.91Å; L136-A139 PolarHBondContact O-N 2.72Å; V137-A139 PolarHBondContact O-N 2.83Å; A139-N142 CarbonylContact O-C 3.51Å; A139-N142 PolarHBondContact O-N 3.36Å; A139-G143 PolarHBondContact O-N 3.06Å; A139-V144 HydrophobicContact CB-CB 4.39Å; A139-V144 PolarHBondContact O-N 2.85Å; A139-I146 HydrophobicContact CB-CD1 3.37Å; A139-I146 HydrophobicContact CB-CG1 4.13Å; A139-H173 VanDerWaalsContact CB-CE1 3.49Å; A139-H173 WeakPolarHBondContact CB-CE1 3.43Å; A139-H173 PolarHBondContact O-CE1 2.84Å
140	K	83.9	Confident	85.1	Confident	71 Å²	71	45.7 Å²	45.7	31%	0.309	24%	0.244	S	C	.	.	H	α-helix	trans	-61.7	-46.9	175.2	-170.1	-170	177.2	-169.2	0	112	L136 V137 N142 G143 H173 Q176	L136-K140 WeakPolarHBondContact O-CB 3.07Å; L136-K140 PolarHBondContact O-N 3.5Å; V137-K140 WeakPolarHBondContact O-CB 3.19Å; V137-K140 PolarHBondContact O-N 2.73Å; K140-N142 VanDerWaalsContact C-N 3.29Å; K140-N142 PolarHBondContact O-N 2.92Å; K140-G143 PolarHBondContact O-N 2.93Å; K140-H173 WeakPolarHBondContact CA-CE1 3.38Å; K140-H173 PolarHBondContact N-CE1 2.79Å; K140-Q176 PolarHBondContact O-NE2 2.88Å; K140-Q176 VanDerWaalsContact O-NE2 3.13Å
141	E	78.5	Confident	85.4	Confident	77 Å²	77	41.5 Å²	41.5	36%	0.36	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-32.3	177	-72.5	-174.2	137.4	0	0	113.2	G79 S80 V137 V138	G79-E141 WeakPolarHBondContact CA-OE2 3.27Å; S80-E141 WeakPolarHBondContact CB-OE1 3.25Å; S80-E141 PolarHBondContact N-OE2 3.5Å; S80-E141 PolarHBondContact OG-OE1 3.47Å; V137-E141 HydrophobicContact CG1-CG 4.48Å; V137-E141 WeakPolarHBondContact O-CG 3.29Å; V137-E141 PolarHBondContact O-N 3.32Å; V138-E141 PolarHBondContact O-N 2.7Å
142	N	79.8	Confident	85.7	Confident	13 Å²	13	42.6 Å²	42.6	7%	0.07	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	0.4	179	-70.3	-39.4	0	0	0	113.8	C78 P87 R90 M91 V138 A139 K140 V144	C78-N142 PolarHBondContact O-ND2 2.91Å; P87-N142 HydrophobicContact CB-CB 4.13Å; R90-N142 WeakPolarHBondContact CD-OD1 3.35Å; R90-N142 PolarHBondContact NH1-OD1 2.93Å; M91-N142 HydrophobicContact CG-CB 4.05Å; M91-N142 HydrophobicContact SD-CB 3.86Å; V138-N142 WeakPolarHBondContact CG1-ND2 3.33Å; V138-N142 WeakPolarHBondContact O-CB 3.34Å; V138-N142 PolarHBondContact O-N 2.69Å; V138-N142 PolarHBondContact O-ND2 3.37Å; V138-N142 VanDerWaalsContact O-ND2 3.1Å; A139-N142 CarbonylContact O-C 3.51Å; A139-N142 PolarHBondContact O-N 3.36Å; K140-N142 VanDerWaalsContact C-N 3.29Å; K140-N142 PolarHBondContact O-N 2.92Å; N142-V144 VanDerWaalsContact C-N 3.35Å; N142-V144 HydrophobicContact CB-CG2 4.31Å; N142-V144 PolarHBondContact O-N 3.34Å
143	G	78.1	Confident	85.8	Confident	53 Å²	53	44.6 Å²	44.6	55%	0.546	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	28.7	177.7	0	0	0	0	0	114.4	A139 K140	A139-G143 PolarHBondContact O-N 3.06Å; K140-G143 PolarHBondContact O-N 2.93Å
144	V	82.6	Confident	85.8	Confident	54 Å²	54	46.8 Å²	46.8	33%	0.327	25%	0.253	S	S	.	.			trans	-92.5	115.7	-179.6	178.9	0	0	0	0	110.3	M91 A139 N142 I146 H173	M91-V144 HydrophobicContact CE-CB 4.41Å; M91-V144 HydrophobicContact CE-CG1 4.4Å; M91-V144 HydrophobicContact CE-CG2 4.02Å; M91-V144 HydrophobicContact CG-CG2 3.69Å; M91-V144 HydrophobicContact SD-CG2 3.85Å; A139-V144 HydrophobicContact CB-CB 4.39Å; A139-V144 PolarHBondContact O-N 2.85Å; N142-V144 VanDerWaalsContact C-N 3.35Å; N142-V144 HydrophobicContact CB-CG2 4.31Å; N142-V144 PolarHBondContact O-N 3.34Å; V144-I146 PolarHBondContact O-N 3.41Å; V144-H173 PolarHBondContact O-CE1 3.3Å; V144-H173 PolarHBondContact O-NE2 3.17Å
145	K	81.8	Confident	85.9	Confident	135 Å²	135	46.5 Å²	46.5	59%	0.587	25%	0.251	S	S	*	.			trans	-59.9	127.4	173.8	180	160.7	-162.3	128.6	0	111.7	H173 D177	K145-H173 WeakPolarHBondContact CA-NE2 3.47Å; K145-H173 PolarHBondContact N-NE2 3.11Å; K145-H173 VanDerWaalsContact N-NE2 3.2Å; K145-D177 WeakPolarHBondContact CD-OD2 3.13Å; K145-D177 WeakPolarHBondContact CE-OD2 3.49Å; K145-D177 WeakPolarHBondContact CG-OD2 3.26Å; K145-D177 IonicContact NZ-OD2 2.89Å; K145-D177 PolarHBondContact NZ-OD2 3.14Å
146	I	82.8	Confident	85.8	Confident	31 Å²	31	47.5 Å²	47.5	16%	0.159	27%	0.269	C	S	.	.			trans	-114.7	136	175	-70	-180	0	0	0	108.1	L136 A139 V144 F151 H173	L136-I146 HydrophobicContact CD2-CD1 3.76Å; L136-I146 HydrophobicContact CD2-CG2 4.42Å; A139-I146 HydrophobicContact CB-CD1 3.37Å; A139-I146 HydrophobicContact CB-CG1 4.13Å; V144-I146 PolarHBondContact O-N 3.41Å; I146-F151 HydrophobicContact CG2-CB 3.8Å; I146-F151 HydrophobicContact CG2-CD2 4.11Å; I146-F151 HydrophobicContact CG2-CG 4.18Å; I146-H173 PolarHBondContact N-NE2 3.47Å
147	S	87.5	Confident	85.7	Confident	49 Å²	49	55.6 Å²	55.6	34%	0.343	31%	0.305	S	S	.	.			trans	-79.7	117.1	166.7	169.9	0	0	0	0	109.4	D149 Q150 F151	S147-D149 VanDerWaalsContact C-N 3.31Å; S147-D149 PolarHBondContact O-N 3.12Å; S147-Q150 PolarHBondContact O-N 3.37Å; S147-Q150 PolarHBondContact OG-N 2.98Å; S147-F151 PolarHBondContact O-N 2.93Å
148	S	87.6	Confident	85.4	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-54.3	-45.1	178.7	-52.3	0	0	0	0	112.4	F151 L152 C174 E182	S148-F151 PolarHBondContact O-N 2.8Å; S148-L152 WeakPolarHBondContact O-CB 3.44Å; S148-L152 WeakPolarHBondContact O-CG 3.47Å; S148-L152 PolarHBondContact O-N 3.17Å; S148-C174 PolarHBondContact OG-SG 3.33Å; S148-C174 VanDerWaalsContact OG-SG 3.42Å; S148-E182 WeakPolarHBondContact CB-OE1 3.13Å; S148-E182 PolarHBondContact OG-OE1 3.39Å
149	D	87.7	Confident	85.2	Confident	89 Å²	89	57.1 Å²	57.1	48%	0.476	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-39.6	179.5	-67.6	-38.2	0	0	0	112.7	S147 S153 R185	S147-D149 VanDerWaalsContact C-N 3.31Å; S147-D149 PolarHBondContact O-N 3.12Å; D149-S153 WeakPolarHBondContact O-CB 3.23Å; D149-S153 PolarHBondContact O-N 2.92Å; D149-R185 IonicContact OD1-CZ 3.55Å; D149-R185 IonicContact OD1-NH1 2.68Å; D149-R185 IonicContact OD1-NH2 3.52Å; D149-R185 PolarHBondContact OD1-NH2 3.48Å; D149-R185 IonicContact OD2-NH2 2.71Å
150	Q	88.9	Confident	85.1	Confident	145 Å²	145	58.2 Å²	58.2	68%	0.678	34%	0.336	S	S	*	.	H	α-helix	trans	-65.2	-42.1	175.5	-68.3	179.1	-7.4	0	0	111.2	S147 S153 E154	S147-Q150 PolarHBondContact O-N 3.37Å; S147-Q150 PolarHBondContact OG-N 2.98Å; Q150-S153 PolarHBondContact O-N 3.3Å; Q150-E154 WeakPolarHBondContact O-CB 3.45Å; Q150-E154 PolarHBondContact O-N 3.31Å
151	F	90	Very high	85.2	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.018	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-44.1	179.4	-167.2	-92.6	0	0	0	112.4	Y132 R135 L136 I146 S147 S148 S153 E154 M155 T166 L170	Y132-F151 HydrophobicContact CD1-CE1 4.14Å; Y132-F151 AromaticContact CD1-CE2 3.96Å; Y132-F151 HydrophobicContact CD1-CE2 3.96Å; Y132-F151 AromaticContact CD1-CZ 3.55Å; Y132-F151 HydrophobicContact CD1-CZ 3.55Å; Y132-F151 HydrophobicContact CG-CZ 4.3Å; Y132-F151 WeakPolarHBondContact O-CZ 3.16Å; R135-F151 HydrophobicContact CG-CE2 4.44Å; L136-F151 HydrophobicContact CD1-CD1 4.24Å; L136-F151 HydrophobicContact CD1-CE1 3.64Å; L136-F151 HydrophobicContact CD1-CZ 4.04Å; L136-F151 HydrophobicContact CD2-CD1 3.87Å; L136-F151 HydrophobicContact CD2-CD2 3.89Å; L136-F151 HydrophobicContact CD2-CE1 3.64Å; L136-F151 HydrophobicContact CD2-CE2 3.67Å; L136-F151 HydrophobicContact CD2-CG 3.98Å; L136-F151 HydrophobicContact CD2-CZ 3.52Å; L136-F151 HydrophobicContact CG-CD1 4.26Å; L136-F151 HydrophobicContact CG-CE1 3.56Å; L136-F151 HydrophobicContact CG-CE2 4.05Å; L136-F151 HydrophobicContact CG-CZ 3.43Å; L136-F151 VanDerWaalsContact CG-CZ 3.43Å; I146-F151 HydrophobicContact CG2-CB 3.8Å; I146-F151 HydrophobicContact CG2-CD2 4.11Å; I146-F151 HydrophobicContact CG2-CG 4.18Å; S147-F151 PolarHBondContact O-N 2.93Å; S148-F151 PolarHBondContact O-N 2.8Å; F151-S153 VanDerWaalsContact C-N 3.32Å; F151-S153 PolarHBondContact O-N 3.42Å; F151-E154 WeakPolarHBondContact O-CB 3.48Å; F151-E154 PolarHBondContact O-N 2.97Å; F151-M155 HydrophobicContact CD1-CG 4.34Å; F151-M155 HydrophobicContact CD1-SD 3.96Å; F151-M155 HydrophobicContact CE1-CG 4.07Å; F151-M155 HydrophobicContact CE1-SD 3.53Å; F151-M155 VanDerWaalsContact CE1-SD 3.53Å; F151-M155 HydrophobicContact CZ-SD 4.47Å; F151-M155 PolarHBondContact O-N 3.19Å; F151-T166 HydrophobicContact CE1-CG2 4.4Å; F151-L170 HydrophobicContact CD1-CD2 4.26Å
152	L	90.4	Very high	85.7	Confident	25 Å²	25	60 Å²	60	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-36.5	174.2	-67.7	169.1	0	0	0	111.5	S148 A156 P162 Y167 L170 L186	S148-L152 WeakPolarHBondContact O-CB 3.44Å; S148-L152 WeakPolarHBondContact O-CG 3.47Å; S148-L152 PolarHBondContact O-N 3.17Å; L152-A156 VanDerWaalsContact O-CB 3.3Å; L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.31Å; L152-P162 HydrophobicContact CD2-CB 3.78Å; L152-P162 HydrophobicContact CD2-CG 3.41Å; L152-P162 VanDerWaalsContact CD2-CG 3.41Å; L152-Y167 HydrophobicContact CD1-CE1 4.41Å; L152-Y167 HydrophobicContact CD2-CE1 4.14Å; L152-L170 HydrophobicContact CD1-CD1 4.12Å; L152-L170 HydrophobicContact CD2-CD1 3.76Å; L152-L170 HydrophobicContact CG-CD1 3.85Å; L152-L186 HydrophobicContact CD1-CD2 4.22Å
153	S	89.9	Confident	86	Confident	52 Å²	52	60.6 Å²	60.6	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-66.6	-36.3	172.2	-174.5	0	0	0	0	112.4	D149 Q150 F151 K157	D149-S153 WeakPolarHBondContact O-CB 3.23Å; D149-S153 PolarHBondContact O-N 2.92Å; Q150-S153 PolarHBondContact O-N 3.3Å; F151-S153 VanDerWaalsContact C-N 3.32Å; F151-S153 PolarHBondContact O-N 3.42Å; S153-K157 WeakPolarHBondContact O-CB 3.48Å; S153-K157 VanDerWaalsContact O-CG 3.25Å; S153-K157 WeakPolarHBondContact O-CG 3.36Å; S153-K157 PolarHBondContact O-N 3.09Å
154	E	87.7	Confident	86.5	Confident	58 Å²	58	60.5 Å²	60.5	27%	0.271	34%	0.337	S	S	.	.	H	α-helix	trans	-65.1	-49.2	175.4	-159.7	-168.4	137	0	0	111.2	Y132 R135 Q150 F151 A156 K157 A158	Y132-E154 HydrophobicContact CE1-CG 4.23Å; Y132-E154 WeakPolarHBondContact CE1-OE1 3.25Å; Y132-E154 PolarHBondContact OH-OE1 2.88Å; R135-E154 IonicContact CZ-OE1 3.06Å; R135-E154 IonicContact CZ-OE2 3.69Å; R135-E154 IonicContact NH1-OE1 3.09Å; R135-E154 PolarHBondContact NH1-OE1 2.93Å; R135-E154 IonicContact NH1-OE2 2.85Å; R135-E154 PolarHBondContact NH1-OE2 3.18Å; R135-E154 IonicContact NH2-OE1 3.88Å; R135-E154 IonicContact NH2-OE2 3.6Å; R135-E154 PolarHBondContact NH2-OE2 3.03Å; Q150-E154 WeakPolarHBondContact O-CB 3.45Å; Q150-E154 PolarHBondContact O-N 3.31Å; F151-E154 WeakPolarHBondContact O-CB 3.48Å; F151-E154 PolarHBondContact O-N 2.97Å; E154-A156 VanDerWaalsContact C-N 3.33Å; E154-A156 PolarHBondContact O-N 3.45Å; E154-K157 PolarHBondContact O-N 3.37Å; E154-A158 PolarHBondContact O-N 2.81Å
155	M	88.9	Confident	86.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-42.8	174.6	-69.3	-176.4	71.4	0	0	112.2	L129 Y132 F151 K157 A158 G159 I160 P162 T166	L129-M155 HydrophobicContact CD1-CE 3.75Å; Y132-M155 HydrophobicContact CD1-CG 3.58Å; Y132-M155 HydrophobicContact CD1-SD 4.43Å; Y132-M155 HydrophobicContact CD2-CG 4.4Å; Y132-M155 HydrophobicContact CE1-CG 3.94Å; Y132-M155 HydrophobicContact CG-CG 3.85Å; Y132-M155 HydrophobicContact CG-SD 4.43Å; F151-M155 HydrophobicContact CD1-CG 4.34Å; F151-M155 HydrophobicContact CD1-SD 3.96Å; F151-M155 HydrophobicContact CE1-CG 4.07Å; F151-M155 HydrophobicContact CE1-SD 3.53Å; F151-M155 VanDerWaalsContact CE1-SD 3.53Å; F151-M155 HydrophobicContact CZ-SD 4.47Å; F151-M155 PolarHBondContact O-N 3.19Å; M155-K157 PolarHBondContact O-N 2.87Å; M155-A158 CarbonylContact O-C 3.43Å; M155-A158 PolarHBondContact O-N 3.4Å; M155-A158 VanDerWaalsContact O-N 3.15Å; M155-G159 PolarHBondContact O-N 2.87Å; M155-G159 VanDerWaalsContact O-N 3.13Å; M155-I160 CarbonylContact C-O 3.57Å; M155-I160 HydrophobicContact CE-CB 4.34Å; M155-I160 HydrophobicContact CE-CG2 3.68Å; M155-I160 PolarHBondContact O-N 3.09Å; M155-P162 HydrophobicContact CE-CB 4.47Å; M155-P162 HydrophobicContact CE-CG 4.36Å; M155-P162 HydrophobicContact SD-CG 4.33Å; M155-T166 HydrophobicContact CE-CG2 4.15Å; M155-T166 HydrophobicContact SD-CG2 3.68Å
156	A	87.3	Confident	87.1	Confident	70 Å²	70	54.4 Å²	54.4	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-64.5	-36.9	177.6	0	0	0	0	0	112.7	L152 E154 A158 G159	L152-A156 VanDerWaalsContact O-CB 3.3Å; L152-A156 WeakPolarHBondContact O-CB 3.49Å; L152-A156 PolarHBondContact O-N 3.31Å; E154-A156 VanDerWaalsContact C-N 3.33Å; E154-A156 PolarHBondContact O-N 3.45Å; A156-A158 VanDerWaalsContact C-N 3.3Å; A156-G159 PolarHBondContact O-N 2.88Å; A156-G159 VanDerWaalsContact O-N 3.17Å
157	K	86.5	Confident	87.5	Confident	173 Å²	173	53.4 Å²	53.4	75%	0.752	31%	0.306	S	S	*	.	H	α-helix	trans	-67.6	-30	173.1	-74.8	167.2	-176	171	0	112.7	S153 E154 M155 G159	S153-K157 WeakPolarHBondContact O-CB 3.48Å; S153-K157 VanDerWaalsContact O-CG 3.25Å; S153-K157 WeakPolarHBondContact O-CG 3.36Å; S153-K157 PolarHBondContact O-N 3.09Å; E154-K157 PolarHBondContact O-N 3.37Å; M155-K157 PolarHBondContact O-N 2.87Å; K157-G159 VanDerWaalsContact C-N 3.28Å
158	A	81.2	Confident	87.6	Confident	24 Å²	24	51.2 Å²	51.2	20%	0.198	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.5	172.5	0	0	0	0	0	113.6	Y132 E154 M155 A156 I160	Y132-A158 HydrophobicContact CE2-CB 4.31Å; E154-A158 PolarHBondContact O-N 2.81Å; M155-A158 CarbonylContact O-C 3.43Å; M155-A158 PolarHBondContact O-N 3.4Å; M155-A158 VanDerWaalsContact O-N 3.15Å; A156-A158 VanDerWaalsContact C-N 3.3Å; A158-I160 VanDerWaalsContact C-N 3.3Å; A158-I160 HydrophobicContact CB-CD1 3.87Å; A158-I160 HydrophobicContact CB-CG1 4.22Å; A158-I160 PolarHBondContact O-N 3.37Å
159	G	82	Confident	87.7	Confident	69 Å²	69	51.9 Å²	51.9	71%	0.711	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	14.6	-179.9	0	0	0	0	0	115.3	M155 A156 K157	M155-G159 PolarHBondContact O-N 2.87Å; M155-G159 VanDerWaalsContact O-N 3.13Å; A156-G159 PolarHBondContact O-N 2.88Å; A156-G159 VanDerWaalsContact O-N 3.17Å; K157-G159 VanDerWaalsContact C-N 3.28Å
160	I	84.6	Confident	87.8	Confident	25 Å²	25	47.7 Å²	47.7	13%	0.128	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-102.1	122.3	-173.7	-56	162.9	0	0	0	110	Y127 L129 Y132 M155 A158 P162	Y127-I160 WeakPolarHBondContact O-CD1 3.44Å; L129-I160 HydrophobicContact CB-CG2 3.95Å; L129-I160 HydrophobicContact CD1-CG2 4.26Å; Y132-I160 HydrophobicContact CD2-CD1 3.47Å; Y132-I160 VanDerWaalsContact CD2-CD1 3.47Å; Y132-I160 HydrophobicContact CE2-CD1 3.34Å; M155-I160 CarbonylContact C-O 3.57Å; M155-I160 HydrophobicContact CE-CB 4.34Å; M155-I160 HydrophobicContact CE-CG2 3.68Å; M155-I160 PolarHBondContact O-N 3.09Å; A158-I160 VanDerWaalsContact C-N 3.3Å; A158-I160 HydrophobicContact CB-CD1 3.87Å; A158-I160 HydrophobicContact CB-CG1 4.22Å; A158-I160 PolarHBondContact O-N 3.37Å; I160-P162 WeakPolarHBondContact O-CD 3.14Å
161	E	85.9	Confident	87.9	Confident	164 Å²	164	40.8 Å²	40.8	77%	0.766	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-77.3	129.2	175.9	-66.4	-158.6	151	0	0	112.5	S163	E161-S163 PolarHBondContact O-N 3.06Å
162	P	87.6	Confident	87.8	Confident	20 Å²	20	40.8 Å²	40.8	13%	0.13	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-61.5	127.8	173.4	-23.9	33.9	0	0	0	112.5	L152 M155 I160 T166 Y167	L152-P162 HydrophobicContact CD2-CB 3.78Å; L152-P162 HydrophobicContact CD2-CG 3.41Å; L152-P162 VanDerWaalsContact CD2-CG 3.41Å; M155-P162 HydrophobicContact CE-CB 4.47Å; M155-P162 HydrophobicContact CE-CG 4.36Å; M155-P162 HydrophobicContact SD-CG 4.33Å; I160-P162 WeakPolarHBondContact O-CD 3.14Å; P162-T166 HydrophobicContact CB-CG2 4.01Å; P162-Y167 HydrophobicContact CB-CE1 4.49Å; P162-Y167 HydrophobicContact CB-CE2 3.84Å
163	S	88.1	Confident	87.6	Confident	27 Å²	27	39.9 Å²	39.9	19%	0.189	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-88.4	173.2	178.6	77	0	0	0	0	112.4	E161 T165 T166 Y167	E161-S163 PolarHBondContact O-N 3.06Å; S163-T165 PolarHBondContact O-N 2.81Å; S163-T165 PolarHBondContact OG-N 3.41Å; S163-T166 PolarHBondContact N-OG1 2.98Å; S163-T166 VanDerWaalsContact N-OG1 3.08Å; S163-T166 WeakPolarHBondContact O-CB 3.24Å; S163-T166 PolarHBondContact O-N 2.98Å; S163-T166 PolarHBondContact OG-N 3.27Å; S163-T166 PolarHBondContact OG-OG1 3.32Å; S163-Y167 VanDerWaalsContact O-CD2 3.24Å; S163-Y167 WeakPolarHBondContact O-CD2 3.36Å; S163-Y167 PolarHBondContact O-N 2.81Å; S163-Y167 VanDerWaalsContact O-N 3.08Å
164	Q	88.3	Confident	87.4	Confident	51 Å²	51	37.8 Å²	37.8	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-51.8	-44.5	169.8	-179.1	-171.7	-30.3	0	0	111.4	T166 Y167 E168 M195 P196	Q164-T166 VanDerWaalsContact C-N 3.3Å; Q164-T166 PolarHBondContact O-N 3.27Å; Q164-Y167 PolarHBondContact O-N 3.01Å; Q164-E168 HydrophobicContact CG-CG 4.47Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.21Å; Q164-E168 PolarHBondContact NE2-OE1 3.49Å; Q164-E168 WeakPolarHBondContact O-CG 3.35Å; Q164-E168 PolarHBondContact O-N 3.42Å; Q164-M195 VanDerWaalsContact CA-SD 3.57Å; Q164-M195 HydrophobicContact CB-CB 4.36Å; Q164-M195 HydrophobicContact CB-CG 4.35Å; Q164-M195 HydrophobicContact CB-SD 3.84Å; Q164-M195 HydrophobicContact CG-CB 4.23Å; Q164-P196 PolarHBondContact NE2-O 2.94Å; Q164-P196 VanDerWaalsContact OE1-CD 3.29Å; Q164-P196 VanDerWaalsContact OE1-CG 3.31Å
165	T	87.4	Confident	87.3	Confident	61 Å²	61	35 Å²	35	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-34.3	178.5	-55.4	0	0	0	0	112	S163 E168 L169	S163-T165 PolarHBondContact O-N 2.81Å; S163-T165 PolarHBondContact OG-N 3.41Å; T165-E168 PolarHBondContact O-N 3.32Å; T165-L169 HydrophobicContact CG2-CD1 4.08Å; T165-L169 HydrophobicContact CG2-CG 4.45Å; T165-L169 WeakPolarHBondContact O-CB 3.37Å; T165-L169 VanDerWaalsContact O-CG 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.4Å; T165-L169 PolarHBondContact O-N 3.41Å
166	T	89.5	Confident	86.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-47.5	173.5	-46.1	0	0	0	0	111.2	L129 N133 L136 F151 M155 P162 S163 Q164 L169 L170	L129-T166 WeakPolarHBondContact CD1-OG1 3.38Å; N133-T166 WeakPolarHBondContact OD1-CA 3.43Å; N133-T166 WeakPolarHBondContact OD1-CB 3.35Å; N133-T166 PolarHBondContact OD1-OG1 3.19Å; L136-T166 HydrophobicContact CD1-CG2 4.06Å; F151-T166 HydrophobicContact CE1-CG2 4.4Å; M155-T166 HydrophobicContact CE-CG2 4.15Å; M155-T166 HydrophobicContact SD-CG2 3.68Å; P162-T166 HydrophobicContact CB-CG2 4.01Å; S163-T166 PolarHBondContact N-OG1 2.98Å; S163-T166 VanDerWaalsContact N-OG1 3.08Å; S163-T166 WeakPolarHBondContact O-CB 3.24Å; S163-T166 PolarHBondContact O-N 2.98Å; S163-T166 PolarHBondContact OG-N 3.27Å; S163-T166 PolarHBondContact OG-OG1 3.32Å; Q164-T166 VanDerWaalsContact C-N 3.3Å; Q164-T166 PolarHBondContact O-N 3.27Å; T166-L169 PolarHBondContact O-N 3.43Å; T166-L170 HydrophobicContact CG2-CD1 4.43Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.23Å
167	Y	90.8	Very high	86.2	Confident	9 Å²	9	37.5 Å²	37.5	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-66.1	-39.5	176.2	-68.9	-66.1	0	0	0	112.9	L152 P162 S163 Q164 L169 L170 I171 L186 L189 K193 M195	L152-Y167 HydrophobicContact CD1-CE1 4.41Å; L152-Y167 HydrophobicContact CD2-CE1 4.14Å; P162-Y167 HydrophobicContact CB-CE1 4.49Å; P162-Y167 HydrophobicContact CB-CE2 3.84Å; S163-Y167 VanDerWaalsContact O-CD2 3.24Å; S163-Y167 WeakPolarHBondContact O-CD2 3.36Å; S163-Y167 PolarHBondContact O-N 2.81Å; S163-Y167 VanDerWaalsContact O-N 3.08Å; Q164-Y167 PolarHBondContact O-N 3.01Å; Y167-L169 VanDerWaalsContact C-N 3.31Å; Y167-L169 PolarHBondContact O-N 2.88Å; Y167-L170 PolarHBondContact O-N 3.17Å; Y167-I171 WeakPolarHBondContact O-CB 3.17Å; Y167-I171 VanDerWaalsContact O-CG1 3.24Å; Y167-I171 WeakPolarHBondContact O-CG1 3.41Å; Y167-I171 PolarHBondContact O-N 3.17Å; Y167-L186 HydrophobicContact CD1-CD2 4.25Å; Y167-L186 HydrophobicContact CE1-CD2 4.49Å; Y167-L189 HydrophobicContact CE1-CD2 3.59Å; Y167-L189 HydrophobicContact CE1-CG 4.19Å; Y167-K193 HydrophobicContact CE2-CD 3.79Å; Y167-K193 WeakPolarHBondContact OH-CE 3.43Å; Y167-K193 PolarHBondContact OH-NZ 2.96Å; Y167-M195 HydrophobicContact CD2-SD 4.01Å; Y167-M195 HydrophobicContact CE2-SD 4.38Å
168	E	89.7	Confident	85.8	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-57	-43.2	172.7	-75.5	174.9	-163.9	0	0	112.3	Q164 T165 A172 N198 R200 V201	Q164-E168 HydrophobicContact CG-CG 4.47Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.21Å; Q164-E168 PolarHBondContact NE2-OE1 3.49Å; Q164-E168 WeakPolarHBondContact O-CG 3.35Å; Q164-E168 PolarHBondContact O-N 3.42Å; T165-E168 PolarHBondContact O-N 3.32Å; E168-A172 WeakPolarHBondContact O-CB 3.42Å; E168-A172 PolarHBondContact O-N 3.25Å; E168-N198 PolarHBondContact OE1-ND2 2.7Å; E168-R200 WeakPolarHBondContact OE2-CD 3.32Å; E168-R200 IonicContact OE2-CZ 2.64Å; E168-R200 IonicContact OE2-NE 3.12Å; E168-R200 IonicContact OE2-NH1 3.13Å; E168-R200 PolarHBondContact OE2-NH1 2.95Å; E168-V201 HydrophobicContact CG-CG2 3.74Å
169	L	88.7	Confident	85.8	Confident	20 Å²	20	32.4 Å²	32.4	11%	0.105	19%	0.193	C	C	.	.	H	α-helix	trans	-69.3	-43.1	179.3	-73.1	168.6	0	0	0	111.7	N133 L136 V137 T165 T166 Y167 A172 H173	N133-L169 HydrophobicContact CB-CD1 3.99Å; L136-L169 HydrophobicContact CB-CB 4.09Å; L136-L169 HydrophobicContact CB-CD1 4.12Å; L136-L169 HydrophobicContact CD1-CB 3.72Å; L136-L169 HydrophobicContact CD1-CD1 4.32Å; V137-L169 HydrophobicContact CG2-CD1 4.02Å; V137-L169 HydrophobicContact CG2-CD2 3.68Å; T165-L169 HydrophobicContact CG2-CD1 4.08Å; T165-L169 HydrophobicContact CG2-CG 4.45Å; T165-L169 WeakPolarHBondContact O-CB 3.37Å; T165-L169 VanDerWaalsContact O-CG 3.25Å; T165-L169 WeakPolarHBondContact O-CG 3.4Å; T165-L169 PolarHBondContact O-N 3.41Å; T166-L169 PolarHBondContact O-N 3.43Å; Y167-L169 VanDerWaalsContact C-N 3.31Å; Y167-L169 PolarHBondContact O-N 2.88Å; L169-A172 PolarHBondContact O-N 2.68Å; L169-H173 WeakPolarHBondContact O-CB 3.34Å; L169-H173 PolarHBondContact O-N 2.8Å
170	L	90.9	Very high	86.1	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-63.5	-43.9	175.5	-69.2	173.5	0	0	0	111.9	L136 F151 L152 T166 Y167 A172 H173 C174 L186	L136-L170 HydrophobicContact CD1-CD2 4.01Å; L136-L170 HydrophobicContact CD1-CG 4Å; L136-L170 HydrophobicContact CD2-CD2 3.8Å; F151-L170 HydrophobicContact CD1-CD2 4.26Å; L152-L170 HydrophobicContact CD1-CD1 4.12Å; L152-L170 HydrophobicContact CD2-CD1 3.76Å; L152-L170 HydrophobicContact CG-CD1 3.85Å; T166-L170 HydrophobicContact CG2-CD1 4.43Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.23Å; Y167-L170 PolarHBondContact O-N 3.17Å; L170-A172 VanDerWaalsContact C-N 3.32Å; L170-A172 PolarHBondContact O-N 3.44Å; L170-H173 WeakPolarHBondContact O-CB 3.43Å; L170-H173 PolarHBondContact O-N 2.7Å; L170-H173 VanDerWaalsContact O-N 3.11Å; L170-C174 PolarHBondContact O-N 3.14Å; L170-C174 PolarHBondContact O-SG 3.1Å; L170-L186 HydrophobicContact CB-CD1 3.72Å
171	I	90.9	Very high	86.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.6	-46.3	173.4	-68.8	166.2	0	0	0	110.1	Y167 H173 C174 C175 A183 L186 L187 L190 V201 L205	Y167-I171 WeakPolarHBondContact O-CB 3.17Å; Y167-I171 VanDerWaalsContact O-CG1 3.24Å; Y167-I171 WeakPolarHBondContact O-CG1 3.41Å; Y167-I171 PolarHBondContact O-N 3.17Å; I171-H173 PolarHBondContact O-N 3.03Å; I171-C174 PolarHBondContact O-N 2.63Å; I171-C175 WeakPolarHBondContact O-CB 3.38Å; I171-C175 PolarHBondContact O-N 2.74Å; I171-C175 PolarHBondContact O-SG 3.24Å; I171-A183 HydrophobicContact CG2-CB 4.35Å; I171-L186 HydrophobicContact CD1-CB 4.23Å; I171-L186 HydrophobicContact CG1-CB 3.59Å; I171-L186 HydrophobicContact CG1-CD1 4.33Å; I171-L187 HydrophobicContact CD1-CB 4.27Å; I171-L187 HydrophobicContact CD1-CD1 4.49Å; I171-L190 HydrophobicContact CD1-CD1 4.04Å; I171-V201 HydrophobicContact CD1-CG1 4.17Å; I171-V201 HydrophobicContact CG2-CG1 4.42Å; I171-L205 HydrophobicContact CG2-CD2 4.37Å
172	A	86.9	Confident	86.2	Confident	4 Å²	4	31.5 Å²	31.5	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-29.7	177.3	0	0	0	0	0	113.3	E168 L169 L170 Q176 S204	E168-A172 WeakPolarHBondContact O-CB 3.42Å; E168-A172 PolarHBondContact O-N 3.25Å; L169-A172 PolarHBondContact O-N 2.68Å; L170-A172 VanDerWaalsContact C-N 3.32Å; L170-A172 PolarHBondContact O-N 3.44Å; A172-Q176 VanDerWaalsContact O-CB 3.3Å; A172-Q176 WeakPolarHBondContact O-CB 3.41Å; A172-Q176 PolarHBondContact O-N 2.65Å; A172-Q176 VanDerWaalsContact O-N 3.08Å; A172-S204 WeakPolarHBondContact CB-OG 3.41Å
173	H	86.4	Confident	86.3	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.028	16%	0.161	C	C	.	.	H	α-helix	trans	-72.3	-50.6	176	-148.3	78.8	0	0	0	111.4	A139 K140 V144 K145 I146 L169 L170 I171 C175 Q176 D177	A139-H173 VanDerWaalsContact CB-CE1 3.49Å; A139-H173 WeakPolarHBondContact CB-CE1 3.43Å; A139-H173 PolarHBondContact O-CE1 2.84Å; K140-H173 WeakPolarHBondContact CA-CE1 3.38Å; K140-H173 PolarHBondContact N-CE1 2.79Å; V144-H173 PolarHBondContact O-CE1 3.3Å; V144-H173 PolarHBondContact O-NE2 3.17Å; K145-H173 WeakPolarHBondContact CA-NE2 3.47Å; K145-H173 PolarHBondContact N-NE2 3.11Å; K145-H173 VanDerWaalsContact N-NE2 3.2Å; I146-H173 PolarHBondContact N-NE2 3.47Å; L169-H173 WeakPolarHBondContact O-CB 3.34Å; L169-H173 PolarHBondContact O-N 2.8Å; L170-H173 WeakPolarHBondContact O-CB 3.43Å; L170-H173 PolarHBondContact O-N 2.7Å; L170-H173 VanDerWaalsContact O-N 3.11Å; I171-H173 PolarHBondContact O-N 3.03Å; H173-C175 VanDerWaalsContact C-N 3.34Å; H173-C175 PolarHBondContact O-N 2.82Å; H173-Q176 WeakPolarHBondContact O-CB 3.32Å; H173-Q176 PolarHBondContact O-N 2.82Å; H173-Q176 VanDerWaalsContact O-N 3.09Å; H173-D177 PolarHBondContact O-N 2.99Å
174	C	85.7	Confident	86.3	Confident	8 Å²	8	31.3 Å²	31.3	5%	0.054	17%	0.165	C	C	.	.	H	α-helix	trans	-59.4	-44.5	176	-61.8	0	0	0	0	111.6	S148 L170 I171 Q176 D177 G178 D179 E182 A183	S148-C174 PolarHBondContact OG-SG 3.33Å; S148-C174 VanDerWaalsContact OG-SG 3.42Å; L170-C174 PolarHBondContact O-N 3.14Å; L170-C174 PolarHBondContact O-SG 3.1Å; I171-C174 PolarHBondContact O-N 2.63Å; C174-Q176 VanDerWaalsContact C-N 3.32Å; C174-Q176 PolarHBondContact O-N 3.33Å; C174-D177 PolarHBondContact O-N 2.72Å; C174-G178 PolarHBondContact O-N 2.71Å; C174-G178 VanDerWaalsContact O-N 3.15Å; C174-D179 HydrophobicContact CB-CB 4.39Å; C174-D179 PolarHBondContact O-N 3.48Å; C174-E182 HydrophobicContact CB-CB 4.45Å; C174-E182 HydrophobicContact CB-CG 4.46Å; C174-E182 WeakPolarHBondContact SG-CG 3.29Å; C174-A183 HydrophobicContact CB-CB 3.94Å
175	C	86	Confident	86.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-31.1	175.2	-68.7	0	0	0	0	113.3	I171 H173 D177 G178 A183 S204 G208	I171-C175 WeakPolarHBondContact O-CB 3.38Å; I171-C175 PolarHBondContact O-N 2.74Å; I171-C175 PolarHBondContact O-SG 3.24Å; H173-C175 VanDerWaalsContact C-N 3.34Å; H173-C175 PolarHBondContact O-N 2.82Å; C175-D177 VanDerWaalsContact C-N 3.3Å; C175-D177 PolarHBondContact O-N 3.37Å; C175-G178 PolarHBondContact O-N 2.62Å; C175-A183 WeakPolarHBondContact SG-CB 3.46Å; C175-S204 WeakPolarHBondContact CB-O 3.35Å; C175-S204 PolarHBondContact SG-O 2.97Å; C175-G208 WeakPolarHBondContact O-CA 3.43Å
176	Q	79.4	Confident	86.6	Confident	52 Å²	52	30.3 Å²	30.3	24%	0.243	15%	0.152	C	C	.	.	H	α-helix	trans	-67.3	-32.7	175.6	178.8	168.8	-31.7	0	0	112.1	K140 A172 H173 C174 K211	K140-Q176 PolarHBondContact O-NE2 2.88Å; K140-Q176 VanDerWaalsContact O-NE2 3.13Å; A172-Q176 VanDerWaalsContact O-CB 3.3Å; A172-Q176 WeakPolarHBondContact O-CB 3.41Å; A172-Q176 PolarHBondContact O-N 2.65Å; A172-Q176 VanDerWaalsContact O-N 3.08Å; H173-Q176 WeakPolarHBondContact O-CB 3.32Å; H173-Q176 PolarHBondContact O-N 2.82Å; H173-Q176 VanDerWaalsContact O-N 3.09Å; C174-Q176 VanDerWaalsContact C-N 3.32Å; C174-Q176 PolarHBondContact O-N 3.33Å; Q176-K211 WeakPolarHBondContact O-CD 3.32Å; Q176-K211 PolarHBondContact O-NZ 3.47Å
177	D	74.5	Confident	86.6	Confident	69 Å²	69	31.1 Å²	31.1	37%	0.369	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.7	174	-81.1	7.7	0	0	0	114.1	K145 H173 C174 C175 D179	K145-D177 WeakPolarHBondContact CD-OD2 3.13Å; K145-D177 WeakPolarHBondContact CE-OD2 3.49Å; K145-D177 WeakPolarHBondContact CG-OD2 3.26Å; K145-D177 IonicContact NZ-OD2 2.89Å; K145-D177 PolarHBondContact NZ-OD2 3.14Å; H173-D177 PolarHBondContact O-N 2.99Å; C174-D177 PolarHBondContact O-N 2.72Å; C175-D177 VanDerWaalsContact C-N 3.3Å; C175-D177 PolarHBondContact O-N 3.37Å; D177-D179 VanDerWaalsContact C-N 3.34Å
178	G	76.4	Confident	86.6	Confident	28 Å²	28	35.4 Å²	35.4	29%	0.289	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	11.5	-172.3	0	0	0	0	0	115.1	C174 C175 I180	C174-G178 PolarHBondContact O-N 2.71Å; C174-G178 VanDerWaalsContact O-N 3.15Å; C175-G178 PolarHBondContact O-N 2.62Å; G178-I180 PolarHBondContact O-N 3.4Å
179	D	82.8	Confident	86.5	Confident	62 Å²	62	37.4 Å²	37.4	33%	0.332	19%	0.187	S	C	.	.			trans	-83.2	77.4	177.7	-162	-25.6	0	0	0	111.8	C174 D177 K181 E182 A183	C174-D179 HydrophobicContact CB-CB 4.39Å; C174-D179 PolarHBondContact O-N 3.48Å; D177-D179 VanDerWaalsContact C-N 3.34Å; D179-K181 VanDerWaalsContact C-N 3.28Å; D179-K181 PolarHBondContact O-N 2.84Å; D179-K181 PolarHBondContact OD1-N 3.5Å; D179-E182 HydrophobicContact CB-CB 4.46Å; D179-E182 WeakPolarHBondContact OD1-CB 3.27Å; D179-E182 PolarHBondContact OD1-N 2.96Å; D179-A183 WeakPolarHBondContact O-CB 3.3Å; D179-A183 PolarHBondContact O-N 3.02Å
180	I	86.6	Confident	86.5	Confident	23 Å²	23	36.4 Å²	36.4	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-69.1	-27.2	-178.3	-50.1	-52.2	0	0	0	112.4	G178 T184 G208 Y209 A212	G178-I180 PolarHBondContact O-N 3.4Å; I180-T184 VanDerWaalsContact O-CB 3.32Å; I180-T184 WeakPolarHBondContact O-CB 3.41Å; I180-T184 PolarHBondContact O-N 3.25Å; I180-T184 PolarHBondContact O-OG1 3.2Å; I180-G208 VanDerWaalsContact CD1-CA 3.44Å; I180-G208 WeakPolarHBondContact CD1-O 3.31Å; I180-Y209 HydrophobicContact CG2-CD1 4.06Å; I180-Y209 HydrophobicContact CG2-CE1 3.52Å; I180-Y209 HydrophobicContact CG2-CE2 4.04Å; I180-A212 HydrophobicContact CG1-CB 4.21Å
181	K	86.8	Confident	86.3	Confident	184 Å²	184	41.1 Å²	41.1	80%	0.8	20%	0.202	S	C	*	.	H	α-helix	trans	-64.8	-50.7	178	-67.1	-177.1	179.6	179.8	0	110.1	D179 T184 R185	D179-K181 VanDerWaalsContact C-N 3.28Å; D179-K181 PolarHBondContact O-N 2.84Å; D179-K181 PolarHBondContact OD1-N 3.5Å; K181-T184 PolarHBondContact O-N 3.37Å; K181-R185 PolarHBondContact O-N 3.33Å
182	E	87.5	Confident	86.2	Confident	33 Å²	33	48 Å²	48	15%	0.154	23%	0.234	C	C	.	.	H	α-helix	trans	-69.4	-37.9	178.9	-178.7	57.9	-168.5	0	0	112.1	S148 C174 D179 T184 R185 L186	S148-E182 WeakPolarHBondContact CB-OE1 3.13Å; S148-E182 PolarHBondContact OG-OE1 3.39Å; C174-E182 HydrophobicContact CB-CB 4.45Å; C174-E182 HydrophobicContact CB-CG 4.46Å; C174-E182 WeakPolarHBondContact SG-CG 3.29Å; D179-E182 HydrophobicContact CB-CB 4.46Å; D179-E182 WeakPolarHBondContact OD1-CB 3.27Å; D179-E182 PolarHBondContact OD1-N 2.96Å; E182-T184 VanDerWaalsContact C-N 3.27Å; E182-T184 PolarHBondContact O-N 3.18Å; E182-R185 PolarHBondContact O-N 2.79Å; E182-R185 IonicContact OE1-CZ 3.49Å; E182-R185 IonicContact OE1-NE 2.76Å; E182-R185 PolarHBondContact OE1-NE 3.26Å; E182-R185 IonicContact OE1-NH2 2.71Å; E182-R185 PolarHBondContact OE1-NH2 3.26Å; E182-R185 IonicContact OE2-CZ 3.81Å; E182-R185 IonicContact OE2-NE 3.61Å; E182-R185 PolarHBondContact OE2-NE 2.88Å; E182-R185 IonicContact OE2-NH2 3.44Å; E182-L186 HydrophobicContact CG-CD1 4.3Å; E182-L186 WeakPolarHBondContact O-CG 3.42Å; E182-L186 PolarHBondContact O-N 3.01Å
183	A	88.9	Confident	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-38.4	172	0	0	0	0	0	112.7	I171 C174 C175 D179 L187 L205	I171-A183 HydrophobicContact CG2-CB 4.35Å; C174-A183 HydrophobicContact CB-CB 3.94Å; C175-A183 WeakPolarHBondContact SG-CB 3.46Å; D179-A183 WeakPolarHBondContact O-CB 3.3Å; D179-A183 PolarHBondContact O-N 3.02Å; A183-L187 WeakPolarHBondContact O-CB 3.41Å; A183-L187 PolarHBondContact O-N 2.95Å; A183-L205 HydrophobicContact CB-CD2 4.25Å
184	T	88.5	Confident	86.2	Confident	43 Å²	43	60.9 Å²	60.9	26%	0.264	29%	0.29	S	S	.	.	H	α-helix	trans	-69.7	-42.2	177.6	-56.2	0	0	0	0	111.4	I180 K181 E182 L186 L187 E188	I180-T184 VanDerWaalsContact O-CB 3.32Å; I180-T184 WeakPolarHBondContact O-CB 3.41Å; I180-T184 PolarHBondContact O-N 3.25Å; I180-T184 PolarHBondContact O-OG1 3.2Å; K181-T184 PolarHBondContact O-N 3.37Å; E182-T184 VanDerWaalsContact C-N 3.27Å; E182-T184 PolarHBondContact O-N 3.18Å; T184-L186 PolarHBondContact O-N 2.79Å; T184-L187 WeakPolarHBondContact O-CB 3.15Å; T184-L187 PolarHBondContact O-N 2.88Å; T184-E188 WeakPolarHBondContact O-CG 3.45Å; T184-E188 PolarHBondContact O-N 3.45Å
185	R	91.8	Very high	86.2	Confident	91 Å²	91	62.8 Å²	62.8	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-60	-44.6	175.1	-170.1	-170.6	72.2	99.4	-6.1	112.1	D149 K181 E182 L187 E188 L189	D149-R185 IonicContact OD1-CZ 3.55Å; D149-R185 IonicContact OD1-NH1 2.68Å; D149-R185 IonicContact OD1-NH2 3.52Å; D149-R185 PolarHBondContact OD1-NH2 3.48Å; D149-R185 IonicContact OD2-NH2 2.71Å; K181-R185 PolarHBondContact O-N 3.33Å; E182-R185 PolarHBondContact O-N 2.79Å; E182-R185 IonicContact OE1-CZ 3.49Å; E182-R185 IonicContact OE1-NE 2.76Å; E182-R185 PolarHBondContact OE1-NE 3.26Å; E182-R185 IonicContact OE1-NH2 2.71Å; E182-R185 PolarHBondContact OE1-NH2 3.26Å; E182-R185 IonicContact OE2-CZ 3.81Å; E182-R185 IonicContact OE2-NE 3.61Å; E182-R185 PolarHBondContact OE2-NE 2.88Å; E182-R185 IonicContact OE2-NH2 3.44Å; R185-L187 VanDerWaalsContact C-N 3.33Å; R185-L187 PolarHBondContact O-N 3.04Å; R185-E188 PolarHBondContact O-N 3.04Å; R185-L189 PolarHBondContact O-N 3.16Å
186	L	90.6	Very high	86	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-35	176.2	-68.2	169.5	0	0	0	112.2	L152 Y167 L170 I171 E182 T184 L189 L190	L152-L186 HydrophobicContact CD1-CD2 4.22Å; Y167-L186 HydrophobicContact CD1-CD2 4.25Å; Y167-L186 HydrophobicContact CE1-CD2 4.49Å; L170-L186 HydrophobicContact CB-CD1 3.72Å; I171-L186 HydrophobicContact CD1-CB 4.23Å; I171-L186 HydrophobicContact CG1-CB 3.59Å; I171-L186 HydrophobicContact CG1-CD1 4.33Å; E182-L186 HydrophobicContact CG-CD1 4.3Å; E182-L186 WeakPolarHBondContact O-CG 3.42Å; E182-L186 PolarHBondContact O-N 3.01Å; T184-L186 PolarHBondContact O-N 2.79Å; L186-L189 PolarHBondContact O-N 3.46Å; L186-L190 WeakPolarHBondContact O-CB 3.09Å; L186-L190 PolarHBondContact O-N 2.97Å
187	L	89.5	Confident	86.2	Confident	17 Å²	17	65.9 Å²	65.9	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-37.1	173	-179.3	72	0	0	0	112.2	I171 A183 T184 R185 K191 I197 V201 L205	I171-L187 HydrophobicContact CD1-CB 4.27Å; I171-L187 HydrophobicContact CD1-CD1 4.49Å; A183-L187 WeakPolarHBondContact O-CB 3.41Å; A183-L187 PolarHBondContact O-N 2.95Å; T184-L187 WeakPolarHBondContact O-CB 3.15Å; T184-L187 PolarHBondContact O-N 2.88Å; R185-L187 VanDerWaalsContact C-N 3.33Å; R185-L187 PolarHBondContact O-N 3.04Å; L187-K191 WeakPolarHBondContact O-CG 3.4Å; L187-K191 PolarHBondContact O-N 3.44Å; L187-K191 VanDerWaalsContact O-N 3.14Å; L187-I197 HydrophobicContact CD1-CD1 3.88Å; L187-I197 HydrophobicContact CD1-CG1 4.19Å; L187-I197 HydrophobicContact CD1-CG2 4.45Å; L187-V201 HydrophobicContact CD1-CG1 3.51Å; L187-L205 HydrophobicContact CD1-CD1 4.27Å; L187-L205 HydrophobicContact CD2-CD1 3.78Å
188	E	90	Very high	86.6	Confident	99 Å²	99	64.9 Å²	64.9	46%	0.463	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-48.1	173.5	-72.9	173.7	164.1	0	0	111.3	T184 R185 L190 K191 E192	T184-E188 WeakPolarHBondContact O-CG 3.45Å; T184-E188 PolarHBondContact O-N 3.45Å; R185-E188 PolarHBondContact O-N 3.04Å; E188-L190 VanDerWaalsContact C-N 3.25Å; E188-L190 PolarHBondContact O-N 2.94Å; E188-K191 CarbonylContact O-C 3.44Å; E188-K191 WeakPolarHBondContact O-CA 3.27Å; E188-K191 WeakPolarHBondContact O-CB 3.48Å; E188-K191 PolarHBondContact O-N 3.45Å; E188-E192 WeakPolarHBondContact O-CG 3.42Å; E188-E192 PolarHBondContact O-N 2.99Å
189	L	88.4	Confident	87	Confident	45 Å²	45	66 Å²	66	24%	0.236	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-34.8	175.9	-171.8	60.7	0	0	0	112.8	Y167 R185 L186 E192 K193	Y167-L189 HydrophobicContact CE1-CD2 3.59Å; Y167-L189 HydrophobicContact CE1-CG 4.19Å; R185-L189 PolarHBondContact O-N 3.16Å; L186-L189 PolarHBondContact O-N 3.46Å; L189-E192 PolarHBondContact O-N 3.04Å; L189-K193 WeakPolarHBondContact O-CB 3.27Å; L189-K193 PolarHBondContact O-N 3.1Å
190	L	88	Confident	87.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-39.4	173.6	-165.9	161.4	0	0	0	111.4	I171 L186 E188 K194 M195 I197 V201	I171-L190 HydrophobicContact CD1-CD1 4.04Å; L186-L190 WeakPolarHBondContact O-CB 3.09Å; L186-L190 PolarHBondContact O-N 2.97Å; E188-L190 VanDerWaalsContact C-N 3.25Å; E188-L190 PolarHBondContact O-N 2.94Å; L190-K194 PolarHBondContact O-N 3.11Å; L190-M195 HydrophobicContact CD2-CB 3.72Å; L190-M195 VanDerWaalsContact CD2-O 3.23Å; L190-M195 WeakPolarHBondContact CD2-O 3.36Å; L190-M195 HydrophobicContact CG-CB 3.96Å; L190-M195 PolarHBondContact O-N 3.37Å; L190-I197 HydrophobicContact CD2-CG1 3.79Å; L190-V201 HydrophobicContact CD1-CG2 4.42Å
191	K	86.5	Confident	87.1	Confident	99 Å²	99	67.2 Å²	67.2	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-66.9	-43.2	172.5	-65	164	-169.1	159.3	0	112	L187 E188 K193 K194 I197	L187-K191 WeakPolarHBondContact O-CG 3.4Å; L187-K191 PolarHBondContact O-N 3.44Å; L187-K191 VanDerWaalsContact O-N 3.14Å; E188-K191 CarbonylContact O-C 3.44Å; E188-K191 WeakPolarHBondContact O-CA 3.27Å; E188-K191 WeakPolarHBondContact O-CB 3.48Å; E188-K191 PolarHBondContact O-N 3.45Å; K191-K193 VanDerWaalsContact C-N 3.34Å; K191-K193 PolarHBondContact O-N 2.93Å; K191-K194 WeakPolarHBondContact O-CA 3.48Å; K191-K194 PolarHBondContact O-N 3.21Å; K191-I197 HydrophobicContact CG-CD1 3.95Å
192	E	88.5	Confident	87.2	Confident	145 Å²	145	58.7 Å²	58.7	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-60.2	-44	178	-72	178.5	165.8	0	0	111.5	E188 L189 K194	E188-E192 WeakPolarHBondContact O-CG 3.42Å; E188-E192 PolarHBondContact O-N 2.99Å; L189-E192 PolarHBondContact O-N 3.04Å; E192-K194 PolarHBondContact O-N 3.47Å; E192-K194 VanDerWaalsContact O-N 3.14Å
193	K	86.8	Confident	87.1	Confident	89 Å²	89	57.3 Å²	57.3	39%	0.387	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	3.4	172	-72.5	-171.4	166.5	-169.3	0	114.2	Y167 L189 K191 M195	Y167-K193 HydrophobicContact CE2-CD 3.79Å; Y167-K193 WeakPolarHBondContact OH-CE 3.43Å; Y167-K193 PolarHBondContact OH-NZ 2.96Å; L189-K193 WeakPolarHBondContact O-CB 3.27Å; L189-K193 PolarHBondContact O-N 3.1Å; K191-K193 VanDerWaalsContact C-N 3.34Å; K191-K193 PolarHBondContact O-N 2.93Å; K193-M195 HydrophobicContact CB-CE 4.22Å; K193-M195 HydrophobicContact CB-CG 4.13Å; K193-M195 HydrophobicContact CB-SD 4.23Å; K193-M195 HydrophobicContact CD-CE 4.1Å; K193-M195 PolarHBondContact O-N 3.2Å; K193-M195 VanDerWaalsContact O-N 3.15Å
194	K	86.5	Confident	87.1	Confident	192 Å²	192	57.9 Å²	57.9	84%	0.835	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	28.1	-179.9	-57.6	179.3	-177.6	174.9	0	113.9	L190 K191 E192	L190-K194 PolarHBondContact O-N 3.11Å; K191-K194 WeakPolarHBondContact O-CA 3.48Å; K191-K194 PolarHBondContact O-N 3.21Å; E192-K194 PolarHBondContact O-N 3.47Å; E192-K194 VanDerWaalsContact O-N 3.14Å
195	M	85.3	Confident	87.1	Confident	48 Å²	48	56 Å²	56	24%	0.236	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-78.7	142.9	176.9	-66.5	175.8	175.1	0	0	109.8	Q164 Y167 L190 K193	Q164-M195 VanDerWaalsContact CA-SD 3.57Å; Q164-M195 HydrophobicContact CB-CB 4.36Å; Q164-M195 HydrophobicContact CB-CG 4.35Å; Q164-M195 HydrophobicContact CB-SD 3.84Å; Q164-M195 HydrophobicContact CG-CB 4.23Å; Y167-M195 HydrophobicContact CD2-SD 4.01Å; Y167-M195 HydrophobicContact CE2-SD 4.38Å; L190-M195 HydrophobicContact CD2-CB 3.72Å; L190-M195 VanDerWaalsContact CD2-O 3.23Å; L190-M195 WeakPolarHBondContact CD2-O 3.36Å; L190-M195 HydrophobicContact CG-CB 3.96Å; L190-M195 PolarHBondContact O-N 3.37Å; K193-M195 HydrophobicContact CB-CE 4.22Å; K193-M195 HydrophobicContact CB-CG 4.13Å; K193-M195 HydrophobicContact CB-SD 4.23Å; K193-M195 HydrophobicContact CD-CE 4.1Å; K193-M195 PolarHBondContact O-N 3.2Å; K193-M195 VanDerWaalsContact O-N 3.15Å
196	P	82.3	Confident	86.9	Confident	84 Å²	84	51.7 Å²	51.7	55%	0.545	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-72.1	130.5	-178.4	27.2	-33.8	0	0	0	111.9	Q164	Q164-P196 PolarHBondContact NE2-O 2.94Å; Q164-P196 VanDerWaalsContact OE1-CD 3.29Å; Q164-P196 VanDerWaalsContact OE1-CG 3.31Å
197	I	83.7	Confident	86.6	Confident	32 Å²	32	52.5 Å²	52.5	16%	0.164	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-81.5	121.1	172.3	-58.7	166.9	0	0	0	108.5	L187 L190 K191 V201 F202	L187-I197 HydrophobicContact CD1-CD1 3.88Å; L187-I197 HydrophobicContact CD1-CG1 4.19Å; L187-I197 HydrophobicContact CD1-CG2 4.45Å; L190-I197 HydrophobicContact CD2-CG1 3.79Å; K191-I197 HydrophobicContact CG-CD1 3.95Å; I197-V201 HydrophobicContact CG2-CB 3.8Å; I197-V201 HydrophobicContact CG2-CG1 3.83Å; I197-V201 HydrophobicContact CG2-CG2 4.38Å; I197-F202 HydrophobicContact CB-CE2 4.25Å; I197-F202 HydrophobicContact CG2-CD2 3.78Å; I197-F202 HydrophobicContact CG2-CE2 3.35Å; I197-F202 HydrophobicContact CG2-CZ 3.92Å
198	N	83.8	Confident	86.4	Confident	48 Å²	48	51.7 Å²	51.7	26%	0.257	25%	0.245	S	C	.	.			trans	-109	178.2	-179.7	64.1	16.7	0	0	0	112.5	E168 R200 V201 F202	E168-N198 PolarHBondContact OE1-ND2 2.7Å; N198-R200 PolarHBondContact O-N 3.04Å; N198-R200 WeakPolarHBondContact OD1-CB 3.46Å; N198-R200 PolarHBondContact OD1-N 2.88Å; N198-V201 PolarHBondContact O-N 3.35Å; N198-V201 VanDerWaalsContact O-N 3.16Å; N198-V201 PolarHBondContact OD1-N 3.06Å; N198-F202 WeakPolarHBondContact O-CD2 3.36Å; N198-F202 PolarHBondContact O-N 3.35Å
199	E	84.8	Confident	86.2	Confident	52 Å²	52	48.7 Å²	48.7	24%	0.243	23%	0.23	C	C	.	.	H	α-helix	trans	-51	-39.5	176.5	175.8	-178	171.6	0	0	112.9	V201 F202 A203 M225 G233 S234 L235 T236	E199-V201 VanDerWaalsContact C-N 3.29Å; E199-V201 PolarHBondContact O-N 2.7Å; E199-F202 PolarHBondContact O-N 3.19Å; E199-A203 VanDerWaalsContact O-CB 3.27Å; E199-A203 WeakPolarHBondContact O-CB 3.46Å; E199-A203 PolarHBondContact O-N 3.5Å; E199-M225 HydrophobicContact CB-CE 3.97Å; E199-M225 HydrophobicContact CG-CE 3.71Å; E199-G233 WeakPolarHBondContact OE1-CA 3.32Å; E199-G233 PolarHBondContact OE1-N 3.38Å; E199-S234 PolarHBondContact OE1-N 3.26Å; E199-L235 HydrophobicContact CG-CB 4.23Å; E199-L235 WeakPolarHBondContact OE1-CB 3.47Å; E199-L235 PolarHBondContact OE1-N 2.96Å; E199-L235 VanDerWaalsContact OE1-N 3.15Å; E199-T236 PolarHBondContact OE1-N 3.49Å
200	R	84	Confident	85.9	Confident	110 Å²	110	46.7 Å²	46.7	42%	0.415	22%	0.219	S	C	.	.	H	α-helix	trans	-60.8	-38.7	-177.8	-178.7	-176.7	-71.3	150.9	-10.4	112.1	E168 N198 S204 L235	E168-R200 WeakPolarHBondContact OE2-CD 3.32Å; E168-R200 IonicContact OE2-CZ 2.64Å; E168-R200 IonicContact OE2-NE 3.12Å; E168-R200 IonicContact OE2-NH1 3.13Å; E168-R200 PolarHBondContact OE2-NH1 2.95Å; N198-R200 PolarHBondContact O-N 3.04Å; N198-R200 WeakPolarHBondContact OD1-CB 3.46Å; N198-R200 PolarHBondContact OD1-N 2.88Å; R200-S204 VanDerWaalsContact O-CB 3.31Å; R200-S204 WeakPolarHBondContact O-CB 3.31Å; R200-S204 PolarHBondContact O-N 3.09Å; R200-S204 PolarHBondContact O-OG 3.31Å; R200-L235 HydrophobicContact CB-CD1 4.28Å
201	V	87.5	Confident	85.4	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-48.3	175.7	-179.5	0	0	0	0	110.5	E168 I171 L187 L190 I197 N198 E199 A203 S204 L205	E168-V201 HydrophobicContact CG-CG2 3.74Å; I171-V201 HydrophobicContact CD1-CG1 4.17Å; I171-V201 HydrophobicContact CG2-CG1 4.42Å; L187-V201 HydrophobicContact CD1-CG1 3.51Å; L190-V201 HydrophobicContact CD1-CG2 4.42Å; I197-V201 HydrophobicContact CG2-CB 3.8Å; I197-V201 HydrophobicContact CG2-CG1 3.83Å; I197-V201 HydrophobicContact CG2-CG2 4.38Å; N198-V201 PolarHBondContact O-N 3.35Å; N198-V201 VanDerWaalsContact O-N 3.16Å; N198-V201 PolarHBondContact OD1-N 3.06Å; E199-V201 VanDerWaalsContact C-N 3.29Å; E199-V201 PolarHBondContact O-N 2.7Å; V201-A203 PolarHBondContact O-N 2.97Å; V201-S204 PolarHBondContact O-N 3.45Å; V201-L205 HydrophobicContact CG1-CD1 4.02Å; V201-L205 WeakPolarHBondContact O-CG 3.26Å; V201-L205 PolarHBondContact O-N 2.77Å
202	F	89.1	Confident	85	Confident	5 Å²	5	46 Å²	46	2%	0.022	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-45.7	177.5	-77.6	-75	0	0	0	112.4	I197 N198 E199 S204 L205 I206 I221 L224 M225 R228 L230	I197-F202 HydrophobicContact CB-CE2 4.25Å; I197-F202 HydrophobicContact CG2-CD2 3.78Å; I197-F202 HydrophobicContact CG2-CE2 3.35Å; I197-F202 HydrophobicContact CG2-CZ 3.92Å; N198-F202 WeakPolarHBondContact O-CD2 3.36Å; N198-F202 PolarHBondContact O-N 3.35Å; E199-F202 PolarHBondContact O-N 3.19Å; F202-S204 VanDerWaalsContact C-N 3.33Å; F202-S204 PolarHBondContact O-N 3.08Å; F202-L205 PolarHBondContact O-N 2.9Å; F202-I206 WeakPolarHBondContact O-CB 3.33Å; F202-I206 VanDerWaalsContact O-CG1 3.27Å; F202-I206 WeakPolarHBondContact O-CG1 3.46Å; F202-I206 PolarHBondContact O-N 3.49Å; F202-I221 HydrophobicContact CD1-CG2 3.79Å; F202-L224 HydrophobicContact CE1-CB 4.3Å; F202-L224 HydrophobicContact CE1-CD2 4.07Å; F202-L224 HydrophobicContact CE1-CG 3.94Å; F202-L224 HydrophobicContact CZ-CG 4.42Å; F202-M225 HydrophobicContact CB-CB 4.24Å; F202-M225 HydrophobicContact CB-CG 4.01Å; F202-M225 HydrophobicContact CB-SD 3.83Å; F202-M225 HydrophobicContact CD1-CB 3.72Å; F202-M225 HydrophobicContact CD1-CG 4.25Å; F202-M225 HydrophobicContact CD2-CB 4.35Å; F202-M225 HydrophobicContact CD2-CG 4.07Å; F202-M225 HydrophobicContact CE1-CB 4.15Å; F202-M225 HydrophobicContact CG-CB 3.85Å; F202-M225 HydrophobicContact CG-CG 3.85Å; F202-M225 HydrophobicContact CG-SD 4.35Å; F202-R228 HydrophobicContact CZ-CG 4.16Å; F202-L230 HydrophobicContact CD2-CD1 3.67Å; F202-L230 HydrophobicContact CE2-CD1 3.56Å
203	A	85.8	Confident	84.4	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-39.1	175.6	0	0	0	0	0	112.2	E199 V201 I206 N207 L235 A239	E199-A203 VanDerWaalsContact O-CB 3.27Å; E199-A203 WeakPolarHBondContact O-CB 3.46Å; E199-A203 PolarHBondContact O-N 3.5Å; V201-A203 PolarHBondContact O-N 2.97Å; A203-I206 PolarHBondContact O-N 3.46Å; A203-N207 WeakPolarHBondContact O-CB 3.27Å; A203-N207 PolarHBondContact O-N 2.87Å; A203-L235 HydrophobicContact CB-CB 4.09Å; A203-A239 HydrophobicContact CB-CB 4.02Å; A203-A239 WeakPolarHBondContact O-CB 3.47Å
204	S	87	Confident	84.2	Confident	12 Å²	12	39.9 Å²	39.9	8%	0.084	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-46.3	174.9	-60.9	0	0	0	0	111.5	A172 C175 R200 V201 F202 N207 G208	A172-S204 WeakPolarHBondContact CB-OG 3.41Å; C175-S204 WeakPolarHBondContact CB-O 3.35Å; C175-S204 PolarHBondContact SG-O 2.97Å; R200-S204 VanDerWaalsContact O-CB 3.31Å; R200-S204 WeakPolarHBondContact O-CB 3.31Å; R200-S204 PolarHBondContact O-N 3.09Å; R200-S204 PolarHBondContact O-OG 3.31Å; V201-S204 PolarHBondContact O-N 3.45Å; F202-S204 VanDerWaalsContact C-N 3.33Å; F202-S204 PolarHBondContact O-N 3.08Å; S204-N207 WeakPolarHBondContact O-CB 3.31Å; S204-N207 PolarHBondContact O-N 3.3Å; S204-G208 PolarHBondContact O-N 3.24Å
205	L	89	Confident	84	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-44.7	175.9	-67.9	166.1	0	0	0	111.4	I171 A183 L187 V201 F202 N207 G208 Y209 I221	I171-L205 HydrophobicContact CG2-CD2 4.37Å; A183-L205 HydrophobicContact CB-CD2 4.25Å; L187-L205 HydrophobicContact CD1-CD1 4.27Å; L187-L205 HydrophobicContact CD2-CD1 3.78Å; V201-L205 HydrophobicContact CG1-CD1 4.02Å; V201-L205 WeakPolarHBondContact O-CG 3.26Å; V201-L205 PolarHBondContact O-N 2.77Å; F202-L205 PolarHBondContact O-N 2.9Å; L205-N207 PolarHBondContact O-N 2.91Å; L205-G208 PolarHBondContact O-N 3Å; L205-G208 VanDerWaalsContact O-N 3.17Å; L205-Y209 HydrophobicContact CB-CD2 4.4Å; L205-Y209 HydrophobicContact CB-CE2 4.45Å; L205-Y209 WeakPolarHBondContact O-CD2 3.4Å; L205-Y209 PolarHBondContact O-N 3.17Å; L205-I221 HydrophobicContact CB-CG2 3.98Å
206	I	87.8	Confident	84	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-47	175.5	-70.6	164	0	0	0	110.9	F202 A203 G208 Y209 L210 I221 E222 T236 K240	F202-I206 WeakPolarHBondContact O-CB 3.33Å; F202-I206 VanDerWaalsContact O-CG1 3.27Å; F202-I206 WeakPolarHBondContact O-CG1 3.46Å; F202-I206 PolarHBondContact O-N 3.49Å; A203-I206 PolarHBondContact O-N 3.46Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.18Å; I206-Y209 PolarHBondContact O-N 2.87Å; I206-L210 HydrophobicContact CG2-CD1 3.89Å; I206-L210 HydrophobicContact CG2-CG 4.45Å; I206-L210 WeakPolarHBondContact O-CB 3.47Å; I206-L210 VanDerWaalsContact O-CG 3.26Å; I206-L210 WeakPolarHBondContact O-CG 3.45Å; I206-L210 PolarHBondContact O-N 3.48Å; I206-I221 HydrophobicContact CD1-CG2 4.24Å; I206-I221 HydrophobicContact CG1-CB 4.16Å; I206-I221 HydrophobicContact CG1-CG2 3.71Å; I206-E222 HydrophobicContact CD1-CB 4.08Å; I206-E222 HydrophobicContact CD1-CG 4.14Å; I206-T236 HydrophobicContact CD1-CG2 3.69Å; I206-K240 HydrophobicContact CG2-CD 4.38Å; I206-K240 HydrophobicContact CG2-CG 3.7Å
207	N	84.8	Confident	84.2	Confident	17 Å²	17	35.5 Å²	35.5	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-55	-48.2	173.5	-176	27.5	0	0	0	111	A203 S204 L205 L210 K211 A239	A203-N207 WeakPolarHBondContact O-CB 3.27Å; A203-N207 PolarHBondContact O-N 2.87Å; S204-N207 WeakPolarHBondContact O-CB 3.31Å; S204-N207 PolarHBondContact O-N 3.3Å; L205-N207 PolarHBondContact O-N 2.91Å; N207-L210 PolarHBondContact O-N 3.04Å; N207-K211 WeakPolarHBondContact O-CB 3.18Å; N207-K211 VanDerWaalsContact O-CG 3.32Å; N207-K211 WeakPolarHBondContact O-CG 3.17Å; N207-K211 PolarHBondContact O-N 3.1Å; N207-K211 VanDerWaalsContact OD1-CE 3.23Å; N207-K211 WeakPolarHBondContact OD1-CE 3.17Å; N207-A239 HydrophobicContact CB-CB 3.89Å
208	G	84.5	Confident	84.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-51	180	0	0	0	0	0	113.5	C175 I180 S204 L205 I206 L210 K211 A212	C175-G208 WeakPolarHBondContact O-CA 3.43Å; I180-G208 VanDerWaalsContact CD1-CA 3.44Å; I180-G208 WeakPolarHBondContact CD1-O 3.31Å; S204-G208 PolarHBondContact O-N 3.24Å; L205-G208 PolarHBondContact O-N 3Å; L205-G208 VanDerWaalsContact O-N 3.17Å; I206-G208 VanDerWaalsContact C-N 3.31Å; I206-G208 PolarHBondContact O-N 3.18Å; G208-L210 VanDerWaalsContact C-N 3.29Å; G208-L210 PolarHBondContact O-N 2.91Å; G208-K211 PolarHBondContact O-N 3.41Å; G208-A212 WeakPolarHBondContact O-CB 3.34Å; G208-A212 PolarHBondContact O-N 3.4Å
209	Y	86.4	Confident	84.4	Confident	35 Å²	35	35 Å²	35	14%	0.137	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-40.6	178.9	-81.1	-69.7	0	0	0	111.2	I180 L205 I206 A212 N213 D214 N217 I221	I180-Y209 HydrophobicContact CG2-CD1 4.06Å; I180-Y209 HydrophobicContact CG2-CE1 3.52Å; I180-Y209 HydrophobicContact CG2-CE2 4.04Å; L205-Y209 HydrophobicContact CB-CD2 4.4Å; L205-Y209 HydrophobicContact CB-CE2 4.45Å; L205-Y209 WeakPolarHBondContact O-CD2 3.4Å; L205-Y209 PolarHBondContact O-N 3.17Å; I206-Y209 PolarHBondContact O-N 2.87Å; Y209-A212 CarbonylContact O-C 3.45Å; Y209-A212 PolarHBondContact O-N 3.39Å; Y209-N213 PolarHBondContact O-N 2.95Å; Y209-D214 HydrophobicContact CD1-CB 4.09Å; Y209-D214 WeakPolarHBondContact O-CA 3.34Å; Y209-D214 PolarHBondContact O-N 2.87Å; Y209-N217 HydrophobicContact CD1-CB 3.34Å; Y209-N217 HydrophobicContact CD2-CB 4.39Å; Y209-N217 HydrophobicContact CE1-CB 3.33Å; Y209-N217 HydrophobicContact CE2-CB 4.43Å; Y209-N217 HydrophobicContact CG-CB 3.89Å; Y209-I221 HydrophobicContact CD2-CG1 3.84Å; Y209-I221 HydrophobicContact CE2-CD1 4.06Å; Y209-I221 HydrophobicContact CE2-CG1 3.6Å
210	L	82.7	Confident	84.6	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-63.9	-46.2	172.7	-68.7	175.1	0	0	0	111.9	I206 N207 G208 A212 N213 E215 A218 K240 A243 Y244 Q247	I206-L210 HydrophobicContact CG2-CD1 3.89Å; I206-L210 HydrophobicContact CG2-CG 4.45Å; I206-L210 WeakPolarHBondContact O-CB 3.47Å; I206-L210 VanDerWaalsContact O-CG 3.26Å; I206-L210 WeakPolarHBondContact O-CG 3.45Å; I206-L210 PolarHBondContact O-N 3.48Å; N207-L210 PolarHBondContact O-N 3.04Å; G208-L210 VanDerWaalsContact C-N 3.29Å; G208-L210 PolarHBondContact O-N 2.91Å; L210-A212 PolarHBondContact O-N 3.35Å; L210-N213 WeakPolarHBondContact O-CA 3.47Å; L210-N213 PolarHBondContact O-N 3.25Å; L210-E215 HydrophobicContact CD2-CB 4.49Å; L210-E215 HydrophobicContact CD2-CG 4.02Å; L210-A218 HydrophobicContact CD2-CB 3.67Å; L210-A218 HydrophobicContact CG-CB 3.72Å; L210-K240 HydrophobicContact CD1-CB 4.2Å; L210-K240 HydrophobicContact CD1-CG 3.85Å; L210-A243 HydrophobicContact CB-CB 3.38Å; L210-A243 HydrophobicContact CD1-CB 3.91Å; L210-A243 HydrophobicContact CG-CB 4.3Å; L210-Y244 HydrophobicContact CD1-CE1 4.36Å; L210-Y244 HydrophobicContact CD2-CE1 4.12Å; L210-Q247 PolarHBondContact O-NE2 2.97Å
211	K	76.8	Confident	84.9	Confident	28 Å²	28	30.5 Å²	30.5	12%	0.122	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-27.3	173.4	-74.2	-175.3	-174.2	-143.3	0	113.8	Q176 N207 G208 N213 A243 E246	Q176-K211 WeakPolarHBondContact O-CD 3.32Å; Q176-K211 PolarHBondContact O-NZ 3.47Å; N207-K211 WeakPolarHBondContact O-CB 3.18Å; N207-K211 VanDerWaalsContact O-CG 3.32Å; N207-K211 WeakPolarHBondContact O-CG 3.17Å; N207-K211 PolarHBondContact O-N 3.1Å; N207-K211 VanDerWaalsContact OD1-CE 3.23Å; N207-K211 WeakPolarHBondContact OD1-CE 3.17Å; G208-K211 PolarHBondContact O-N 3.41Å; K211-N213 VanDerWaalsContact C-N 3.26Å; K211-A243 HydrophobicContact CG-CB 4.43Å; K211-E246 VanDerWaalsContact CE-CD 3.43Å; K211-E246 VanDerWaalsContact CE-OE1 3.29Å; K211-E246 WeakPolarHBondContact CE-OE1 3.4Å; K211-E246 WeakPolarHBondContact CE-OE2 3.36Å; K211-E246 IonicContact NZ-OE1 2.68Å; K211-E246 PolarHBondContact NZ-OE1 3.45Å; K211-E246 IonicContact NZ-OE2 3.79Å; K211-E246 PolarHBondContact NZ-OE2 2.82Å
212	A	78.4	Confident	84.8	Confident	55 Å²	55	31.6 Å²	31.6	46%	0.455	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.7	173.5	0	0	0	0	0	113.9	I180 G208 Y209 L210 D214	I180-A212 HydrophobicContact CG1-CB 4.21Å; G208-A212 WeakPolarHBondContact O-CB 3.34Å; G208-A212 PolarHBondContact O-N 3.4Å; Y209-A212 CarbonylContact O-C 3.45Å; Y209-A212 PolarHBondContact O-N 3.39Å; L210-A212 PolarHBondContact O-N 3.35Å; A212-D214 PolarHBondContact O-N 2.9Å
213	N	76.4	Confident	84.7	Confident	57 Å²	57	37.8 Å²	37.8	31%	0.305	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	28.2	-171.6	-69.1	2.9	0	0	0	114.3	Y209 L210 K211	Y209-N213 PolarHBondContact O-N 2.95Å; L210-N213 WeakPolarHBondContact O-CA 3.47Å; L210-N213 PolarHBondContact O-N 3.25Å; K211-N213 VanDerWaalsContact C-N 3.26Å
214	D	82.8	Confident	84.9	Confident	50 Å²	50	40.8 Å²	40.8	27%	0.267	24%	0.237	S	C	.	.			trans	-105.1	69	-179.7	-168.6	-14	0	0	0	110.6	Y209 A212 A216 N217 A218	Y209-D214 HydrophobicContact CD1-CB 4.09Å; Y209-D214 WeakPolarHBondContact O-CA 3.34Å; Y209-D214 PolarHBondContact O-N 2.87Å; A212-D214 PolarHBondContact O-N 2.9Å; D214-A216 PolarHBondContact O-N 2.93Å; D214-N217 PolarHBondContact O-N 2.67Å; D214-N217 WeakPolarHBondContact OD1-CB 3.36Å; D214-N217 PolarHBondContact OD1-N 3.38Å; D214-N217 PolarHBondContact OD1-ND2 3.21Å; D214-N217 PolarHBondContact OD2-ND2 2.87Å; D214-A218 WeakPolarHBondContact O-CB 3.33Å; D214-A218 PolarHBondContact O-N 3.39Å
215	E	80.9	Confident	84.9	Confident	88 Å²	88	40.2 Å²	40.2	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-27.3	179	-60	-165.8	152.4	0	0	112.7	L210 S219	L210-E215 HydrophobicContact CD2-CB 4.49Å; L210-E215 HydrophobicContact CD2-CG 4.02Å; E215-S219 VanDerWaalsContact O-CB 3.31Å; E215-S219 WeakPolarHBondContact O-CB 3.13Å; E215-S219 PolarHBondContact O-N 3.28Å; E215-S219 PolarHBondContact O-OG 3.33Å
216	A	85.5	Confident	84.8	Confident	74 Å²	74	45.1 Å²	45.1	61%	0.612	25%	0.254	S	S	*	.	H	α-helix	trans	-65.9	-52.1	177.8	0	0	0	0	0	110.9	D214 S219 A220	D214-A216 PolarHBondContact O-N 2.93Å; A216-S219 PolarHBondContact O-N 2.85Å; A216-A220 PolarHBondContact O-N 2.74Å
217	N	87.3	Confident	84.8	Confident	69 Å²	69	49.5 Å²	49.5	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-70.8	-33.1	175	-77.1	-51	0	0	0	112.4	Y209 D214 S219 A220 I221	Y209-N217 HydrophobicContact CD1-CB 3.34Å; Y209-N217 HydrophobicContact CD2-CB 4.39Å; Y209-N217 HydrophobicContact CE1-CB 3.33Å; Y209-N217 HydrophobicContact CE2-CB 4.43Å; Y209-N217 HydrophobicContact CG-CB 3.89Å; D214-N217 PolarHBondContact O-N 2.67Å; D214-N217 WeakPolarHBondContact OD1-CB 3.36Å; D214-N217 PolarHBondContact OD1-N 3.38Å; D214-N217 PolarHBondContact OD1-ND2 3.21Å; D214-N217 PolarHBondContact OD2-ND2 2.87Å; N217-S219 VanDerWaalsContact C-N 3.29Å; N217-S219 PolarHBondContact O-N 2.95Å; N217-A220 PolarHBondContact O-N 3.17Å; N217-I221 WeakPolarHBondContact O-CB 3.42Å; N217-I221 VanDerWaalsContact O-CG1 3.23Å; N217-I221 WeakPolarHBondContact O-CG1 3.41Å; N217-I221 PolarHBondContact O-N 3.38Å
218	A	85.7	Confident	84.7	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-57.5	-44.2	171.6	0	0	0	0	0	111.5	L210 D214 I221 E222	L210-A218 HydrophobicContact CD2-CB 3.67Å; L210-A218 HydrophobicContact CG-CB 3.72Å; D214-A218 WeakPolarHBondContact O-CB 3.33Å; D214-A218 PolarHBondContact O-N 3.39Å; A218-I221 PolarHBondContact O-N 2.89Å; A218-E222 PolarHBondContact O-N 3.37Å
219	S	85.6	Confident	84.6	Confident	66 Å²	66	58.6 Å²	58.6	46%	0.462	34%	0.338	S	S	.	.	H	α-helix	trans	-65.5	-43.6	175.5	-57.9	0	0	0	0	111.9	E215 A216 N217 I221 E222 E223	E215-S219 VanDerWaalsContact O-CB 3.31Å; E215-S219 WeakPolarHBondContact O-CB 3.13Å; E215-S219 PolarHBondContact O-N 3.28Å; E215-S219 PolarHBondContact O-OG 3.33Å; A216-S219 PolarHBondContact O-N 2.85Å; N217-S219 VanDerWaalsContact C-N 3.29Å; N217-S219 PolarHBondContact O-N 2.95Å; S219-I221 VanDerWaalsContact C-N 3.31Å; S219-I221 PolarHBondContact O-N 3.44Å; S219-E222 CarbonylContact O-C 3.54Å; S219-E222 WeakPolarHBondContact O-CB 3.3Å; S219-E222 PolarHBondContact O-N 3.35Å; S219-E222 VanDerWaalsContact O-N 3.1Å; S219-E223 PolarHBondContact O-N 2.83Å
220	A	89.5	Confident	84.4	Confident	45 Å²	45	59.5 Å²	59.5	37%	0.372	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-34.4	176.1	0	0	0	0	0	112.8	A216 N217 E223 L224	A216-A220 PolarHBondContact O-N 2.74Å; N217-A220 PolarHBondContact O-N 3.17Å; A220-E223 PolarHBondContact O-N 2.69Å; A220-L224 VanDerWaalsContact O-CB 3.27Å; A220-L224 WeakPolarHBondContact O-CB 3.21Å; A220-L224 PolarHBondContact O-N 3.3Å
221	I	89	Confident	84.2	Confident	21 Å²	21	69.7 Å²	69.7	11%	0.108	38%	0.384	C	S	.	.	H	α-helix	trans	-71	-35.2	172.7	-66.3	-66.4	0	0	0	111.1	F202 L205 I206 Y209 N217 A218 S219 L224 M225	F202-I221 HydrophobicContact CD1-CG2 3.79Å; L205-I221 HydrophobicContact CB-CG2 3.98Å; I206-I221 HydrophobicContact CD1-CG2 4.24Å; I206-I221 HydrophobicContact CG1-CB 4.16Å; I206-I221 HydrophobicContact CG1-CG2 3.71Å; Y209-I221 HydrophobicContact CD2-CG1 3.84Å; Y209-I221 HydrophobicContact CE2-CD1 4.06Å; Y209-I221 HydrophobicContact CE2-CG1 3.6Å; N217-I221 WeakPolarHBondContact O-CB 3.42Å; N217-I221 VanDerWaalsContact O-CG1 3.23Å; N217-I221 WeakPolarHBondContact O-CG1 3.41Å; N217-I221 PolarHBondContact O-N 3.38Å; A218-I221 PolarHBondContact O-N 2.89Å; S219-I221 VanDerWaalsContact C-N 3.31Å; S219-I221 PolarHBondContact O-N 3.44Å; I221-L224 HydrophobicContact CD1-CD2 4.27Å; I221-L224 PolarHBondContact O-N 3.43Å; I221-M225 WeakPolarHBondContact O-CB 3.22Å; I221-M225 PolarHBondContact O-N 2.95Å
222	E	85.4	Confident	84.1	Confident	24 Å²	24	69.3 Å²	69.3	11%	0.112	38%	0.384	C	S	.	.	H	α-helix	trans	-67	-38.4	172.9	-151.8	-166.7	105.9	0	0	111.7	I206 A218 S219 M225 K226 P232 K240	I206-E222 HydrophobicContact CD1-CB 4.08Å; I206-E222 HydrophobicContact CD1-CG 4.14Å; A218-E222 PolarHBondContact O-N 3.37Å; S219-E222 CarbonylContact O-C 3.54Å; S219-E222 WeakPolarHBondContact O-CB 3.3Å; S219-E222 PolarHBondContact O-N 3.35Å; S219-E222 VanDerWaalsContact O-N 3.1Å; E222-M225 WeakPolarHBondContact O-CB 3.35Å; E222-M225 PolarHBondContact O-N 3.22Å; E222-K226 WeakPolarHBondContact O-CD 3.22Å; E222-K226 VanDerWaalsContact O-CG 3.27Å; E222-K226 WeakPolarHBondContact O-CG 3.25Å; E222-K226 PolarHBondContact O-N 3.41Å; E222-K226 VanDerWaalsContact OE1-CE 3.32Å; E222-K226 WeakPolarHBondContact OE1-CE 3.48Å; E222-K226 IonicContact OE1-NZ 3.05Å; E222-K226 PolarHBondContact OE1-NZ 2.77Å; E222-P232 HydrophobicContact CG-CG 3.78Å; E222-K240 IonicContact OE2-NZ 3.92Å; E222-K240 PolarHBondContact OE2-NZ 2.82Å
223	E	88.2	Confident	83.9	Confident	134 Å²	134	67.4 Å²	67.4	63%	0.626	37%	0.369	S	S	*	.	H	α-helix	trans	-68.7	-39.4	171.2	-70.6	-171.8	167.8	0	0	112.6	S219 A220 M225 K226 S227	S219-E223 PolarHBondContact O-N 2.83Å; A220-E223 PolarHBondContact O-N 2.69Å; E223-M225 VanDerWaalsContact C-N 3.32Å; E223-M225 PolarHBondContact O-N 3.01Å; E223-K226 PolarHBondContact O-N 2.74Å; E223-S227 PolarHBondContact O-N 3.13Å; E223-S227 PolarHBondContact O-OG 3.37Å
224	L	88.3	Confident	83.7	Confident	69 Å²	69	66.8 Å²	66.8	36%	0.361	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-41	173.4	-177.4	61.8	0	0	0	111	F202 A220 I221 S227 R228	F202-L224 HydrophobicContact CE1-CB 4.3Å; F202-L224 HydrophobicContact CE1-CD2 4.07Å; F202-L224 HydrophobicContact CE1-CG 3.94Å; F202-L224 HydrophobicContact CZ-CG 4.42Å; A220-L224 VanDerWaalsContact O-CB 3.27Å; A220-L224 WeakPolarHBondContact O-CB 3.21Å; A220-L224 PolarHBondContact O-N 3.3Å; I221-L224 HydrophobicContact CD1-CD2 4.27Å; I221-L224 PolarHBondContact O-N 3.43Å; L224-S227 WeakPolarHBondContact CA-OG 3.4Å; L224-S227 PolarHBondContact O-N 3.23Å; L224-S227 PolarHBondContact O-OG 3.39Å; L224-R228 WeakPolarHBondContact O-CB 3.31Å; L224-R228 WeakPolarHBondContact O-CG 3.31Å; L224-R228 PolarHBondContact O-N 3.03Å
225	M	88.5	Confident	83.3	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-58.4	-50.3	172.7	-173.5	-176.3	174.9	0	0	110.7	E199 F202 I221 E222 E223 S227 R228 L230 R231 P232	E199-M225 HydrophobicContact CB-CE 3.97Å; E199-M225 HydrophobicContact CG-CE 3.71Å; F202-M225 HydrophobicContact CB-CB 4.24Å; F202-M225 HydrophobicContact CB-CG 4.01Å; F202-M225 HydrophobicContact CB-SD 3.83Å; F202-M225 HydrophobicContact CD1-CB 3.72Å; F202-M225 HydrophobicContact CD1-CG 4.25Å; F202-M225 HydrophobicContact CD2-CB 4.35Å; F202-M225 HydrophobicContact CD2-CG 4.07Å; F202-M225 HydrophobicContact CE1-CB 4.15Å; F202-M225 HydrophobicContact CG-CB 3.85Å; F202-M225 HydrophobicContact CG-CG 3.85Å; F202-M225 HydrophobicContact CG-SD 4.35Å; I221-M225 WeakPolarHBondContact O-CB 3.22Å; I221-M225 PolarHBondContact O-N 2.95Å; E222-M225 WeakPolarHBondContact O-CB 3.35Å; E222-M225 PolarHBondContact O-N 3.22Å; E223-M225 VanDerWaalsContact C-N 3.32Å; E223-M225 PolarHBondContact O-N 3.01Å; M225-S227 PolarHBondContact O-N 3.46Å; M225-R228 WeakPolarHBondContact O-CB 3.41Å; M225-R228 PolarHBondContact O-N 3.46Å; M225-R228 VanDerWaalsContact O-N 3.16Å; M225-L230 CarbonylContact C-O 3.43Å; M225-L230 HydrophobicContact CE-CB 3.9Å; M225-L230 HydrophobicContact CG-CB 3.56Å; M225-L230 HydrophobicContact CG-CD1 4.45Å; M225-L230 WeakPolarHBondContact O-CB 3.33Å; M225-L230 PolarHBondContact O-N 2.86Å; M225-R231 VanDerWaalsContact CE-C 3.46Å; M225-R231 WeakPolarHBondContact CE-O 3.39Å; M225-P232 HydrophobicContact SD-CG 4.42Å
226	K	86.2	Confident	83.1	Confident	106 Å²	106	63.7 Å²	63.7	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-44.8	177	-71.2	161.1	-178.7	166.8	0	112.6	E222 E223 R228 G229 L230	E222-K226 WeakPolarHBondContact O-CD 3.22Å; E222-K226 VanDerWaalsContact O-CG 3.27Å; E222-K226 WeakPolarHBondContact O-CG 3.25Å; E222-K226 PolarHBondContact O-N 3.41Å; E222-K226 VanDerWaalsContact OE1-CE 3.32Å; E222-K226 WeakPolarHBondContact OE1-CE 3.48Å; E222-K226 IonicContact OE1-NZ 3.05Å; E222-K226 PolarHBondContact OE1-NZ 2.77Å; E223-K226 PolarHBondContact O-N 2.74Å; K226-R228 VanDerWaalsContact C-N 3.28Å; K226-R228 PolarHBondContact O-N 2.8Å; K226-G229 PolarHBondContact O-N 2.72Å; K226-L230 VanDerWaalsContact CA-O 3.29Å; K226-L230 WeakPolarHBondContact CA-O 3.43Å; K226-L230 PolarHBondContact N-O 3.07Å
227	S	87.1	Confident	82.4	Confident	93 Å²	93	61.1 Å²	61.1	65%	0.65	33%	0.33	S	S	*	.	H	α-helix	trans	-67.8	-24.9	177.9	66.4	0	0	0	0	113.7	E223 L224 M225 G229	E223-S227 PolarHBondContact O-N 3.13Å; E223-S227 PolarHBondContact O-OG 3.37Å; L224-S227 WeakPolarHBondContact CA-OG 3.4Å; L224-S227 PolarHBondContact O-N 3.23Å; L224-S227 PolarHBondContact O-OG 3.39Å; M225-S227 PolarHBondContact O-N 3.46Å; S227-G229 PolarHBondContact O-N 3.03Å
228	R	83.8	Confident	81.6	Confident	141 Å²	141	58.8 Å²	58.8	53%	0.532	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	3.2	170.3	-68.9	-77.2	-179.7	96.7	-2.5	113.5	F202 L224 M225 K226 L230	F202-R228 HydrophobicContact CZ-CG 4.16Å; L224-R228 WeakPolarHBondContact O-CB 3.31Å; L224-R228 WeakPolarHBondContact O-CG 3.31Å; L224-R228 PolarHBondContact O-N 3.03Å; M225-R228 WeakPolarHBondContact O-CB 3.41Å; M225-R228 PolarHBondContact O-N 3.46Å; M225-R228 VanDerWaalsContact O-N 3.16Å; K226-R228 VanDerWaalsContact C-N 3.28Å; K226-R228 PolarHBondContact O-N 2.8Å; R228-L230 VanDerWaalsContact C-N 3.25Å; R228-L230 PolarHBondContact O-N 3.35Å
229	G	82.1	Confident	81.1	Confident	66 Å²	66	59 Å²	59	68%	0.68	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	6.8	-176.7	0	0	0	0	0	114.3	K226 S227	K226-G229 PolarHBondContact O-N 2.72Å; S227-G229 PolarHBondContact O-N 3.03Å
230	L	82.3	Confident	80.7	Confident	54 Å²	54	56.6 Å²	56.6	28%	0.283	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-91.7	130.4	175.2	-61	173.3	0	0	0	108.9	F202 M225 K226 R228	F202-L230 HydrophobicContact CD2-CD1 3.67Å; F202-L230 HydrophobicContact CE2-CD1 3.56Å; M225-L230 CarbonylContact C-O 3.43Å; M225-L230 HydrophobicContact CE-CB 3.9Å; M225-L230 HydrophobicContact CG-CB 3.56Å; M225-L230 HydrophobicContact CG-CD1 4.45Å; M225-L230 WeakPolarHBondContact O-CB 3.33Å; M225-L230 PolarHBondContact O-N 2.86Å; K226-L230 VanDerWaalsContact CA-O 3.29Å; K226-L230 WeakPolarHBondContact CA-O 3.43Å; K226-L230 PolarHBondContact N-O 3.07Å; R228-L230 VanDerWaalsContact C-N 3.25Å; R228-L230 PolarHBondContact O-N 3.35Å
231	R	77.6	Confident	79.8	Confident	219 Å²	219	54.7 Å²	54.7	83%	0.826	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-97	139.4	174.9	-64.5	-175.8	179.9	-168.3	-0.8	109.5	M225 G233	M225-R231 VanDerWaalsContact CE-C 3.46Å; M225-R231 WeakPolarHBondContact CE-O 3.39Å; R231-G233 PolarHBondContact O-N 2.81Å; R231-G233 VanDerWaalsContact O-N 3.11Å
232	P	76.4	Confident	78.8	Confident	20 Å²	20	55.1 Å²	55.1	13%	0.13	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-47.1	117.9	170.1	-31.8	38.5	0	0	0	111.3	E222 M225 T236 Y237 I288	E222-P232 HydrophobicContact CG-CG 3.78Å; M225-P232 HydrophobicContact SD-CG 4.42Å; P232-T236 HydrophobicContact CB-CG2 3.87Å; P232-T236 HydrophobicContact CG-CG2 4.5Å; P232-Y237 HydrophobicContact CB-CD2 4.44Å; P232-Y237 HydrophobicContact CB-CE2 3.71Å; P232-I288 WeakPolarHBondContact O-CD1 3.43Å
233	G	72.9	Confident	78.2	Confident	14 Å²	14	54 Å²	54	14%	0.144	28%	0.282	C	S	.	.			trans	-111.5	-170.2	-179.2	0	0	0	0	0	111.2	E199 R231 L235 T236 Y237	E199-G233 WeakPolarHBondContact OE1-CA 3.32Å; E199-G233 PolarHBondContact OE1-N 3.38Å; R231-G233 PolarHBondContact O-N 2.81Å; R231-G233 VanDerWaalsContact O-N 3.11Å; G233-L235 PolarHBondContact O-N 3.2Å; G233-T236 PolarHBondContact N-OG1 3.44Å; G233-T236 WeakPolarHBondContact O-CB 3.45Å; G233-T236 PolarHBondContact O-N 2.89Å; G233-Y237 WeakPolarHBondContact O-CD2 3.36Å; G233-Y237 PolarHBondContact O-N 3.46Å; G233-Y237 VanDerWaalsContact O-N 3.08Å
234	S	71.9	Confident	77.4	Confident	45 Å²	45	48.6 Å²	48.6	32%	0.315	26%	0.256	S	S	.	.	H	α-helix	trans	-57.6	-35	-175.9	56.1	0	0	0	0	112.6	E199 Y237 V238 F289	E199-S234 PolarHBondContact OE1-N 3.26Å; S234-Y237 PolarHBondContact O-N 3.45Å; S234-V238 WeakPolarHBondContact O-CB 3.42Å; S234-V238 VanDerWaalsContact O-CG2 3.26Å; S234-V238 WeakPolarHBondContact O-CG2 3.29Å; S234-V238 PolarHBondContact O-N 3.47Å; S234-F289 WeakPolarHBondContact CB-O 3.5Å
235	L	74.7	Confident	76.3	Confident	72 Å²	72	45.4 Å²	45.4	38%	0.377	24%	0.24	S	C	.	.	H	α-helix	trans	-67.4	-37.5	177	-64	174.5	0	0	0	111.6	E199 R200 A203 G233 A239	E199-L235 HydrophobicContact CG-CB 4.23Å; E199-L235 WeakPolarHBondContact OE1-CB 3.47Å; E199-L235 PolarHBondContact OE1-N 2.96Å; E199-L235 VanDerWaalsContact OE1-N 3.15Å; R200-L235 HydrophobicContact CB-CD1 4.28Å; A203-L235 HydrophobicContact CB-CB 4.09Å; G233-L235 PolarHBondContact O-N 3.2Å; L235-A239 WeakPolarHBondContact O-CB 3.24Å; L235-A239 PolarHBondContact O-N 2.96Å
236	T	76.2	Confident	75.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-43.3	174.7	-48.7	0	0	0	0	111.5	E199 I206 P232 G233 A239 K240	E199-T236 PolarHBondContact OE1-N 3.49Å; I206-T236 HydrophobicContact CD1-CG2 3.69Å; P232-T236 HydrophobicContact CB-CG2 3.87Å; P232-T236 HydrophobicContact CG-CG2 4.5Å; G233-T236 PolarHBondContact N-OG1 3.44Å; G233-T236 WeakPolarHBondContact O-CB 3.45Å; G233-T236 PolarHBondContact O-N 2.89Å; T236-A239 WeakPolarHBondContact O-CB 3.35Å; T236-A239 PolarHBondContact O-N 3.06Å; T236-K240 HydrophobicContact CG2-CD 4.5Å; T236-K240 WeakPolarHBondContact O-CG 3.26Å; T236-K240 PolarHBondContact O-N 3.04Å
237	Y	71.3	Confident	74.2	Confident	20 Å²	20	45 Å²	45	8%	0.078	24%	0.239	C	C	.	.	H	α-helix	trans	-72.7	-37.2	179.2	-77.5	-83.3	0	0	0	113.1	P232 G233 S234 K240 L241 L279 E282 V283 I288	P232-Y237 HydrophobicContact CB-CD2 4.44Å; P232-Y237 HydrophobicContact CB-CE2 3.71Å; G233-Y237 WeakPolarHBondContact O-CD2 3.36Å; G233-Y237 PolarHBondContact O-N 3.46Å; G233-Y237 VanDerWaalsContact O-N 3.08Å; S234-Y237 PolarHBondContact O-N 3.45Å; Y237-K240 PolarHBondContact O-N 3.41Å; Y237-L241 WeakPolarHBondContact O-CB 3.49Å; Y237-L241 WeakPolarHBondContact O-CG 3.2Å; Y237-L241 PolarHBondContact O-N 2.96Å; Y237-L279 HydrophobicContact CD1-CD1 3.49Å; Y237-L279 VanDerWaalsContact CD1-CD1 3.49Å; Y237-L279 HydrophobicContact CD1-CG 4.12Å; Y237-L279 HydrophobicContact CE1-CD1 3.76Å; Y237-E282 HydrophobicContact CD1-CB 4.49Å; Y237-E282 HydrophobicContact CE1-CB 3.62Å; Y237-E282 WeakPolarHBondContact CE1-OE2 3.32Å; Y237-V283 HydrophobicContact CD1-CG2 3.47Å; Y237-V283 VanDerWaalsContact CD1-CG2 3.47Å; Y237-V283 HydrophobicContact CE1-CG2 4.34Å; Y237-V283 HydrophobicContact CG-CG2 3.64Å; Y237-I288 HydrophobicContact CD2-CD1 3.29Å; Y237-I288 HydrophobicContact CD2-CG2 4.41Å; Y237-I288 HydrophobicContact CE2-CD1 3.11Å; Y237-I288 HydrophobicContact CG-CD1 4.33Å
238	V	71	Confident	72.6	Confident	21 Å²	21	41 Å²	41	13%	0.127	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-45.5	169.7	172.8	0	0	0	0	110.2	S234 K240 L241 L242 L290 D294	S234-V238 WeakPolarHBondContact O-CB 3.42Å; S234-V238 VanDerWaalsContact O-CG2 3.26Å; S234-V238 WeakPolarHBondContact O-CG2 3.29Å; S234-V238 PolarHBondContact O-N 3.47Å; V238-K240 VanDerWaalsContact C-N 3.33Å; V238-K240 PolarHBondContact O-N 3.41Å; V238-L241 WeakPolarHBondContact O-CB 3.48Å; V238-L241 PolarHBondContact O-N 3.4Å; V238-L241 VanDerWaalsContact O-N 3.12Å; V238-L242 HydrophobicContact CG1-CD1 4Å; V238-L242 HydrophobicContact CG1-CG 4.01Å; V238-L242 WeakPolarHBondContact O-CB 3.49Å; V238-L242 VanDerWaalsContact O-CG 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.16Å; V238-L242 PolarHBondContact O-N 3.07Å; V238-L290 HydrophobicContact CG2-CD2 3.6Å; V238-D294 HydrophobicContact CG2-CB 3.75Å
239	A	75.3	Confident	70.8	Confident	9 Å²	9	38.4 Å²	38.4	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-45.4	174.5	0	0	0	0	0	113	A203 N207 L235 T236 A243	A203-A239 HydrophobicContact CB-CB 4.02Å; A203-A239 WeakPolarHBondContact O-CB 3.47Å; N207-A239 HydrophobicContact CB-CB 3.89Å; L235-A239 WeakPolarHBondContact O-CB 3.24Å; L235-A239 PolarHBondContact O-N 2.96Å; T236-A239 WeakPolarHBondContact O-CB 3.35Å; T236-A239 PolarHBondContact O-N 3.06Å; A239-A243 WeakPolarHBondContact O-CB 3.19Å; A239-A243 PolarHBondContact O-N 2.92Å
240	K	77.1	Confident	69	Low	16 Å²	16	44.9 Å²	44.9	7%	0.07	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-41.7	174.6	-65.9	174.8	78	174.6	0	111.7	I206 L210 E222 T236 Y237 V238 A243 Y244 L279 E282	I206-K240 HydrophobicContact CG2-CD 4.38Å; I206-K240 HydrophobicContact CG2-CG 3.7Å; L210-K240 HydrophobicContact CD1-CB 4.2Å; L210-K240 HydrophobicContact CD1-CG 3.85Å; E222-K240 IonicContact OE2-NZ 3.92Å; E222-K240 PolarHBondContact OE2-NZ 2.82Å; T236-K240 HydrophobicContact CG2-CD 4.5Å; T236-K240 WeakPolarHBondContact O-CG 3.26Å; T236-K240 PolarHBondContact O-N 3.04Å; Y237-K240 PolarHBondContact O-N 3.41Å; V238-K240 VanDerWaalsContact C-N 3.33Å; V238-K240 PolarHBondContact O-N 3.41Å; K240-A243 PolarHBondContact O-N 3.41Å; K240-Y244 HydrophobicContact CB-CE2 4.19Å; K240-Y244 WeakPolarHBondContact O-CB 3.3Å; K240-Y244 WeakPolarHBondContact O-CD2 3.09Å; K240-Y244 VanDerWaalsContact O-CG 3.31Å; K240-Y244 PolarHBondContact O-N 3.46Å; K240-L279 VanDerWaalsContact C-CD2 3.43Å; K240-L279 HydrophobicContact CB-CD1 3.87Å; K240-L279 HydrophobicContact CB-CD2 3.42Å; K240-L279 VanDerWaalsContact CB-CD2 3.42Å; K240-L279 HydrophobicContact CB-CG 4.33Å; K240-L279 HydrophobicContact CD-CD1 4.04Å; K240-E282 IonicContact NZ-OE2 3.53Å; K240-E282 PolarHBondContact NZ-OE2 3.13Å
241	L	69.9	Low	67	Low	5 Å²	5	49 Å²	49	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-46.1	177.3	-80.7	168.8	0	0	0	111.6	Y237 V238 A245 F276 L279 F280 L290	Y237-L241 WeakPolarHBondContact O-CB 3.49Å; Y237-L241 WeakPolarHBondContact O-CG 3.2Å; Y237-L241 PolarHBondContact O-N 2.96Å; V238-L241 WeakPolarHBondContact O-CB 3.48Å; V238-L241 PolarHBondContact O-N 3.4Å; V238-L241 VanDerWaalsContact O-N 3.12Å; L241-A245 WeakPolarHBondContact O-CB 3.47Å; L241-A245 PolarHBondContact O-N 2.98Å; L241-F276 HydrophobicContact CD2-CD2 3.94Å; L241-F276 HydrophobicContact CD2-CE2 3.55Å; L241-F276 HydrophobicContact CD2-CZ 3.86Å; L241-L279 HydrophobicContact CB-CD2 4.1Å; L241-L279 HydrophobicContact CD2-CD2 3.76Å; L241-L279 HydrophobicContact CD2-CG 4.33Å; L241-L279 HydrophobicContact CG-CD2 3.56Å; L241-L279 HydrophobicContact CG-CG 4.31Å; L241-F280 HydrophobicContact CD1-CE2 4.39Å; L241-F280 HydrophobicContact CD1-CZ 4.2Å; L241-F280 HydrophobicContact CD2-CD2 3.81Å; L241-F280 HydrophobicContact CD2-CE2 3.48Å; L241-F280 VanDerWaalsContact CD2-CE2 3.48Å; L241-F280 HydrophobicContact CD2-CZ 4.11Å; L241-L290 HydrophobicContact CD1-CD1 3.79Å
242	L	69.6	Low	65.3	Low	30 Å²	30	41.2 Å²	41.2	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-43.1	178.9	-64.7	-169.9	0	0	0	111.3	V238 A245 E246 A298 I301	V238-L242 HydrophobicContact CG1-CD1 4Å; V238-L242 HydrophobicContact CG1-CG 4.01Å; V238-L242 WeakPolarHBondContact O-CB 3.49Å; V238-L242 VanDerWaalsContact O-CG 3.28Å; V238-L242 WeakPolarHBondContact O-CG 3.16Å; V238-L242 PolarHBondContact O-N 3.07Å; L242-A245 PolarHBondContact O-N 2.95Å; L242-E246 WeakPolarHBondContact O-CB 3.46Å; L242-E246 WeakPolarHBondContact O-CG 3.34Å; L242-E246 PolarHBondContact O-N 3.14Å; L242-A298 HydrophobicContact CD2-CB 4.47Å; L242-I301 HydrophobicContact CD1-CD1 4.03Å; L242-I301 HydrophobicContact CD2-CB 4.35Å; L242-I301 HydrophobicContact CD2-CD1 3.51Å; L242-I301 HydrophobicContact CD2-CG1 4.49Å; L242-I301 HydrophobicContact CD2-CG2 4.49Å; L242-I301 HydrophobicContact CG-CD1 4.3Å
243	A	72.9	Confident	63.2	Low	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-45.6	177	0	0	0	0	0	112.2	L210 K211 A239 K240 A245 E246 Q247	L210-A243 HydrophobicContact CB-CB 3.38Å; L210-A243 HydrophobicContact CD1-CB 3.91Å; L210-A243 HydrophobicContact CG-CB 4.3Å; K211-A243 HydrophobicContact CG-CB 4.43Å; A239-A243 WeakPolarHBondContact O-CB 3.19Å; A239-A243 PolarHBondContact O-N 2.92Å; K240-A243 PolarHBondContact O-N 3.41Å; A243-A245 VanDerWaalsContact C-N 3.31Å; A243-A245 PolarHBondContact O-N 2.84Å; A243-E246 CarbonylContact O-C 3.58Å; A243-E246 PolarHBondContact O-N 3.38Å; A243-E246 VanDerWaalsContact O-N 3.08Å; A243-Q247 WeakPolarHBondContact O-CG 3.22Å; A243-Q247 PolarHBondContact O-N 3.47Å
244	Y	70.2	Confident	61.1	Low	21 Å²	21	54.2 Å²	54.2	8%	0.082	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-33.5	175.2	-65.7	-39.1	0	0	0	112.6	L210 K240 E246 I272 L275 L279	L210-Y244 HydrophobicContact CD1-CE1 4.36Å; L210-Y244 HydrophobicContact CD2-CE1 4.12Å; K240-Y244 HydrophobicContact CB-CE2 4.19Å; K240-Y244 WeakPolarHBondContact O-CB 3.3Å; K240-Y244 WeakPolarHBondContact O-CD2 3.09Å; K240-Y244 VanDerWaalsContact O-CG 3.31Å; K240-Y244 PolarHBondContact O-N 3.46Å; Y244-E246 VanDerWaalsContact C-N 3.26Å; Y244-E246 PolarHBondContact O-N 2.96Å; Y244-I272 WeakPolarHBondContact O-CG2 3.47Å; Y244-L275 HydrophobicContact CD1-CB 4.35Å; Y244-L275 HydrophobicContact CD1-CD1 4.13Å; Y244-L275 HydrophobicContact CD2-CB 4.26Å; Y244-L275 HydrophobicContact CE1-CB 4.37Å; Y244-L275 HydrophobicContact CE1-CD1 3.92Å; Y244-L275 HydrophobicContact CE1-CD2 4.42Å; Y244-L275 HydrophobicContact CE1-CG 4.47Å; Y244-L275 HydrophobicContact CE2-CB 4.28Å; Y244-L275 HydrophobicContact CG-CB 4.32Å; Y244-L279 HydrophobicContact CD2-CB 4.47Å; Y244-L279 HydrophobicContact CD2-CD2 3.7Å; Y244-L279 HydrophobicContact CE2-CB 4.45Å; Y244-L279 HydrophobicContact CE2-CD1 4.42Å; Y244-L279 HydrophobicContact CE2-CD2 3.89Å
245	A	65.4	Low	59.2	Low	2 Å²	2	55.7 Å²	55.7	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-70	-19.3	172.9	0	0	0	0	0	113.7	L241 L242 A243 F276 I301 L302 N305	L241-A245 WeakPolarHBondContact O-CB 3.47Å; L241-A245 PolarHBondContact O-N 2.98Å; L242-A245 PolarHBondContact O-N 2.95Å; A243-A245 VanDerWaalsContact C-N 3.31Å; A243-A245 PolarHBondContact O-N 2.84Å; A245-F276 HydrophobicContact CB-CE2 4.4Å; A245-I301 HydrophobicContact CB-CG2 4.32Å; A245-L302 HydrophobicContact CB-CD2 3.65Å; A245-L302 HydrophobicContact CB-CG 4.04Å; A245-N305 PolarHBondContact O-ND2 3.15Å
246	E	66.1	Low	57.1	Low	77 Å²	77	55.7 Å²	55.7	36%	0.36	28%	0.278	S	S	.	.	H	α-helix	trans	-99.6	-30.4	176.7	-76.3	-172.5	-135.6	0	0	114	K211 L242 A243 Y244 A248 I301 N305	K211-E246 VanDerWaalsContact CE-CD 3.43Å; K211-E246 VanDerWaalsContact CE-OE1 3.29Å; K211-E246 WeakPolarHBondContact CE-OE1 3.4Å; K211-E246 WeakPolarHBondContact CE-OE2 3.36Å; K211-E246 IonicContact NZ-OE1 2.68Å; K211-E246 PolarHBondContact NZ-OE1 3.45Å; K211-E246 IonicContact NZ-OE2 3.79Å; K211-E246 PolarHBondContact NZ-OE2 2.82Å; L242-E246 WeakPolarHBondContact O-CB 3.46Å; L242-E246 WeakPolarHBondContact O-CG 3.34Å; L242-E246 PolarHBondContact O-N 3.14Å; A243-E246 CarbonylContact O-C 3.58Å; A243-E246 PolarHBondContact O-N 3.38Å; A243-E246 VanDerWaalsContact O-N 3.08Å; Y244-E246 VanDerWaalsContact C-N 3.26Å; Y244-E246 PolarHBondContact O-N 2.96Å; E246-A248 PolarHBondContact O-N 3.48Å; E246-A248 VanDerWaalsContact O-N 3.11Å; E246-I301 HydrophobicContact CG-CG2 4.07Å; E246-N305 WeakPolarHBondContact CA-ND2 3.28Å; E246-N305 VanDerWaalsContact CG-ND2 3.35Å; E246-N305 WeakPolarHBondContact CG-ND2 3.36Å
247	Q	64	Low	54.7	Low	21 Å²	21	60 Å²	60	10%	0.098	31%	0.308	C	S	.	.	S	Bend	trans	-62.3	-13.5	170	-77.4	-175.5	-18	0	0	113	L210 A243 D249 R250 I272	L210-Q247 PolarHBondContact O-NE2 2.97Å; A243-Q247 WeakPolarHBondContact O-CG 3.22Å; A243-Q247 PolarHBondContact O-N 3.47Å; Q247-D249 PolarHBondContact O-N 3.05Å; Q247-R250 PolarHBondContact O-N 3.27Å; Q247-I272 HydrophobicContact CB-CD1 4.23Å; Q247-I272 WeakPolarHBondContact O-CD1 3.03Å
248	A	53.7	Low	52.7	Low	7 Å²	7	64.4 Å²	64.4	6%	0.058	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	24.1	-170.7	0	0	0	0	0	116.6	E246 I272 H307	E246-A248 PolarHBondContact O-N 3.48Å; E246-A248 VanDerWaalsContact O-N 3.11Å; A248-I272 HydrophobicContact CB-CD1 4.27Å; A248-I272 HydrophobicContact CB-CG2 4.14Å; A248-H307 PolarHBondContact O-NE2 3.13Å
249	D	47	Very low	50.8	Low	87 Å²	87	69.6 Å²	69.6	47%	0.465	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.4	66.2	145.8	-121.4	-16.7	0	0	0	115.5	Q247 I253	Q247-D249 PolarHBondContact O-N 3.05Å; D249-I253 WeakPolarHBondContact OD1-CD1 3.45Å; D249-I253 WeakPolarHBondContact OD1-CG1 3.18Å
250	R	43.6	Very low	48.5	Very low	203 Å²	203	77.6 Å²	77.6	77%	0.766	39%	0.392	S	S	*	.	S	Bend	trans	-126.2	-15.5	165.2	-82.2	-171.2	175.1	169.4	0.7	117	Q247	Q247-R250 PolarHBondContact O-N 3.27Å
251	Q	41	Very low	46.1	Very low	139 Å²	139	83.5 Å²	83.5	65%	0.65	43%	0.429	S	S	*	.	S	Bend	trans	-139.3	-1.3	-177.2	-70.4	-179.1	-18.2	0	0	114.3
252	K	40.1	Very low	44.2	Very low	57 Å²	57	91.5 Å²	91.5	25%	0.248	46%	0.464	C	S	.	.	S	Bend	trans	-93.8	-22.3	-175.1	-97.5	-161.3	161	-164.1	0	115.9	E254 A255 V256 S271 I272	K252-E254 PolarHBondContact O-N 3.44Å; K252-A255 PolarHBondContact O-N 3.28Å; K252-V256 HydrophobicContact CB-CG2 4.34Å; K252-V256 HydrophobicContact CD-CG2 3.89Å; K252-V256 HydrophobicContact CG-CG2 3.8Å; K252-S271 VanDerWaalsContact CE-CB 3.41Å; K252-S271 WeakPolarHBondContact CE-OG 3.43Å; K252-S271 PolarHBondContact NZ-OG 3.22Å; K252-I272 HydrophobicContact CD-CB 4.19Å; K252-I272 HydrophobicContact CD-CD1 4.35Å; K252-I272 HydrophobicContact CD-CG1 4.33Å; K252-I272 VanDerWaalsContact CE-N 3.26Å; K252-I272 HydrophobicContact CG-CD1 4.43Å
253	I	33.1	Very low	42.2	Very low	137 Å²	137	97.3 Å²	97.3	70%	0.703	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.8	172.8	-72.3	169.5	0	0	0	112.2	D249	D249-I253 WeakPolarHBondContact OD1-CD1 3.45Å; D249-I253 WeakPolarHBondContact OD1-CG1 3.18Å
254	E	29.1	Very low	40.1	Very low	170 Å²	170	102.2 Å²	102.2	79%	0.794	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-1	177	-66.1	-173	141.9	0	0	114.8	K252	K252-E254 PolarHBondContact O-N 3.44Å
255	A	31.3	Very low	38	Very low	75 Å²	75	108.9 Å²	108.9	62%	0.62	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	3.2	-165.3	0	0	0	0	0	117.6	K252	K252-A255 PolarHBondContact O-N 3.28Å
256	V	30.6	Very low	36.6	Very low	72 Å²	72	115.9 Å²	115.9	44%	0.436	60%	0.6	S	S	.	*			trans	-130.5	46.2	-176.9	-158.6	0	0	0	0	113.1	K252	K252-V256 HydrophobicContact CB-CG2 4.34Å; K252-V256 HydrophobicContact CD-CG2 3.89Å; K252-V256 HydrophobicContact CG-CG2 3.8Å
257	S	26.9	Very low	34.9	Very low	90 Å²	90	121.6 Å²	121.6	63%	0.629	62%	0.624	S	S	*	*	S	Bend	trans	-105.3	7.1	169.5	55.7	0	0	0	0	113.6
258	T	29	Very low	33.4	Very low	114 Å²	114	126.4 Å²	126.4	70%	0.699	66%	0.657	S	S	*	*	S	Bend	trans	-152.5	143.1	173.8	-24.3	0	0	0	0	114.1
259	I	30.1	Very low	32.4	Very low	129 Å²	129	132 Å²	132	66%	0.662	70%	0.695	S	S	*	*			trans	67.5	101.7	164	-16.1	176.9	0	0	0	119
260	Y	27.5	Very low	32	Very low	177 Å²	177	129.9 Å²	129.9	69%	0.694	69%	0.69	S	S	*	*				177	111.5	95.3	-107.4	-71	0	0	0	113.7	F263	Y260-F263 HydrophobicContact CE1-CB 4.49Å
261	V	27.4	Very low	32.4	Very low	140 Å²	140	122.5 Å²	122.5	85%	0.848	67%	0.669	S	S	*	*	S	Bend	trans	-102.7	127.5	132.2	173.8	0	0	0	0	105.2
262	F	29.7	Very low	32.9	Very low	174 Å²	174	117 Å²	117	76%	0.763	64%	0.644	S	S	*	*	S	Bend	trans	151	-38.4	136.7	-168.2	-127.5	0	0	0	117.1
263	F	28.1	Very low	33.4	Very low	151 Å²	151	118.3 Å²	118.3	66%	0.662	65%	0.65	S	S	*	*			trans	-124.7	126.5	-167.5	-118.8	-106.7	0	0	0	118.6	Y260	Y260-F263 HydrophobicContact CE1-CB 4.49Å
264	C	27.3	Very low	34.6	Very low	103 Å²	103	113.4 Å²	113.4	70%	0.696	63%	0.63	S	S	*	*			trans	-74.6	166.7	164.9	-62.4	0	0	0	0	112
265	L	27.5	Very low	36	Very low	161 Å²	161	106.8 Å²	106.8	84%	0.843	60%	0.6	S	S	*	*			trans	86.5	132	168.3	-48.7	170.2	0	0	0	116
266	V	35.5	Very low	37.3	Very low	150 Å²	150	103.4 Å²	103.4	91%	0.909	57%	0.572	S	S	*	*	S	Bend	trans	85.3	123.4	-179	-165.6	0	0	0	0	115.5
267	K	30.3	Very low	38.8	Very low	197 Å²	197	103.2 Å²	103.2	86%	0.857	57%	0.568	S	S	*	*			trans	-92.4	176.3	-170.8	-49.3	169.1	178.3	178.1	0	111.3
268	P	32	Very low	40.4	Very low	121 Å²	121	103 Å²	103	79%	0.786	56%	0.559	S	S	*	*			cis	-130.8	154.2	-32.8	36.5	-20.5	0	0	0	114.5
269	S	32.8	Very low	42.1	Very low	124 Å²	124	97.7 Å²	97.7	87%	0.867	53%	0.527	S	S	*	.			trans	177.4	96.6	146.3	48.7	0	0	0	0	109.2	S271	S269-S271 PolarHBondContact O-N 2.93Å
270	A	39.2	Very low	43.7	Very low	44 Å²	44	92.1 Å²	92.1	36%	0.364	50%	0.498	S	S	.	.			trans	-85.6	120.3	-160.8	0	0	0	0	0	112.8	A274 L275	A270-A274 HydrophobicContact CB-CB 3.97Å; A270-L275 HydrophobicContact CB-CD2 3.73Å; A270-L275 HydrophobicContact CB-CG 3.69Å
271	S	51.8	Low	45.4	Very low	47 Å²	47	87.4 Å²	87.4	33%	0.329	49%	0.489	S	S	.	.			trans	-54	146.6	163.4	109.3	0	0	0	0	109.4	K252 S269 F273 A274 L275	K252-S271 VanDerWaalsContact CE-CB 3.41Å; K252-S271 WeakPolarHBondContact CE-OG 3.43Å; K252-S271 PolarHBondContact NZ-OG 3.22Å; S269-S271 PolarHBondContact O-N 2.93Å; S271-F273 CarbonylContact O-C 3.59Å; S271-F273 PolarHBondContact O-N 2.96Å; S271-F273 PolarHBondContact OG-N 3.27Å; S271-A274 CarbonylContact O-C 3.43Å; S271-A274 VanDerWaalsContact O-CA 3.27Å; S271-A274 WeakPolarHBondContact O-CA 3.05Å; S271-A274 WeakPolarHBondContact O-CB 3.2Å; S271-A274 PolarHBondContact O-N 2.93Å; S271-L275 PolarHBondContact O-N 3.42Å
272	I	50.5	Low	47.2	Very low	24 Å²	24	84.3 Å²	84.3	12%	0.123	47%	0.466	C	S	.	.	H	α-helix	trans	-47.8	-30.4	178.4	-61.5	175.2	0	0	0	113.8	Y244 Q247 A248 K252 L275 F276	Y244-I272 WeakPolarHBondContact O-CG2 3.47Å; Q247-I272 HydrophobicContact CB-CD1 4.23Å; Q247-I272 WeakPolarHBondContact O-CD1 3.03Å; A248-I272 HydrophobicContact CB-CD1 4.27Å; A248-I272 HydrophobicContact CB-CG2 4.14Å; K252-I272 HydrophobicContact CD-CB 4.19Å; K252-I272 HydrophobicContact CD-CD1 4.35Å; K252-I272 HydrophobicContact CD-CG1 4.33Å; K252-I272 VanDerWaalsContact CE-N 3.26Å; K252-I272 HydrophobicContact CG-CD1 4.43Å; I272-L275 PolarHBondContact O-N 3.49Å; I272-F276 WeakPolarHBondContact O-CB 3.19Å; I272-F276 PolarHBondContact O-N 3.27Å
273	F	52.3	Low	48.9	Very low	84 Å²	84	76 Å²	76	37%	0.368	43%	0.43	S	S	.	.	H	α-helix	trans	-66.3	-45.9	172.9	-175.3	-101.9	0	0	0	111.8	S271 F276 L277 L310 Q313	S271-F273 CarbonylContact O-C 3.59Å; S271-F273 PolarHBondContact O-N 2.96Å; S271-F273 PolarHBondContact OG-N 3.27Å; F273-F276 PolarHBondContact O-N 2.94Å; F273-L277 HydrophobicContact CD1-CD1 3.87Å; F273-L277 HydrophobicContact CE1-CD1 3.38Å; F273-L277 HydrophobicContact CE1-CG 4.41Å; F273-L277 HydrophobicContact CE2-CD1 4.32Å; F273-L277 HydrophobicContact CZ-CD1 3.64Å; F273-L277 HydrophobicContact CZ-CG 4.49Å; F273-L277 WeakPolarHBondContact O-CB 3.43Å; F273-L277 WeakPolarHBondContact O-CG 3.43Å; F273-L277 PolarHBondContact O-N 2.92Å; F273-L310 HydrophobicContact CD2-CD2 3.71Å; F273-L310 HydrophobicContact CE2-CD2 3.8Å; F273-Q313 VanDerWaalsContact CE2-OE1 3.23Å
274	A	57.9	Low	50.7	Low	34 Å²	34	73.4 Å²	73.4	28%	0.281	42%	0.423	S	S	.	.	H	α-helix	trans	-68.3	-35.7	171.8	0	0	0	0	0	112.5	A270 S271 N278	A270-A274 HydrophobicContact CB-CB 3.97Å; S271-A274 CarbonylContact O-C 3.43Å; S271-A274 VanDerWaalsContact O-CA 3.27Å; S271-A274 WeakPolarHBondContact O-CA 3.05Å; S271-A274 WeakPolarHBondContact O-CB 3.2Å; S271-A274 PolarHBondContact O-N 2.93Å; A274-N278 WeakPolarHBondContact O-CA 3.42Å; A274-N278 WeakPolarHBondContact O-CB 3.32Å; A274-N278 PolarHBondContact O-N 3.38Å; A274-N278 PolarHBondContact O-ND2 2.83Å; A274-N278 VanDerWaalsContact O-ND2 3.1Å
275	L	57.8	Low	52.5	Low	32 Å²	32	73.3 Å²	73.3	17%	0.168	42%	0.423	C	S	.	.	H	α-helix	trans	-63.5	-44.7	172.1	-73.3	169.3	0	0	0	111.2	Y244 A270 S271 I272 N278 L279	Y244-L275 HydrophobicContact CD1-CB 4.35Å; Y244-L275 HydrophobicContact CD1-CD1 4.13Å; Y244-L275 HydrophobicContact CD2-CB 4.26Å; Y244-L275 HydrophobicContact CE1-CB 4.37Å; Y244-L275 HydrophobicContact CE1-CD1 3.92Å; Y244-L275 HydrophobicContact CE1-CD2 4.42Å; Y244-L275 HydrophobicContact CE1-CG 4.47Å; Y244-L275 HydrophobicContact CE2-CB 4.28Å; Y244-L275 HydrophobicContact CG-CB 4.32Å; A270-L275 HydrophobicContact CB-CD2 3.73Å; A270-L275 HydrophobicContact CB-CG 3.69Å; S271-L275 PolarHBondContact O-N 3.42Å; I272-L275 PolarHBondContact O-N 3.49Å; L275-N278 PolarHBondContact O-N 2.97Å; L275-L279 WeakPolarHBondContact O-CB 3.47Å; L275-L279 PolarHBondContact O-N 3.4Å
276	F	59.6	Low	54.3	Low	4 Å²	4	68 Å²	68	2%	0.018	40%	0.402	C	S	.	.	H	α-helix	trans	-69.2	-43.3	-178.6	-166.4	-95.3	0	0	0	112.3	L241 A245 I272 F273 L279 F280 L302 V314	L241-F276 HydrophobicContact CD2-CD2 3.94Å; L241-F276 HydrophobicContact CD2-CE2 3.55Å; L241-F276 HydrophobicContact CD2-CZ 3.86Å; A245-F276 HydrophobicContact CB-CE2 4.4Å; I272-F276 WeakPolarHBondContact O-CB 3.19Å; I272-F276 PolarHBondContact O-N 3.27Å; F273-F276 PolarHBondContact O-N 2.94Å; F276-L279 PolarHBondContact O-N 2.85Å; F276-F280 HydrophobicContact CD1-CD2 4.2Å; F276-F280 HydrophobicContact CD1-CE2 4.27Å; F276-F280 AromaticContact CE1-CD2 3.94Å; F276-F280 HydrophobicContact CE1-CD2 3.94Å; F276-F280 AromaticContact CE1-CE2 3.57Å; F276-F280 HydrophobicContact CE1-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CD2 4.45Å; F276-F280 AromaticContact CZ-CE2 3.77Å; F276-F280 HydrophobicContact CZ-CE2 3.77Å; F276-F280 PolarHBondContact O-N 2.9Å; F276-L302 HydrophobicContact CE1-CD1 4.46Å; F276-L302 HydrophobicContact CZ-CD1 3.92Å; F276-V314 HydrophobicContact CE1-CG2 3.39Å; F276-V314 HydrophobicContact CZ-CG2 3.36Å
277	L	61.1	Low	55.7	Low	68 Å²	68	68.1 Å²	68.1	36%	0.356	40%	0.398	S	S	.	.	H	α-helix	trans	-69.2	-41.5	172.3	-69.8	-177.9	0	0	0	112.4	F273 L279 F280 C281	F273-L277 HydrophobicContact CD1-CD1 3.87Å; F273-L277 HydrophobicContact CE1-CD1 3.38Å; F273-L277 HydrophobicContact CE1-CG 4.41Å; F273-L277 HydrophobicContact CE2-CD1 4.32Å; F273-L277 HydrophobicContact CZ-CD1 3.64Å; F273-L277 HydrophobicContact CZ-CG 4.49Å; F273-L277 WeakPolarHBondContact O-CB 3.43Å; F273-L277 WeakPolarHBondContact O-CG 3.43Å; F273-L277 PolarHBondContact O-N 2.92Å; L277-L279 PolarHBondContact O-N 3.25Å; L277-F280 PolarHBondContact O-N 3.21Å; L277-C281 PolarHBondContact O-N 2.88Å; L277-C281 PolarHBondContact O-SG 3.43Å; L277-C281 VanDerWaalsContact O-SG 3.34Å
278	N	61.9	Low	57.5	Low	85 Å²	85	59.9 Å²	59.9	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-60	-36	172.2	-76.1	-23.5	0	0	0	110.6	A274 L275 C281 E282	A274-N278 WeakPolarHBondContact O-CA 3.42Å; A274-N278 WeakPolarHBondContact O-CB 3.32Å; A274-N278 PolarHBondContact O-N 3.38Å; A274-N278 PolarHBondContact O-ND2 2.83Å; A274-N278 VanDerWaalsContact O-ND2 3.1Å; L275-N278 PolarHBondContact O-N 2.97Å; N278-C281 CarbonylContact O-C 3.33Å; N278-C281 WeakPolarHBondContact O-CA 3.29Å; N278-C281 WeakPolarHBondContact O-CB 3.23Å; N278-C281 PolarHBondContact O-N 3.25Å; N278-E282 WeakPolarHBondContact O-CG 3.38Å; N278-E282 PolarHBondContact O-N 3.11Å
279	L	63	Low	59.3	Low	2 Å²	2	55.6 Å²	55.6	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-70.2	-37.9	177.8	-167.3	68.1	0	0	0	112.1	Y237 K240 L241 Y244 L275 F276 L277 C281 E282 V283	Y237-L279 HydrophobicContact CD1-CD1 3.49Å; Y237-L279 VanDerWaalsContact CD1-CD1 3.49Å; Y237-L279 HydrophobicContact CD1-CG 4.12Å; Y237-L279 HydrophobicContact CE1-CD1 3.76Å; K240-L279 VanDerWaalsContact C-CD2 3.43Å; K240-L279 HydrophobicContact CB-CD1 3.87Å; K240-L279 HydrophobicContact CB-CD2 3.42Å; K240-L279 VanDerWaalsContact CB-CD2 3.42Å; K240-L279 HydrophobicContact CB-CG 4.33Å; K240-L279 HydrophobicContact CD-CD1 4.04Å; L241-L279 HydrophobicContact CB-CD2 4.1Å; L241-L279 HydrophobicContact CD2-CD2 3.76Å; L241-L279 HydrophobicContact CD2-CG 4.33Å; L241-L279 HydrophobicContact CG-CD2 3.56Å; L241-L279 HydrophobicContact CG-CG 4.31Å; Y244-L279 HydrophobicContact CD2-CB 4.47Å; Y244-L279 HydrophobicContact CD2-CD2 3.7Å; Y244-L279 HydrophobicContact CE2-CB 4.45Å; Y244-L279 HydrophobicContact CE2-CD1 4.42Å; Y244-L279 HydrophobicContact CE2-CD2 3.89Å; L275-L279 WeakPolarHBondContact O-CB 3.47Å; L275-L279 PolarHBondContact O-N 3.4Å; F276-L279 PolarHBondContact O-N 2.85Å; L277-L279 PolarHBondContact O-N 3.25Å; L279-C281 VanDerWaalsContact C-N 3.31Å; L279-E282 PolarHBondContact O-N 3.03Å; L279-V283 WeakPolarHBondContact O-CB 3.45Å; L279-V283 VanDerWaalsContact O-CG2 3.29Å; L279-V283 WeakPolarHBondContact O-CG2 3.47Å; L279-V283 PolarHBondContact O-N 3.08Å
280	F	63.5	Low	61.1	Low	13 Å²	13	50 Å²	50	6%	0.057	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-35.4	167.9	-90.4	-76	0	0	0	112.1	L241 F276 L277 V283 N284 L290 V314 N317	L241-F280 HydrophobicContact CD1-CE2 4.39Å; L241-F280 HydrophobicContact CD1-CZ 4.2Å; L241-F280 HydrophobicContact CD2-CD2 3.81Å; L241-F280 HydrophobicContact CD2-CE2 3.48Å; L241-F280 VanDerWaalsContact CD2-CE2 3.48Å; L241-F280 HydrophobicContact CD2-CZ 4.11Å; F276-F280 HydrophobicContact CD1-CD2 4.2Å; F276-F280 HydrophobicContact CD1-CE2 4.27Å; F276-F280 AromaticContact CE1-CD2 3.94Å; F276-F280 HydrophobicContact CE1-CD2 3.94Å; F276-F280 AromaticContact CE1-CE2 3.57Å; F276-F280 HydrophobicContact CE1-CE2 3.57Å; F276-F280 HydrophobicContact CZ-CD2 4.45Å; F276-F280 AromaticContact CZ-CE2 3.77Å; F276-F280 HydrophobicContact CZ-CE2 3.77Å; F276-F280 PolarHBondContact O-N 2.9Å; L277-F280 PolarHBondContact O-N 3.21Å; F280-V283 PolarHBondContact O-N 3.11Å; F280-N284 WeakPolarHBondContact O-CB 3.16Å; F280-N284 PolarHBondContact O-N 2.87Å; F280-N284 PolarHBondContact O-ND2 3.18Å; F280-L290 HydrophobicContact CD1-CD1 4.41Å; F280-L290 HydrophobicContact CE1-CD1 3.75Å; F280-L290 HydrophobicContact CZ-CD1 4.35Å; F280-V314 HydrophobicContact CE2-CG2 4.35Å; F280-N317 HydrophobicContact CD1-CB 4.21Å; F280-N317 VanDerWaalsContact CD1-CG 3.5Å; F280-N317 WeakPolarHBondContact CD1-OD1 3.45Å; F280-N317 HydrophobicContact CE1-CB 3.59Å; F280-N317 HydrophobicContact CZ-CB 4.2Å
281	C	64	Low	62.9	Low	77 Å²	77	49.1 Å²	49.1	52%	0.52	28%	0.283	S	S	.	.	H	α-helix	trans	-67.6	-34.8	170.6	-69.4	0	0	0	0	113	L277 N278 L279 S285	L277-C281 PolarHBondContact O-N 2.88Å; L277-C281 PolarHBondContact O-SG 3.43Å; L277-C281 VanDerWaalsContact O-SG 3.34Å; N278-C281 CarbonylContact O-C 3.33Å; N278-C281 WeakPolarHBondContact O-CA 3.29Å; N278-C281 WeakPolarHBondContact O-CB 3.23Å; N278-C281 PolarHBondContact O-N 3.25Å; L279-C281 VanDerWaalsContact C-N 3.31Å; C281-S285 VanDerWaalsContact O-CB 3.25Å; C281-S285 WeakPolarHBondContact O-CB 3.33Å; C281-S285 PolarHBondContact O-N 2.65Å; C281-S285 PolarHBondContact O-OG 3.1Å
282	E	65.4	Low	64.3	Low	75 Å²	75	46.9 Å²	46.9	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-43.8	172.9	-75.7	-178.3	-168.2	0	0	110.4	Y237 K240 N278 L279 N284 S285 A286	Y237-E282 HydrophobicContact CD1-CB 4.49Å; Y237-E282 HydrophobicContact CE1-CB 3.62Å; Y237-E282 WeakPolarHBondContact CE1-OE2 3.32Å; K240-E282 IonicContact NZ-OE2 3.53Å; K240-E282 PolarHBondContact NZ-OE2 3.13Å; N278-E282 WeakPolarHBondContact O-CG 3.38Å; N278-E282 PolarHBondContact O-N 3.11Å; L279-E282 PolarHBondContact O-N 3.03Å; E282-N284 VanDerWaalsContact C-N 3.33Å; E282-N284 PolarHBondContact O-N 3.39Å; E282-S285 WeakPolarHBondContact CA-OG 3.44Å; E282-S285 PolarHBondContact O-N 2.93Å; E282-S285 PolarHBondContact O-OG 3.1Å; E282-A286 WeakPolarHBondContact O-CB 3.12Å; E282-A286 PolarHBondContact O-N 2.63Å
283	V	65.8	Low	65.7	Low	1 Å²	1	49.1 Å²	49.1	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-47.4	172.6	166.9	0	0	0	0	110.7	Y237 L279 F280 N287 I288 L290	Y237-V283 HydrophobicContact CD1-CG2 3.47Å; Y237-V283 VanDerWaalsContact CD1-CG2 3.47Å; Y237-V283 HydrophobicContact CE1-CG2 4.34Å; Y237-V283 HydrophobicContact CG-CG2 3.64Å; L279-V283 WeakPolarHBondContact O-CB 3.45Å; L279-V283 VanDerWaalsContact O-CG2 3.29Å; L279-V283 WeakPolarHBondContact O-CG2 3.47Å; L279-V283 PolarHBondContact O-N 3.08Å; F280-V283 PolarHBondContact O-N 3.11Å; V283-N287 PolarHBondContact O-N 2.89Å; V283-N287 VanDerWaalsContact O-N 3.11Å; V283-I288 HydrophobicContact CG1-CB 4.24Å; V283-I288 HydrophobicContact CG1-CG2 4.43Å; V283-I288 PolarHBondContact O-N 3.06Å; V283-L290 HydrophobicContact CG1-CD1 3.91Å; V283-L290 HydrophobicContact CG1-CG 3.91Å; V283-L290 HydrophobicContact CG2-CD1 4.24Å
284	N	66.3	Low	66.8	Low	96 Å²	96	47.2 Å²	47.2	51%	0.513	27%	0.273	S	S	.	.	H	α-helix	trans	-68.7	-39.7	-179.4	-72.2	-25.2	0	0	0	112.4	F280 E282 N287	F280-N284 WeakPolarHBondContact O-CB 3.16Å; F280-N284 PolarHBondContact O-N 2.87Å; F280-N284 PolarHBondContact O-ND2 3.18Å; E282-N284 VanDerWaalsContact C-N 3.33Å; E282-N284 PolarHBondContact O-N 3.39Å; N284-N287 PolarHBondContact O-N 2.92Å
285	S	63.6	Low	67.8	Low	101 Å²	101	45.7 Å²	45.7	71%	0.706	26%	0.261	S	S	*	.	H	α-helix	trans	-78.1	-30.5	178.9	57.3	0	0	0	0	113.9	C281 E282 N287	C281-S285 VanDerWaalsContact O-CB 3.25Å; C281-S285 WeakPolarHBondContact O-CB 3.33Å; C281-S285 PolarHBondContact O-N 2.65Å; C281-S285 PolarHBondContact O-OG 3.1Å; E282-S285 WeakPolarHBondContact CA-OG 3.44Å; E282-S285 PolarHBondContact O-N 2.93Å; E282-S285 PolarHBondContact O-OG 3.1Å; S285-N287 PolarHBondContact O-N 3.46Å
286	A	65.3	Low	69	Low	49 Å²	49	44.3 Å²	44.3	41%	0.405	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.1	168	0	0	0	0	0	112.7	E282 I288	E282-A286 WeakPolarHBondContact O-CB 3.12Å; E282-A286 PolarHBondContact O-N 2.63Å; A286-I288 VanDerWaalsContact C-N 3.31Å; A286-I288 HydrophobicContact CB-CD1 3.57Å; A286-I288 HydrophobicContact CB-CG1 3.85Å; A286-I288 PolarHBondContact O-N 2.92Å
287	N	65.2	Low	69.8	Low	153 Å²	153	46.5 Å²	46.5	82%	0.818	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	37.7	179.3	-149.4	0.4	0	0	0	113	V283 N284 S285	V283-N287 PolarHBondContact O-N 2.89Å; V283-N287 VanDerWaalsContact O-N 3.11Å; N284-N287 PolarHBondContact O-N 2.92Å; S285-N287 PolarHBondContact O-N 3.46Å
288	I	67.9	Low	70.5	Confident	24 Å²	24	43.4 Å²	43.4	12%	0.123	25%	0.248	C	C	.	.			trans	-89.4	139.8	-172.5	-72.2	172.7	0	0	0	111.1	P232 Y237 V283 A286 R319	P232-I288 WeakPolarHBondContact O-CD1 3.43Å; Y237-I288 HydrophobicContact CD2-CD1 3.29Å; Y237-I288 HydrophobicContact CD2-CG2 4.41Å; Y237-I288 HydrophobicContact CE2-CD1 3.11Å; Y237-I288 HydrophobicContact CG-CD1 4.33Å; V283-I288 HydrophobicContact CG1-CB 4.24Å; V283-I288 HydrophobicContact CG1-CG2 4.43Å; V283-I288 PolarHBondContact O-N 3.06Å; A286-I288 VanDerWaalsContact C-N 3.31Å; A286-I288 HydrophobicContact CB-CD1 3.57Å; A286-I288 HydrophobicContact CB-CG1 3.85Å; A286-I288 PolarHBondContact O-N 2.92Å; I288-R319 PolarHBondContact O-NH2 2.81Å
289	F	69.6	Low	71.3	Confident	31 Å²	31	39.3 Å²	39.3	14%	0.136	23%	0.226	C	C	.	.			trans	-92.6	108	-179.4	-172	-81.1	0	0	0	110	S234 R319	S234-F289 WeakPolarHBondContact CB-O 3.5Å; F289-R319 VanDerWaalsContact CD2-NH1 3.28Å
290	L	70.7	Confident	72.1	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.037	23%	0.226	C	C	.	.			trans	-88.4	133.8	161.3	-61.9	177.3	0	0	0	108.7	V238 L241 F280 V283 D294 V295	V238-L290 HydrophobicContact CG2-CD2 3.6Å; L241-L290 HydrophobicContact CD1-CD1 3.79Å; F280-L290 HydrophobicContact CD1-CD1 4.41Å; F280-L290 HydrophobicContact CE1-CD1 3.75Å; F280-L290 HydrophobicContact CZ-CD1 4.35Å; V283-L290 HydrophobicContact CG1-CD1 3.91Å; V283-L290 HydrophobicContact CG1-CG 3.91Å; V283-L290 HydrophobicContact CG2-CD1 4.24Å; L290-D294 HydrophobicContact CB-CB 4.48Å; L290-V295 HydrophobicContact CB-CG2 4.22Å
291	S	77	Confident	72.5	Confident	24 Å²	24	39.6 Å²	39.6	17%	0.168	23%	0.228	C	C	.	.			trans	-79.7	162.2	173.3	74.9	0	0	0	0	111.3	D293 D294 V295	S291-D293 PolarHBondContact O-N 3.26Å; S291-D293 PolarHBondContact OG-N 3.17Å; S291-D294 WeakPolarHBondContact CA-OD2 3.31Å; S291-D294 VanDerWaalsContact CB-OD2 3.26Å; S291-D294 WeakPolarHBondContact CB-OD2 3.39Å; S291-D294 PolarHBondContact N-OD2 3.35Å; S291-D294 WeakPolarHBondContact O-CB 3.42Å; S291-D294 PolarHBondContact O-N 2.88Å; S291-D294 VanDerWaalsContact O-N 3.13Å; S291-D294 PolarHBondContact OG-N 2.92Å; S291-D294 PolarHBondContact OG-OD2 2.92Å; S291-V295 WeakPolarHBondContact O-CG2 3.42Å; S291-V295 PolarHBondContact O-N 3.04Å
292	D	81.3	Confident	73	Confident	1 Å²	1	36 Å²	36	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-27.7	174.9	-65.4	-40.2	0	0	0	112.4	L296 L318 R319 K320 Q321 F324	D292-L296 VanDerWaalsContact O-CB 3.27Å; D292-L296 WeakPolarHBondContact O-CB 3.37Å; D292-L296 WeakPolarHBondContact O-CD1 3.5Å; D292-L296 WeakPolarHBondContact O-CG 3.38Å; D292-L296 PolarHBondContact O-N 2.68Å; D292-L318 HydrophobicContact CB-CD2 3.95Å; D292-R319 PolarHBondContact OD1-N 2.98Å; D292-K320 PolarHBondContact OD1-N 2.63Å; D292-K320 WeakPolarHBondContact OD2-CA 3.31Å; D292-K320 PolarHBondContact OD2-N 2.94Å; D292-Q321 PolarHBondContact OD2-N 3.41Å; D292-F324 HydrophobicContact CB-CD2 3.9Å
293	D	80.1	Confident	73.6	Confident	71 Å²	71	32.5 Å²	32.5	38%	0.38	19%	0.187	S	C	.	.	H	α-helix	trans	-70	-39.4	174.9	-70.7	-49.5	0	0	0	111.6	S291 V295 L296 E297 K327	S291-D293 PolarHBondContact O-N 3.26Å; S291-D293 PolarHBondContact OG-N 3.17Å; D293-V295 VanDerWaalsContact C-N 3.3Å; D293-V295 PolarHBondContact O-N 2.92Å; D293-L296 PolarHBondContact O-N 3.22Å; D293-E297 WeakPolarHBondContact O-CB 3.47Å; D293-E297 PolarHBondContact O-N 2.82Å; D293-K327 VanDerWaalsContact OD1-CD 3.26Å; D293-K327 WeakPolarHBondContact OD1-CD 3.4Å; D293-K327 WeakPolarHBondContact OD1-CG 3.38Å; D293-K327 WeakPolarHBondContact OD2-CD 3.48Å; D293-K327 WeakPolarHBondContact OD2-CE 3.29Å; D293-K327 IonicContact OD2-NZ 2.72Å; D293-K327 PolarHBondContact OD2-NZ 2.92Å
294	D	75.4	Confident	74.1	Confident	43 Å²	43	37 Å²	37	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-42.1	176.2	-58.6	-56.2	0	0	0	110.9	V238 L290 S291 A298	V238-D294 HydrophobicContact CG2-CB 3.75Å; L290-D294 HydrophobicContact CB-CB 4.48Å; S291-D294 WeakPolarHBondContact CA-OD2 3.31Å; S291-D294 VanDerWaalsContact CB-OD2 3.26Å; S291-D294 WeakPolarHBondContact CB-OD2 3.39Å; S291-D294 PolarHBondContact N-OD2 3.35Å; S291-D294 WeakPolarHBondContact O-CB 3.42Å; S291-D294 PolarHBondContact O-N 2.88Å; S291-D294 VanDerWaalsContact O-N 3.13Å; S291-D294 PolarHBondContact OG-N 2.92Å; S291-D294 PolarHBondContact OG-OD2 2.92Å; D294-A298 WeakPolarHBondContact O-CB 3.29Å; D294-A298 PolarHBondContact O-N 2.77Å
295	V	78.7	Confident	74.2	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-70.1	-41.4	177.8	178.4	0	0	0	0	111.3	L290 S291 D293 A298 A299 V314 N317 L318	L290-V295 HydrophobicContact CB-CG2 4.22Å; S291-V295 WeakPolarHBondContact O-CG2 3.42Å; S291-V295 PolarHBondContact O-N 3.04Å; D293-V295 VanDerWaalsContact C-N 3.3Å; D293-V295 PolarHBondContact O-N 2.92Å; V295-A298 PolarHBondContact O-N 3.39Å; V295-A299 WeakPolarHBondContact O-CB 3.32Å; V295-A299 PolarHBondContact O-N 2.95Å; V295-V314 HydrophobicContact CG1-CG1 3.66Å; V295-V314 WeakPolarHBondContact CG1-O 3.39Å; V295-V314 WeakPolarHBondContact O-CG1 3.27Å; V295-N317 HydrophobicContact CG1-CB 4.44Å; V295-L318 HydrophobicContact CB-CD2 3.7Å; V295-L318 HydrophobicContact CB-CG 4.42Å; V295-L318 HydrophobicContact CG1-CD2 3.52Å; V295-L318 HydrophobicContact CG1-CG 3.72Å
296	L	83.4	Confident	74.5	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-35.3	175.3	-74.7	170.4	0	0	0	112.6	D292 D293 A299 C300 L315 L318 F324 K327 A328 A331 V347	D292-L296 VanDerWaalsContact O-CB 3.27Å; D292-L296 WeakPolarHBondContact O-CB 3.37Å; D292-L296 WeakPolarHBondContact O-CD1 3.5Å; D292-L296 WeakPolarHBondContact O-CG 3.38Å; D292-L296 PolarHBondContact O-N 2.68Å; D293-L296 PolarHBondContact O-N 3.22Å; L296-A299 PolarHBondContact O-N 3.31Å; L296-C300 WeakPolarHBondContact O-CB 3.42Å; L296-C300 PolarHBondContact O-N 2.8Å; L296-C300 PolarHBondContact O-SG 3.3Å; L296-L315 HydrophobicContact CD2-CD2 3.91Å; L296-L318 HydrophobicContact CD2-CD1 4.39Å; L296-L318 HydrophobicContact CD2-CD2 4.42Å; L296-L318 HydrophobicContact CG-CD2 4.05Å; L296-F324 HydrophobicContact CD1-CE2 4.32Å; L296-K327 HydrophobicContact CD1-CB 3.67Å; L296-A328 HydrophobicContact CD1-CB 4.26Å; L296-A328 HydrophobicContact CD2-CB 4.31Å; L296-A331 HydrophobicContact CB-CB 4.12Å; L296-A331 HydrophobicContact CD1-CB 4.35Å; L296-A331 HydrophobicContact CD2-CB 4.08Å; L296-A331 HydrophobicContact CG-CB 4.42Å; L296-V347 HydrophobicContact CD2-CG1 3.72Å
297	E	77.8	Confident	74.7	Confident	51 Å²	51	31.2 Å²	31.2	24%	0.238	17%	0.167	C	C	.	.	H	α-helix	trans	-73.1	-39.1	176.2	-164.6	60.7	-141.1	0	0	111.2	D293 A299 C300 I301 K304 R334	D293-E297 WeakPolarHBondContact O-CB 3.47Å; D293-E297 PolarHBondContact O-N 2.82Å; E297-A299 VanDerWaalsContact C-N 3.33Å; E297-A299 PolarHBondContact O-N 2.87Å; E297-C300 CarbonylContact O-C 3.55Å; E297-C300 WeakPolarHBondContact O-CB 3.26Å; E297-C300 PolarHBondContact O-N 3.17Å; E297-C300 VanDerWaalsContact O-N 3.1Å; E297-I301 HydrophobicContact CG-CD1 4.04Å; E297-I301 WeakPolarHBondContact O-CG1 3.36Å; E297-I301 PolarHBondContact O-N 3.12Å; E297-K304 IonicContact OE1-NZ 4Å; E297-R334 IonicContact OE2-CZ 3.61Å; E297-R334 IonicContact OE2-NH1 2.81Å; E297-R334 PolarHBondContact OE2-NH1 2.96Å; E297-R334 IonicContact OE2-NH2 2.68Å; E297-R334 PolarHBondContact OE2-NH2 3.48Å
298	A	73.9	Confident	75	Confident	2 Å²	2	25 Å²	25	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-58	-44.5	169.3	0	0	0	0	0	111.5	L242 D294 V295 C300 I301 L302 V314	L242-A298 HydrophobicContact CD2-CB 4.47Å; D294-A298 WeakPolarHBondContact O-CB 3.29Å; D294-A298 PolarHBondContact O-N 2.77Å; V295-A298 PolarHBondContact O-N 3.39Å; A298-C300 VanDerWaalsContact C-N 3.33Å; A298-C300 PolarHBondContact O-N 3.23Å; A298-I301 PolarHBondContact O-N 3.25Å; A298-L302 WeakPolarHBondContact O-CB 3.44Å; A298-L302 WeakPolarHBondContact O-CG 3.46Å; A298-L302 PolarHBondContact O-N 3.4Å; A298-V314 HydrophobicContact CB-CG1 4.09Å
299	A	79.4	Confident	75.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-37.4	173.3	0	0	0	0	0	112.4	V295 L296 E297 A303 V314 L315	V295-A299 WeakPolarHBondContact O-CB 3.32Å; V295-A299 PolarHBondContact O-N 2.95Å; L296-A299 PolarHBondContact O-N 3.31Å; E297-A299 VanDerWaalsContact C-N 3.33Å; E297-A299 PolarHBondContact O-N 2.87Å; A299-A303 WeakPolarHBondContact O-CB 3.49Å; A299-A303 PolarHBondContact O-N 3.01Å; A299-V314 HydrophobicContact CB-CG1 3.97Å; A299-L315 HydrophobicContact CB-CD2 3.83Å; A299-L315 HydrophobicContact CB-CG 4.25Å
300	C	79.6	Confident	75.2	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.014	14%	0.138	C	C	.	.	H	α-helix	trans	-67.2	-35.7	176	-70.9	0	0	0	0	113	L296 E297 A298 K304 L335	L296-C300 WeakPolarHBondContact O-CB 3.42Å; L296-C300 PolarHBondContact O-N 2.8Å; L296-C300 PolarHBondContact O-SG 3.3Å; E297-C300 CarbonylContact O-C 3.55Å; E297-C300 WeakPolarHBondContact O-CB 3.26Å; E297-C300 PolarHBondContact O-N 3.17Å; E297-C300 VanDerWaalsContact O-N 3.1Å; A298-C300 VanDerWaalsContact C-N 3.33Å; A298-C300 PolarHBondContact O-N 3.23Å; C300-K304 VanDerWaalsContact O-CG 3.26Å; C300-K304 WeakPolarHBondContact O-CG 3.37Å; C300-K304 PolarHBondContact O-N 3.4Å; C300-K304 VanDerWaalsContact O-N 3.09Å; C300-L335 HydrophobicContact CB-CD2 4.45Å
301	I	73.1	Confident	75.5	Confident	19 Å²	19	25.6 Å²	25.6	10%	0.097	14%	0.137	C	C	.	.	H	α-helix	trans	-78	-40.2	179.8	-72.9	167.6	0	0	0	111	L242 A245 E246 E297 A298 A303 K304 N305	L242-I301 HydrophobicContact CD1-CD1 4.03Å; L242-I301 HydrophobicContact CD2-CB 4.35Å; L242-I301 HydrophobicContact CD2-CD1 3.51Å; L242-I301 HydrophobicContact CD2-CG1 4.49Å; L242-I301 HydrophobicContact CD2-CG2 4.49Å; L242-I301 HydrophobicContact CG-CD1 4.3Å; A245-I301 HydrophobicContact CB-CG2 4.32Å; E246-I301 HydrophobicContact CG-CG2 4.07Å; E297-I301 HydrophobicContact CG-CD1 4.04Å; E297-I301 WeakPolarHBondContact O-CG1 3.36Å; E297-I301 PolarHBondContact O-N 3.12Å; A298-I301 PolarHBondContact O-N 3.25Å; I301-A303 VanDerWaalsContact C-N 3.33Å; I301-A303 PolarHBondContact O-N 3.38Å; I301-K304 HydrophobicContact CG1-CD 4.4Å; I301-K304 WeakPolarHBondContact O-CB 3.49Å; I301-K304 PolarHBondContact O-N 3.37Å; I301-N305 PolarHBondContact O-N 3.21Å; I301-N305 PolarHBondContact O-ND2 2.88Å
302	L	73.5	Confident	75.6	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-55.1	-48	168.5	-75.2	170.5	0	0	0	111.7	A245 F276 A298 K304 N305 G306 H307 L310 I311 V314	A245-L302 HydrophobicContact CB-CD2 3.65Å; A245-L302 HydrophobicContact CB-CG 4.04Å; F276-L302 HydrophobicContact CE1-CD1 4.46Å; F276-L302 HydrophobicContact CZ-CD1 3.92Å; A298-L302 WeakPolarHBondContact O-CB 3.44Å; A298-L302 WeakPolarHBondContact O-CG 3.46Å; A298-L302 PolarHBondContact O-N 3.4Å; L302-K304 PolarHBondContact O-N 2.77Å; L302-N305 CarbonylContact O-C 3.49Å; L302-N305 PolarHBondContact O-N 3.46Å; L302-G306 PolarHBondContact O-N 3.29Å; L302-H307 HydrophobicContact CB-CB 4.05Å; L302-H307 HydrophobicContact CD2-CB 3.73Å; L302-H307 HydrophobicContact CG-CB 4.48Å; L302-H307 WeakPolarHBondContact O-CA 3.29Å; L302-H307 PolarHBondContact O-N 3Å; L302-L310 HydrophobicContact CD1-CB 3.87Å; L302-L310 HydrophobicContact CD2-CB 4.23Å; L302-L310 HydrophobicContact CD2-CD1 4Å; L302-I311 HydrophobicContact CB-CG1 4.47Å; L302-V314 HydrophobicContact CD1-CB 4.27Å; L302-V314 HydrophobicContact CD1-CG2 3.36Å
303	A	78.7	Confident	75.2	Confident	1 Å²	1	32 Å²	32	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-59.9	-43.2	176.5	0	0	0	0	0	113.1	A299 I301 N305 G306 I311 L335 L340 A343	A299-A303 WeakPolarHBondContact O-CB 3.49Å; A299-A303 PolarHBondContact O-N 3.01Å; I301-A303 VanDerWaalsContact C-N 3.33Å; I301-A303 PolarHBondContact O-N 3.38Å; A303-N305 VanDerWaalsContact C-N 3.26Å; A303-N305 PolarHBondContact O-N 3.45Å; A303-G306 PolarHBondContact O-N 3.47Å; A303-G306 VanDerWaalsContact O-N 3.13Å; A303-I311 HydrophobicContact CB-CD1 3.69Å; A303-L335 HydrophobicContact CB-CD2 3.43Å; A303-L335 VanDerWaalsContact CB-CD2 3.43Å; A303-L340 HydrophobicContact CB-CD1 4.04Å; A303-A343 HydrophobicContact CB-CB 3.44Å; A303-A343 VanDerWaalsContact CB-CB 3.44Å
304	K	76.5	Confident	74.9	Confident	97 Å²	97	28.6 Å²	28.6	42%	0.422	15%	0.148	S	C	.	.	H	α-helix	trans	-59.5	-37.2	176.5	-77.9	165.3	-176.8	168.4	0	112.5	E297 C300 I301 L302 G306 L338 L340	E297-K304 IonicContact OE1-NZ 4Å; C300-K304 VanDerWaalsContact O-CG 3.26Å; C300-K304 WeakPolarHBondContact O-CG 3.37Å; C300-K304 PolarHBondContact O-N 3.4Å; C300-K304 VanDerWaalsContact O-N 3.09Å; I301-K304 HydrophobicContact CG1-CD 4.4Å; I301-K304 WeakPolarHBondContact O-CB 3.49Å; I301-K304 PolarHBondContact O-N 3.37Å; L302-K304 PolarHBondContact O-N 2.77Å; K304-G306 VanDerWaalsContact C-N 3.27Å; K304-G306 PolarHBondContact O-N 2.9Å; K304-L338 HydrophobicContact CD-CD1 4.28Å; K304-L338 HydrophobicContact CG-CD1 3.79Å; K304-L340 HydrophobicContact CG-CD1 4.38Å
305	N	68.3	Low	75.2	Confident	69 Å²	69	27.1 Å²	27.1	37%	0.369	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	7.8	-179.9	-61.1	-20	0	0	0	112.8	A245 E246 I301 L302 A303 H307	A245-N305 PolarHBondContact O-ND2 3.15Å; E246-N305 WeakPolarHBondContact CA-ND2 3.28Å; E246-N305 VanDerWaalsContact CG-ND2 3.35Å; E246-N305 WeakPolarHBondContact CG-ND2 3.36Å; I301-N305 PolarHBondContact O-N 3.21Å; I301-N305 PolarHBondContact O-ND2 2.88Å; L302-N305 CarbonylContact O-C 3.49Å; L302-N305 PolarHBondContact O-N 3.46Å; A303-N305 VanDerWaalsContact C-N 3.26Å; A303-N305 PolarHBondContact O-N 3.45Å; N305-H307 PolarHBondContact O-CD2 3.42Å
306	G	68.3	Low	75.3	Confident	28 Å²	28	30.9 Å²	30.9	29%	0.289	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	34.9	178.5	0	0	0	0	0	114	L302 A303 K304 K1049	L302-G306 PolarHBondContact O-N 3.29Å; A303-G306 PolarHBondContact O-N 3.47Å; A303-G306 VanDerWaalsContact O-N 3.13Å; K304-G306 VanDerWaalsContact C-N 3.27Å; K304-G306 PolarHBondContact O-N 2.9Å; G306-K1049 WeakPolarHBondContact O-CD 3.28Å; G306-K1049 WeakPolarHBondContact O-CE 3.01Å; G306-K1049 VanDerWaalsContact O-CG 3.23Å; G306-K1049 WeakPolarHBondContact O-CG 2.93Å
307	H	69.5	Low	74.8	Confident	27 Å²	27	33.3 Å²	33.3	13%	0.125	19%	0.185	C	C	.	.			trans	-107.9	47.6	176	-63.8	-67.3	0	0	0	113.7	A248 L302 N305 E309 L310 K1049	A248-H307 PolarHBondContact O-NE2 3.13Å; L302-H307 HydrophobicContact CB-CB 4.05Å; L302-H307 HydrophobicContact CD2-CB 3.73Å; L302-H307 HydrophobicContact CG-CB 4.48Å; L302-H307 WeakPolarHBondContact O-CA 3.29Å; L302-H307 PolarHBondContact O-N 3Å; N305-H307 PolarHBondContact O-CD2 3.42Å; H307-E309 PolarHBondContact O-N 3.09Å; H307-L310 HydrophobicContact CB-CB 4.45Å; H307-L310 HydrophobicContact CB-CD1 4.18Å; H307-L310 HydrophobicContact CB-CG 4.34Å; H307-L310 PolarHBondContact O-N 3.27Å; H307-K1049 PolarHBondContact CE1-NZ 3.38Å
308	D	72.4	Confident	75	Confident	22 Å²	22	31.8 Å²	31.8	12%	0.118	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-23.5	-178.4	-79.4	-3.3	0	0	0	114.9	I311 K346	D308-I311 HydrophobicContact CB-CD1 4.39Å; D308-I311 WeakPolarHBondContact OD1-CD1 3.34Å; D308-K346 PolarHBondContact O-NZ 3.41Å
309	E	70.8	Confident	75.1	Confident	59 Å²	59	37.7 Å²	37.7	28%	0.276	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-45.3	172.4	-66.9	149.1	-145.4	0	0	112.8	H307 I311 Y1045 K1049	H307-E309 PolarHBondContact O-N 3.09Å; E309-I311 PolarHBondContact O-N 3.34Å; E309-Y1045 HydrophobicContact CG-CD1 3.83Å; E309-Y1045 HydrophobicContact CG-CE1 3.26Å; E309-Y1045 HydrophobicContact CG-CE2 4.48Å; E309-Y1045 WeakPolarHBondContact OE1-CD1 3.47Å; E309-Y1045 WeakPolarHBondContact OE1-CE1 3.41Å; E309-K1049 VanDerWaalsContact CD-CE 3.42Å; E309-K1049 WeakPolarHBondContact OE1-CD 3.47Å; E309-K1049 WeakPolarHBondContact OE1-CE 3.49Å; E309-K1049 IonicContact OE1-NZ 2.65Å; E309-K1049 PolarHBondContact OE1-NZ 2.7Å; E309-K1049 IonicContact OE2-NZ 2.67Å; E309-K1049 PolarHBondContact OE2-NZ 2.66Å
310	L	70	Confident	75.2	Confident	15 Å²	15	41.7 Å²	41.7	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-77.9	-15.7	-171.2	-58.1	-176.2	0	0	0	111.8	F273 L302 H307 D312 Q313 V314	F273-L310 HydrophobicContact CD2-CD2 3.71Å; F273-L310 HydrophobicContact CE2-CD2 3.8Å; L302-L310 HydrophobicContact CD1-CB 3.87Å; L302-L310 HydrophobicContact CD2-CB 4.23Å; L302-L310 HydrophobicContact CD2-CD1 4Å; H307-L310 HydrophobicContact CB-CB 4.45Å; H307-L310 HydrophobicContact CB-CD1 4.18Å; H307-L310 HydrophobicContact CB-CG 4.34Å; H307-L310 PolarHBondContact O-N 3.27Å; L310-D312 VanDerWaalsContact C-N 3.31Å; L310-D312 PolarHBondContact O-N 2.87Å; L310-Q313 PolarHBondContact O-N 3.08Å; L310-V314 PolarHBondContact O-N 3Å
311	I	78	Confident	75	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-53.9	-46.6	176.9	-65.3	-178.9	0	0	0	111	L302 A303 D308 E309 Q313 V314 L315 A343 K346	L302-I311 HydrophobicContact CB-CG1 4.47Å; A303-I311 HydrophobicContact CB-CD1 3.69Å; D308-I311 HydrophobicContact CB-CD1 4.39Å; D308-I311 WeakPolarHBondContact OD1-CD1 3.34Å; E309-I311 PolarHBondContact O-N 3.34Å; I311-Q313 VanDerWaalsContact C-N 3.3Å; I311-Q313 PolarHBondContact O-N 3.4Å; I311-V314 PolarHBondContact O-N 3.19Å; I311-L315 HydrophobicContact CG2-CD1 3.39Å; I311-L315 HydrophobicContact CG2-CG 4Å; I311-L315 WeakPolarHBondContact O-CB 3.23Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 2.61Å; I311-A343 HydrophobicContact CD1-CB 3.4Å; I311-K346 HydrophobicContact CB-CD 4.16Å; I311-K346 HydrophobicContact CG2-CB 3.94Å; I311-K346 HydrophobicContact CG2-CD 3.9Å
312	D	78.4	Confident	75.1	Confident	82 Å²	82	51.8 Å²	51.8	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-35.6	-176.9	-59.3	-40.7	0	0	0	111.7	L310 A316 K346	L310-D312 VanDerWaalsContact C-N 3.31Å; L310-D312 PolarHBondContact O-N 2.87Å; D312-A316 WeakPolarHBondContact O-CB 3.49Å; D312-A316 PolarHBondContact O-N 3.36Å; D312-K346 VanDerWaalsContact OD1-CD 3.3Å; D312-K346 WeakPolarHBondContact OD1-CD 3.25Å; D312-K346 IonicContact OD1-NZ 3.03Å; D312-K346 PolarHBondContact OD1-NZ 3.21Å; D312-K346 WeakPolarHBondContact OD2-CE 3.45Å; D312-K346 IonicContact OD2-NZ 2.74Å; D312-K346 PolarHBondContact OD2-NZ 3.48Å
313	Q	72.7	Confident	75.2	Confident	77 Å²	77	53.2 Å²	53.2	36%	0.36	28%	0.282	S	S	.	.	H	α-helix	trans	-71.1	-36.4	176.8	-60.1	-178.9	4.2	0	0	112.2	F273 L310 I311 N317	F273-Q313 VanDerWaalsContact CE2-OE1 3.23Å; L310-Q313 PolarHBondContact O-N 3.08Å; I311-Q313 VanDerWaalsContact C-N 3.3Å; I311-Q313 PolarHBondContact O-N 3.4Å; Q313-N317 PolarHBondContact O-ND2 3.35Å
314	V	74.7	Confident	75.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.2	-48.4	172.2	171.6	0	0	0	0	110.9	F276 F280 V295 A298 A299 L302 L310 I311 A316 N317	F276-V314 HydrophobicContact CE1-CG2 3.39Å; F276-V314 HydrophobicContact CZ-CG2 3.36Å; F280-V314 HydrophobicContact CE2-CG2 4.35Å; V295-V314 HydrophobicContact CG1-CG1 3.66Å; V295-V314 WeakPolarHBondContact CG1-O 3.39Å; V295-V314 WeakPolarHBondContact O-CG1 3.27Å; A298-V314 HydrophobicContact CB-CG1 4.09Å; A299-V314 HydrophobicContact CB-CG1 3.97Å; L302-V314 HydrophobicContact CD1-CB 4.27Å; L302-V314 HydrophobicContact CD1-CG2 3.36Å; L310-V314 PolarHBondContact O-N 3Å; I311-V314 PolarHBondContact O-N 3.19Å; V314-A316 PolarHBondContact O-N 3.11Å; V314-N317 WeakPolarHBondContact O-CB 3.43Å; V314-N317 PolarHBondContact O-N 2.73Å
315	L	82.2	Confident	75.4	Confident	13 Å²	13	50.8 Å²	50.8	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-23.1	-179.8	-65.2	175.3	0	0	0	112.5	L296 A299 I311 N317 L318 K346 V347 T350	L296-L315 HydrophobicContact CD2-CD2 3.91Å; A299-L315 HydrophobicContact CB-CD2 3.83Å; A299-L315 HydrophobicContact CB-CG 4.25Å; I311-L315 HydrophobicContact CG2-CD1 3.39Å; I311-L315 HydrophobicContact CG2-CG 4Å; I311-L315 WeakPolarHBondContact O-CB 3.23Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 2.61Å; L315-N317 PolarHBondContact O-N 2.84Å; L315-L318 HydrophobicContact CB-CD1 4.06Å; L315-L318 HydrophobicContact CD2-CD1 3.62Å; L315-L318 HydrophobicContact CD2-CG 4.42Å; L315-L318 HydrophobicContact CG-CD1 4.42Å; L315-L318 VanDerWaalsContact O-CB 3.31Å; L315-L318 WeakPolarHBondContact O-CB 3.49Å; L315-L318 WeakPolarHBondContact O-CD1 3.21Å; L315-L318 VanDerWaalsContact O-CG 3.29Å; L315-L318 WeakPolarHBondContact O-CG 3.36Å; L315-L318 PolarHBondContact O-N 2.99Å; L315-K346 HydrophobicContact CD1-CB 4.31Å; L315-V347 HydrophobicContact CD1-CG2 4.03Å; L315-V347 HydrophobicContact CD2-CG2 4.18Å; L315-T350 HydrophobicContact CB-CG2 3.83Å; L315-T350 HydrophobicContact CD1-CG2 3.68Å; L315-T350 HydrophobicContact CD2-CG2 4.11Å; L315-T350 HydrophobicContact CG-CG2 4.07Å
316	A	79.1	Confident	75.9	Confident	82 Å²	82	49.8 Å²	49.8	68%	0.678	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.9	169.7	0	0	0	0	0	114	D312 V314 L318	D312-A316 WeakPolarHBondContact O-CB 3.49Å; D312-A316 PolarHBondContact O-N 3.36Å; V314-A316 PolarHBondContact O-N 3.11Å; A316-L318 VanDerWaalsContact C-N 3.33Å
317	N	74.7	Confident	76.6	Confident	52 Å²	52	50.9 Å²	50.9	28%	0.278	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.3	176.4	-66.7	-81.3	0	0	0	113.7	F280 V295 Q313 V314 L315 R319	F280-N317 HydrophobicContact CD1-CB 4.21Å; F280-N317 VanDerWaalsContact CD1-CG 3.5Å; F280-N317 WeakPolarHBondContact CD1-OD1 3.45Å; F280-N317 HydrophobicContact CE1-CB 3.59Å; F280-N317 HydrophobicContact CZ-CB 4.2Å; V295-N317 HydrophobicContact CG1-CB 4.44Å; Q313-N317 PolarHBondContact O-ND2 3.35Å; V314-N317 WeakPolarHBondContact O-CB 3.43Å; V314-N317 PolarHBondContact O-N 2.73Å; L315-N317 PolarHBondContact O-N 2.84Å; N317-R319 PolarHBondContact O-N 3.4Å
318	L	80.3	Confident	77.3	Confident	19 Å²	19	49.6 Å²	49.6	10%	0.099	26%	0.259	C	S	.	.			trans	-67.2	125.3	176.4	-71	169.1	0	0	0	111.3	D292 V295 L296 L315 A316 K320 F324 T350	D292-L318 HydrophobicContact CB-CD2 3.95Å; V295-L318 HydrophobicContact CB-CD2 3.7Å; V295-L318 HydrophobicContact CB-CG 4.42Å; V295-L318 HydrophobicContact CG1-CD2 3.52Å; V295-L318 HydrophobicContact CG1-CG 3.72Å; L296-L318 HydrophobicContact CD2-CD1 4.39Å; L296-L318 HydrophobicContact CD2-CD2 4.42Å; L296-L318 HydrophobicContact CG-CD2 4.05Å; L315-L318 HydrophobicContact CB-CD1 4.06Å; L315-L318 HydrophobicContact CD2-CD1 3.62Å; L315-L318 HydrophobicContact CD2-CG 4.42Å; L315-L318 HydrophobicContact CG-CD1 4.42Å; L315-L318 VanDerWaalsContact O-CB 3.31Å; L315-L318 WeakPolarHBondContact O-CB 3.49Å; L315-L318 WeakPolarHBondContact O-CD1 3.21Å; L315-L318 VanDerWaalsContact O-CG 3.29Å; L315-L318 WeakPolarHBondContact O-CG 3.36Å; L315-L318 PolarHBondContact O-N 2.99Å; A316-L318 VanDerWaalsContact C-N 3.33Å; L318-K320 HydrophobicContact CB-CG 4.18Å; L318-F324 HydrophobicContact CB-CE2 4.43Å; L318-F324 HydrophobicContact CD1-CE2 3.67Å; L318-F324 HydrophobicContact CD1-CZ 3.78Å; L318-F324 HydrophobicContact CD2-CD2 4.49Å; L318-F324 HydrophobicContact CD2-CE2 3.87Å; L318-F324 HydrophobicContact CG-CE2 4.21Å; L318-T350 HydrophobicContact CD1-CG2 3.93Å
319	R	76.1	Confident	77.8	Confident	127 Å²	127	50.8 Å²	50.8	48%	0.479	26%	0.263	S	S	.	.			trans	-84.1	-17	177.2	-58.3	-176	-171.9	-143.5	0.8	112	I288 F289 D292 N317 Q321	I288-R319 PolarHBondContact O-NH2 2.81Å; F289-R319 VanDerWaalsContact CD2-NH1 3.28Å; D292-R319 PolarHBondContact OD1-N 2.98Å; N317-R319 PolarHBondContact O-N 3.4Å; R319-Q321 HydrophobicContact CB-CG 4.26Å
320	K	82	Confident	78.4	Confident	84 Å²	84	48.8 Å²	48.8	37%	0.365	26%	0.255	S	S	.	.			trans	57.2	50.8	175.8	-54.1	-168.6	173.7	-171.8	0	113.4	D292 L318 F324 T350 N352	D292-K320 PolarHBondContact OD1-N 2.63Å; D292-K320 WeakPolarHBondContact OD2-CA 3.31Å; D292-K320 PolarHBondContact OD2-N 2.94Å; L318-K320 HydrophobicContact CB-CG 4.18Å; K320-F324 HydrophobicContact CB-CD1 3.71Å; K320-F324 HydrophobicContact CB-CE1 4.12Å; K320-F324 HydrophobicContact CB-CG 4.04Å; K320-F324 HydrophobicContact CD-CD1 4.13Å; K320-F324 HydrophobicContact CD-CE1 3.74Å; K320-F324 HydrophobicContact CD-CZ 4.37Å; K320-F324 HydrophobicContact CG-CD1 3.76Å; K320-F324 HydrophobicContact CG-CE1 3.62Å; K320-F324 HydrophobicContact CG-CE2 4.47Å; K320-F324 HydrophobicContact CG-CG 4.25Å; K320-F324 HydrophobicContact CG-CZ 4Å; K320-T350 WeakPolarHBondContact CE-O 3.38Å; K320-T350 PolarHBondContact NZ-O 3.32Å; K320-N352 VanDerWaalsContact CD-OD1 3.25Å; K320-N352 WeakPolarHBondContact CD-OD1 3.36Å; K320-N352 PolarHBondContact NZ-OD1 3.02Å
321	Q	76.1	Confident	79.1	Confident	58 Å²	58	48.1 Å²	48.1	27%	0.271	25%	0.251	S	S	.	.			trans	-65.1	175.1	177.5	-57.5	-161.2	-62.6	0	0	112.6	D292 R319 G323 F324	D292-Q321 PolarHBondContact OD2-N 3.41Å; R319-Q321 HydrophobicContact CB-CG 4.26Å; Q321-G323 PolarHBondContact O-N 3.43Å; Q321-F324 WeakPolarHBondContact O-CB 3.5Å; Q321-F324 PolarHBondContact O-N 2.78Å
322	I	75.2	Confident	79.5	Confident	175 Å²	175	48.1 Å²	48.1	90%	0.897	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	133	176.9	-58.6	173.5	0	0	0	109.5	F324	I322-F324 VanDerWaalsContact C-N 3.31Å; I322-F324 PolarHBondContact O-N 3.48Å
323	G	74.2	Confident	79.7	Confident	30 Å²	30	44.3 Å²	44.3	31%	0.309	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	84	-7.6	-176.5	0	0	0	0	0	115.6	Q321 T325 H326 K327	Q321-G323 PolarHBondContact O-N 3.43Å; G323-T325 PolarHBondContact O-N 2.9Å; G323-T325 VanDerWaalsContact O-N 3.12Å; G323-H326 PolarHBondContact O-N 3.44Å; G323-K327 PolarHBondContact O-N 2.73Å
324	F	80.8	Confident	80.1	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	22%	0.222	C	C	.	.	H	α-helix	trans	-50.6	-37.9	179.4	166.4	-107.6	0	0	0	114.3	D292 L296 L318 K320 Q321 I322 H326 K327 A328 T350	D292-F324 HydrophobicContact CB-CD2 3.9Å; L296-F324 HydrophobicContact CD1-CE2 4.32Å; L318-F324 HydrophobicContact CB-CE2 4.43Å; L318-F324 HydrophobicContact CD1-CE2 3.67Å; L318-F324 HydrophobicContact CD1-CZ 3.78Å; L318-F324 HydrophobicContact CD2-CD2 4.49Å; L318-F324 HydrophobicContact CD2-CE2 3.87Å; L318-F324 HydrophobicContact CG-CE2 4.21Å; K320-F324 HydrophobicContact CB-CD1 3.71Å; K320-F324 HydrophobicContact CB-CE1 4.12Å; K320-F324 HydrophobicContact CB-CG 4.04Å; K320-F324 HydrophobicContact CD-CD1 4.13Å; K320-F324 HydrophobicContact CD-CE1 3.74Å; K320-F324 HydrophobicContact CD-CZ 4.37Å; K320-F324 HydrophobicContact CG-CD1 3.76Å; K320-F324 HydrophobicContact CG-CE1 3.62Å; K320-F324 HydrophobicContact CG-CE2 4.47Å; K320-F324 HydrophobicContact CG-CG 4.25Å; K320-F324 HydrophobicContact CG-CZ 4Å; Q321-F324 WeakPolarHBondContact O-CB 3.5Å; Q321-F324 PolarHBondContact O-N 2.78Å; I322-F324 VanDerWaalsContact C-N 3.31Å; I322-F324 PolarHBondContact O-N 3.48Å; F324-H326 PolarHBondContact O-N 2.76Å; F324-K327 PolarHBondContact O-N 3.11Å; F324-A328 HydrophobicContact CD2-CB 4.44Å; F324-A328 HydrophobicContact CE1-CB 4.46Å; F324-A328 HydrophobicContact CE2-CB 3.83Å; F324-A328 HydrophobicContact CZ-CB 3.85Å; F324-A328 WeakPolarHBondContact O-CB 3.43Å; F324-A328 PolarHBondContact O-N 3.36Å; F324-T350 WeakPolarHBondContact CE1-O 3.45Å; F324-T350 WeakPolarHBondContact CZ-OG1 3.49Å
325	T	79.4	Confident	80.5	Confident	44 Å²	44	42.9 Å²	42.9	27%	0.27	22%	0.222	S	C	.	.	H	α-helix	trans	-58.9	-31.9	179.1	53.7	0	0	0	0	113.1	G323 K329 V351 N352	G323-T325 PolarHBondContact O-N 2.9Å; G323-T325 VanDerWaalsContact O-N 3.12Å; T325-K329 WeakPolarHBondContact O-CB 3.31Å; T325-K329 VanDerWaalsContact O-CG 3.23Å; T325-K329 WeakPolarHBondContact O-CG 3.48Å; T325-K329 PolarHBondContact O-N 2.9Å; T325-V351 HydrophobicContact CG2-CG1 3.97Å; T325-N352 HydrophobicContact CG2-CB 4.34Å
326	H	79.4	Confident	80.4	Confident	49 Å²	49	42.3 Å²	42.3	23%	0.227	22%	0.219	C	C	.	.	H	α-helix	trans	-80.2	-46.7	175.7	-57.9	-65.8	0	0	0	110.7	M45 G323 F324 A328 K329 N330	M45-H326 VanDerWaalsContact CE-CE1 3.5Å; M45-H326 WeakPolarHBondContact CE-CE1 3.31Å; M45-H326 VanDerWaalsContact CE-ND1 3.3Å; M45-H326 WeakPolarHBondContact CE-ND1 3.18Å; M45-H326 WeakPolarHBondContact O-CB 3.3Å; M45-H326 PolarHBondContact SD-CE1 3.28Å; M45-H326 PolarHBondContact SD-ND1 3.48Å; M45-H326 VanDerWaalsContact SD-ND1 3.38Å; G323-H326 PolarHBondContact O-N 3.44Å; F324-H326 PolarHBondContact O-N 2.76Å; H326-A328 VanDerWaalsContact C-N 3.33Å; H326-A328 PolarHBondContact O-N 2.91Å; H326-K329 WeakPolarHBondContact O-CB 3.23Å; H326-K329 PolarHBondContact O-N 3.37Å; H326-K329 VanDerWaalsContact O-N 3.13Å; H326-N330 PolarHBondContact O-N 3.44Å; H326-N330 PolarHBondContact O-ND2 3.34Å; H326-N330 PolarHBondContact O-OD1 2.56Å
327	K	81.4	Confident	80.3	Confident	51 Å²	51	38.5 Å²	38.5	22%	0.222	19%	0.188	C	C	.	.	H	α-helix	trans	-51.7	-49.8	175.8	-61.2	176.5	172.2	-156.5	0	111.9	D293 L296 G323 F324 N330 A331	D293-K327 VanDerWaalsContact OD1-CD 3.26Å; D293-K327 WeakPolarHBondContact OD1-CD 3.4Å; D293-K327 WeakPolarHBondContact OD1-CG 3.38Å; D293-K327 WeakPolarHBondContact OD2-CD 3.48Å; D293-K327 WeakPolarHBondContact OD2-CE 3.29Å; D293-K327 IonicContact OD2-NZ 2.72Å; D293-K327 PolarHBondContact OD2-NZ 2.92Å; L296-K327 HydrophobicContact CD1-CB 3.67Å; G323-K327 PolarHBondContact O-N 2.73Å; F324-K327 PolarHBondContact O-N 3.11Å; K327-N330 PolarHBondContact O-N 2.96Å; K327-A331 WeakPolarHBondContact O-CB 3.45Å; K327-A331 PolarHBondContact O-N 3.44Å
328	A	84.7	Confident	80.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-41.2	177.4	0	0	0	0	0	113.2	L296 F324 H326 N330 A331 S332 V347 V351	L296-A328 HydrophobicContact CD1-CB 4.26Å; L296-A328 HydrophobicContact CD2-CB 4.31Å; F324-A328 HydrophobicContact CD2-CB 4.44Å; F324-A328 HydrophobicContact CE1-CB 4.46Å; F324-A328 HydrophobicContact CE2-CB 3.83Å; F324-A328 HydrophobicContact CZ-CB 3.85Å; F324-A328 WeakPolarHBondContact O-CB 3.43Å; F324-A328 PolarHBondContact O-N 3.36Å; H326-A328 VanDerWaalsContact C-N 3.33Å; H326-A328 PolarHBondContact O-N 2.91Å; A328-N330 VanDerWaalsContact C-N 3.27Å; A328-N330 PolarHBondContact O-N 3.31Å; A328-A331 PolarHBondContact O-N 3.47Å; A328-S332 VanDerWaalsContact O-CB 3.29Å; A328-S332 WeakPolarHBondContact O-CB 3.5Å; A328-S332 PolarHBondContact O-N 2.88Å; A328-V347 HydrophobicContact CB-CG1 4.4Å; A328-V347 VanDerWaalsContact O-CG1 3.31Å; A328-V347 WeakPolarHBondContact O-CG1 3.27Å; A328-V351 HydrophobicContact CB-CG2 3.65Å
329	K	83.3	Confident	80	Confident	46 Å²	46	38.7 Å²	38.7	20%	0.2	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-41.5	171.5	-81	176.8	179.2	-170.2	0	111.9	T325 H326 S332 I333 M348 V351 V364	T325-K329 WeakPolarHBondContact O-CB 3.31Å; T325-K329 VanDerWaalsContact O-CG 3.23Å; T325-K329 WeakPolarHBondContact O-CG 3.48Å; T325-K329 PolarHBondContact O-N 2.9Å; H326-K329 WeakPolarHBondContact O-CB 3.23Å; H326-K329 PolarHBondContact O-N 3.37Å; H326-K329 VanDerWaalsContact O-N 3.13Å; K329-S332 PolarHBondContact O-N 2.85Å; K329-I333 VanDerWaalsContact O-CG1 3.29Å; K329-I333 WeakPolarHBondContact O-CG1 3.33Å; K329-I333 PolarHBondContact O-N 3.5Å; K329-M348 HydrophobicContact CG-CE 4.16Å; K329-M348 HydrophobicContact CG-SD 4.07Å; K329-V351 HydrophobicContact CG-CG2 4.34Å; K329-V364 HydrophobicContact CD-CG1 4.43Å; K329-V364 WeakPolarHBondContact CE-O 3.48Å; K329-V364 HydrophobicContact CG-CG1 4.3Å
330	N	84.1	Confident	80.1	Confident	18 Å²	18	34.7 Å²	34.7	10%	0.096	18%	0.178	C	C	.	.	H	α-helix	trans	-72.1	-45.8	-176.8	-55.7	-12.1	0	0	0	110.9	M45 G46 V47 H326 K327 A328 S332 I333 R334	M45-N330 PolarHBondContact O-ND2 2.98Å; G46-N330 PolarHBondContact O-ND2 3.4Å; V47-N330 HydrophobicContact CG2-CB 4.37Å; V47-N330 WeakPolarHBondContact CG2-ND2 3.45Å; V47-N330 WeakPolarHBondContact CG2-OD1 3.44Å; H326-N330 PolarHBondContact O-N 3.44Å; H326-N330 PolarHBondContact O-ND2 3.34Å; H326-N330 PolarHBondContact O-OD1 2.56Å; K327-N330 PolarHBondContact O-N 2.96Å; A328-N330 VanDerWaalsContact C-N 3.27Å; A328-N330 PolarHBondContact O-N 3.31Å; N330-S332 VanDerWaalsContact C-N 3.31Å; N330-S332 PolarHBondContact O-N 3.23Å; N330-I333 PolarHBondContact O-N 2.97Å; N330-R334 VanDerWaalsContact O-CG 3.32Å; N330-R334 WeakPolarHBondContact O-CG 3.15Å; N330-R334 PolarHBondContact O-N 3.42Å
331	A	84.1	Confident	79.9	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-56.8	-43.8	172.2	0	0	0	0	0	111.9	L296 K327 A328 I333 R334 L335 V347	L296-A331 HydrophobicContact CB-CB 4.12Å; L296-A331 HydrophobicContact CD1-CB 4.35Å; L296-A331 HydrophobicContact CD2-CB 4.08Å; L296-A331 HydrophobicContact CG-CB 4.42Å; K327-A331 WeakPolarHBondContact O-CB 3.45Å; K327-A331 PolarHBondContact O-N 3.44Å; A328-A331 PolarHBondContact O-N 3.47Å; A331-I333 PolarHBondContact O-N 2.89Å; A331-R334 PolarHBondContact O-N 3.11Å; A331-L335 WeakPolarHBondContact O-CG 3.47Å; A331-L335 PolarHBondContact O-N 3.42Å; A331-V347 HydrophobicContact CB-CG1 3.82Å
332	S	86	Confident	80.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.3	-46.8	173.8	174.4	0	0	0	0	112.6	A328 K329 N330 L335 A336 S344	A328-S332 VanDerWaalsContact O-CB 3.29Å; A328-S332 WeakPolarHBondContact O-CB 3.5Å; A328-S332 PolarHBondContact O-N 2.88Å; K329-S332 PolarHBondContact O-N 2.85Å; N330-S332 VanDerWaalsContact C-N 3.31Å; N330-S332 PolarHBondContact O-N 3.23Å; S332-L335 WeakPolarHBondContact O-CB 3.22Å; S332-L335 PolarHBondContact O-N 2.97Å; S332-A336 PolarHBondContact O-N 2.87Å; S332-S344 VanDerWaalsContact CB-O 3.3Å; S332-S344 WeakPolarHBondContact CB-O 3.34Å; S332-S344 VanDerWaalsContact O-CB 3.29Å; S332-S344 WeakPolarHBondContact O-CB 3.28Å; S332-S344 PolarHBondContact O-OG 3.4Å; S332-S344 PolarHBondContact OG-O 3.11Å; S332-S344 PolarHBondContact OG-OG 3.04Å; S332-S344 VanDerWaalsContact OG-OG 3.09Å
333	I	83.4	Confident	80.4	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-66.6	-39	178.1	-66.7	166	0	0	0	111.2	P83 E84 K329 N330 A331 L335 A336 S337 R367 L368 H371	P83-I333 HydrophobicContact CB-CB 4.02Å; P83-I333 HydrophobicContact CB-CG2 3.76Å; P83-I333 HydrophobicContact CG-CG2 4.14Å; E84-I333 HydrophobicContact CB-CG2 4.44Å; E84-I333 HydrophobicContact CG-CG2 3.66Å; K329-I333 VanDerWaalsContact O-CG1 3.29Å; K329-I333 WeakPolarHBondContact O-CG1 3.33Å; K329-I333 PolarHBondContact O-N 3.5Å; N330-I333 PolarHBondContact O-N 2.97Å; A331-I333 PolarHBondContact O-N 2.89Å; I333-L335 VanDerWaalsContact C-N 3.26Å; I333-L335 PolarHBondContact O-N 3.35Å; I333-A336 PolarHBondContact O-N 3.43Å; I333-S337 PolarHBondContact O-N 3.01Å; I333-S337 PolarHBondContact O-OG 2.88Å; I333-R367 HydrophobicContact CD1-CB 4.33Å; I333-R367 HydrophobicContact CD1-CG 3.7Å; I333-L368 HydrophobicContact CG1-CD1 4.34Å; I333-H371 PolarHBondContact O-NE2 3.33Å; I333-H371 VanDerWaalsContact O-NE2 3.12Å
334	R	80.4	Confident	80.9	Confident	46 Å²	46	20.1 Å²	20.1	17%	0.174	10%	0.099	C	C	.	.	H	α-helix	trans	-58	-37.9	173.2	-71.7	-173.9	-56.6	157.9	11.8	111.7	P83 E297 N330 A331 S337 L338	P83-R334 HydrophobicContact CB-CG 3.67Å; E297-R334 IonicContact OE2-CZ 3.61Å; E297-R334 IonicContact OE2-NH1 2.81Å; E297-R334 PolarHBondContact OE2-NH1 2.96Å; E297-R334 IonicContact OE2-NH2 2.68Å; E297-R334 PolarHBondContact OE2-NH2 3.48Å; N330-R334 VanDerWaalsContact O-CG 3.32Å; N330-R334 WeakPolarHBondContact O-CG 3.15Å; N330-R334 PolarHBondContact O-N 3.42Å; A331-R334 PolarHBondContact O-N 3.11Å; R334-S337 WeakPolarHBondContact O-CB 3.44Å; R334-L338 WeakPolarHBondContact O-CG 3.35Å; R334-L338 PolarHBondContact O-N 2.85Å
335	L	82.8	Confident	81	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-71.7	-40.5	175.8	-73.5	166.2	0	0	0	112.8	C300 A303 A331 S332 I333 S337 L338 G339 L340 A343 V347	C300-L335 HydrophobicContact CB-CD2 4.45Å; A303-L335 HydrophobicContact CB-CD2 3.43Å; A303-L335 VanDerWaalsContact CB-CD2 3.43Å; A331-L335 WeakPolarHBondContact O-CG 3.47Å; A331-L335 PolarHBondContact O-N 3.42Å; S332-L335 WeakPolarHBondContact O-CB 3.22Å; S332-L335 PolarHBondContact O-N 2.97Å; I333-L335 VanDerWaalsContact C-N 3.26Å; I333-L335 PolarHBondContact O-N 3.35Å; L335-S337 VanDerWaalsContact C-N 3.31Å; L335-S337 PolarHBondContact O-N 3.45Å; L335-L338 PolarHBondContact O-N 3.27Å; L335-L338 VanDerWaalsContact O-N 3.09Å; L335-G339 PolarHBondContact O-N 2.87Å; L335-L340 HydrophobicContact CB-CB 4.47Å; L335-L340 HydrophobicContact CD2-CB 4.25Å; L335-L340 HydrophobicContact CD2-CD1 3.85Å; L335-L340 WeakPolarHBondContact O-CB 3.47Å; L335-L340 PolarHBondContact O-N 3.4Å; L335-L340 VanDerWaalsContact O-N 3.08Å; L335-A343 HydrophobicContact CD1-CB 4.01Å; L335-A343 HydrophobicContact CD2-CB 4.11Å; L335-A343 HydrophobicContact CG-CB 4.49Å; L335-V347 HydrophobicContact CD1-CB 4.28Å; L335-V347 HydrophobicContact CD1-CG2 3.62Å
336	A	81.1	Confident	81.3	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.2	-38.7	173.4	0	0	0	0	0	112	S332 I333 L338 G339 F341 L368 M372 I375	S332-A336 PolarHBondContact O-N 2.87Å; I333-A336 PolarHBondContact O-N 3.43Å; A336-L338 PolarHBondContact O-N 2.76Å; A336-G339 PolarHBondContact O-N 3.13Å; A336-F341 HydrophobicContact CB-CD1 4.23Å; A336-F341 HydrophobicContact CB-CE1 4.47Å; A336-L368 HydrophobicContact CB-CD1 3.66Å; A336-M372 HydrophobicContact CB-CG 4.01Å; A336-I375 WeakPolarHBondContact O-CD1 3.35Å
337	S	77.1	Confident	81.6	Confident	2 Å²	2	16.6 Å²	16.6	1%	0.014	8%	0.079	C	C	.	.	H	α-helix	trans	-52.5	-35.3	171	-74.2	0	0	0	0	113.5	P83 V86 I333 R334 L335 G339 H371 I375	P83-S337 PolarHBondContact O-OG 3.41Å; V86-S337 VanDerWaalsContact CG1-O 3.23Å; V86-S337 WeakPolarHBondContact CG1-O 3.47Å; I333-S337 PolarHBondContact O-N 3.01Å; I333-S337 PolarHBondContact O-OG 2.88Å; R334-S337 WeakPolarHBondContact O-CB 3.44Å; L335-S337 VanDerWaalsContact C-N 3.31Å; L335-S337 PolarHBondContact O-N 3.45Å; S337-G339 VanDerWaalsContact C-N 3.29Å; S337-G339 PolarHBondContact O-N 3.11Å; S337-H371 WeakPolarHBondContact CA-NE2 3.5Å; S337-H371 WeakPolarHBondContact CB-NE2 3.36Å; S337-H371 PolarHBondContact N-NE2 3.23Å; S337-H371 PolarHBondContact OG-CE1 2.95Å; S337-H371 PolarHBondContact OG-NE2 3.35Å; S337-I375 VanDerWaalsContact CA-CD1 3.45Å
338	L	74.9	Confident	81.8	Confident	68 Å²	68	14.2 Å²	14.2	36%	0.356	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	3.6	179.8	-60.8	170.4	0	0	0	113.1	P87 K304 R334 L335 A336 L340	P87-L338 HydrophobicContact CG-CD2 4.36Å; K304-L338 HydrophobicContact CD-CD1 4.28Å; K304-L338 HydrophobicContact CG-CD1 3.79Å; R334-L338 WeakPolarHBondContact O-CG 3.35Å; R334-L338 PolarHBondContact O-N 2.85Å; L335-L338 PolarHBondContact O-N 3.27Å; L335-L338 VanDerWaalsContact O-N 3.09Å; A336-L338 PolarHBondContact O-N 2.76Å; L338-L340 HydrophobicContact CB-CD1 3.91Å; L338-L340 HydrophobicContact CB-CG 4.06Å; L338-L340 HydrophobicContact CD1-CD1 4.28Å; L338-L340 PolarHBondContact O-N 2.97Å
339	G	72.7	Confident	81.7	Confident	7 Å²	7	18.1 Å²	18.1	7%	0.072	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	4.8	-175.1	0	0	0	0	0	114.4	L335 A336 S337 F341 K385	L335-G339 PolarHBondContact O-N 2.87Å; A336-G339 PolarHBondContact O-N 3.13Å; S337-G339 VanDerWaalsContact C-N 3.29Å; S337-G339 PolarHBondContact O-N 3.11Å; G339-F341 PolarHBondContact O-N 3.42Å; G339-K385 PolarHBondContact O-NZ 3.15Å
340	L	79.2	Confident	81.7	Confident	43 Å²	43	16.8 Å²	16.8	23%	0.225	8%	0.083	C	C	.	.			trans	-84.3	59.8	-179.3	-59	169.5	0	0	0	110.1	A303 K304 L335 L338 E342 A343 S344	A303-L340 HydrophobicContact CB-CD1 4.04Å; K304-L340 HydrophobicContact CG-CD1 4.38Å; L335-L340 HydrophobicContact CB-CB 4.47Å; L335-L340 HydrophobicContact CD2-CB 4.25Å; L335-L340 HydrophobicContact CD2-CD1 3.85Å; L335-L340 WeakPolarHBondContact O-CB 3.47Å; L335-L340 PolarHBondContact O-N 3.4Å; L335-L340 VanDerWaalsContact O-N 3.08Å; L338-L340 HydrophobicContact CB-CD1 3.91Å; L338-L340 HydrophobicContact CB-CG 4.06Å; L338-L340 HydrophobicContact CD1-CD1 4.28Å; L338-L340 PolarHBondContact O-N 2.97Å; L340-E342 VanDerWaalsContact C-N 3.26Å; L340-E342 PolarHBondContact O-N 2.96Å; L340-A343 HydrophobicContact CB-CB 4.23Å; L340-A343 PolarHBondContact O-N 3.32Å; L340-S344 VanDerWaalsContact O-CB 3.26Å; L340-S344 WeakPolarHBondContact O-CB 3.09Å; L340-S344 PolarHBondContact O-N 3.49Å
341	F	78.4	Confident	81.4	Confident	12 Å²	12	16.1 Å²	16.1	5%	0.053	8%	0.08	C	C	.	.	H	α-helix	trans	-62.7	-29.1	-171.2	-57.1	-47	0	0	0	113.8	A336 G339 S344 Y345 M372 I375 K385 V389 F393	A336-F341 HydrophobicContact CB-CD1 4.23Å; A336-F341 HydrophobicContact CB-CE1 4.47Å; G339-F341 PolarHBondContact O-N 3.42Å; F341-S344 WeakPolarHBondContact O-CB 3.29Å; F341-Y345 VanDerWaalsContact O-CB 3.3Å; F341-Y345 WeakPolarHBondContact O-CB 3.48Å; F341-Y345 PolarHBondContact O-N 3.48Å; F341-M372 HydrophobicContact CB-CE 3.85Å; F341-M372 HydrophobicContact CD1-CE 3.74Å; F341-M372 HydrophobicContact CD1-CG 4.08Å; F341-M372 HydrophobicContact CD1-SD 4.47Å; F341-M372 HydrophobicContact CE1-CE 4.41Å; F341-M372 HydrophobicContact CE1-CG 4.17Å; F341-M372 HydrophobicContact CG-CE 3.83Å; F341-I375 HydrophobicContact CE1-CG2 4.05Å; F341-I375 HydrophobicContact CZ-CG2 3.82Å; F341-K385 HydrophobicContact CD2-CD 4.13Å; F341-K385 HydrophobicContact CE2-CD 3.71Å; F341-V389 HydrophobicContact CD2-CG1 4.21Å; F341-F393 HydrophobicContact CB-CD2 4.32Å; F341-F393 HydrophobicContact CB-CE1 4.3Å; F341-F393 HydrophobicContact CB-CE2 3.36Å; F341-F393 HydrophobicContact CB-CZ 3.36Å; F341-F393 HydrophobicContact CD2-CE2 4.15Å; F341-F393 HydrophobicContact CG-CE2 4.05Å; F341-F393 HydrophobicContact CG-CZ 4.49Å
342	E	79.2	Confident	80.6	Confident	30 Å²	30	19.8 Å²	19.8	14%	0.14	10%	0.099	C	C	.	.	H	α-helix	trans	-75.9	-45.3	178.9	-67	-68.6	-167.7	0	0	112.5	L340 S344 Y345 K346 F393 R396 R1080	L340-E342 VanDerWaalsContact C-N 3.26Å; L340-E342 PolarHBondContact O-N 2.96Å; E342-S344 VanDerWaalsContact C-N 3.31Å; E342-S344 PolarHBondContact O-N 3.4Å; E342-Y345 WeakPolarHBondContact O-CB 3.45Å; E342-Y345 PolarHBondContact O-N 2.73Å; E342-K346 WeakPolarHBondContact O-CG 3.26Å; E342-K346 PolarHBondContact O-N 3.06Å; E342-F393 HydrophobicContact CG-CZ 4.43Å; E342-R396 IonicContact OE1-CZ 2.68Å; E342-R396 IonicContact OE1-NH1 3.62Å; E342-R396 PolarHBondContact OE1-NH1 2.77Å; E342-R396 IonicContact OE1-NH2 3.66Å; E342-R396 PolarHBondContact OE1-NH2 2.84Å; E342-R396 IonicContact OE2-NH1 2.84Å; E342-R396 PolarHBondContact OE2-NH1 3.08Å; E342-R1080 VanDerWaalsContact CD-NH1 3.26Å; E342-R1080 WeakPolarHBondContact OE1-CD 3.45Å; E342-R1080 VanDerWaalsContact OE1-CG 3.31Å; E342-R1080 WeakPolarHBondContact OE1-CG 3.35Å; E342-R1080 IonicContact OE1-CZ 2.96Å; E342-R1080 IonicContact OE1-NE 3.09Å; E342-R1080 IonicContact OE1-NH1 3.41Å; E342-R1080 IonicContact OE2-CZ 2.7Å; E342-R1080 IonicContact OE2-NE 2.81Å; E342-R1080 IonicContact OE2-NH1 3.36Å; E342-R1080 PolarHBondContact OE2-NH1 3.38Å; E342-R1080 IonicContact OE2-NH2 3.73Å
343	A	82.6	Confident	79.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.6	-44	169.3	0	0	0	0	0	111.8	A303 I311 L335 L340 Y345 K346 V347	A303-A343 HydrophobicContact CB-CB 3.44Å; A303-A343 VanDerWaalsContact CB-CB 3.44Å; I311-A343 HydrophobicContact CD1-CB 3.4Å; L335-A343 HydrophobicContact CD1-CB 4.01Å; L335-A343 HydrophobicContact CD2-CB 4.11Å; L335-A343 HydrophobicContact CG-CB 4.49Å; L340-A343 HydrophobicContact CB-CB 4.23Å; L340-A343 PolarHBondContact O-N 3.32Å; A343-Y345 VanDerWaalsContact C-N 3.27Å; A343-Y345 PolarHBondContact O-N 3.39Å; A343-K346 PolarHBondContact O-N 2.89Å; A343-V347 WeakPolarHBondContact O-CG2 3.49Å; A343-V347 PolarHBondContact O-N 3.01Å
344	S	84.3	Confident	78.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-55.1	-43.6	173.8	176.6	0	0	0	0	112	S332 L340 F341 E342 M348 L368	S332-S344 VanDerWaalsContact CB-O 3.3Å; S332-S344 WeakPolarHBondContact CB-O 3.34Å; S332-S344 VanDerWaalsContact O-CB 3.29Å; S332-S344 WeakPolarHBondContact O-CB 3.28Å; S332-S344 PolarHBondContact O-OG 3.4Å; S332-S344 PolarHBondContact OG-O 3.11Å; S332-S344 PolarHBondContact OG-OG 3.04Å; S332-S344 VanDerWaalsContact OG-OG 3.09Å; L340-S344 VanDerWaalsContact O-CB 3.26Å; L340-S344 WeakPolarHBondContact O-CB 3.09Å; L340-S344 PolarHBondContact O-N 3.49Å; F341-S344 WeakPolarHBondContact O-CB 3.29Å; E342-S344 VanDerWaalsContact C-N 3.31Å; E342-S344 PolarHBondContact O-N 3.4Å; S344-M348 PolarHBondContact O-N 3.25Å; S344-L368 WeakPolarHBondContact OG-CD1 3.47Å
345	Y	83.3	Confident	76.5	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-47.9	177.4	-170	-94.2	0	0	0	112.4	F341 E342 A343 V347 M348 Q349 F393 R396 M397 D400 L402	F341-Y345 VanDerWaalsContact O-CB 3.3Å; F341-Y345 WeakPolarHBondContact O-CB 3.48Å; F341-Y345 PolarHBondContact O-N 3.48Å; E342-Y345 WeakPolarHBondContact O-CB 3.45Å; E342-Y345 PolarHBondContact O-N 2.73Å; A343-Y345 VanDerWaalsContact C-N 3.27Å; A343-Y345 PolarHBondContact O-N 3.39Å; Y345-V347 VanDerWaalsContact C-N 3.32Å; Y345-V347 PolarHBondContact O-N 3.25Å; Y345-M348 CarbonylContact O-C 3.56Å; Y345-M348 WeakPolarHBondContact O-CA 3.04Å; Y345-M348 WeakPolarHBondContact O-CB 3.47Å; Y345-M348 PolarHBondContact O-N 3.04Å; Y345-Q349 HydrophobicContact CD1-CG 4.01Å; Y345-Q349 VanDerWaalsContact CE1-CD 3.4Å; Y345-Q349 HydrophobicContact CE1-CG 3.73Å; Y345-Q349 WeakPolarHBondContact O-CG 3.22Å; Y345-Q349 PolarHBondContact O-N 3.42Å; Y345-F393 AromaticContact CD2-CD1 3.93Å; Y345-F393 HydrophobicContact CD2-CD1 3.93Å; Y345-F393 HydrophobicContact CD2-CE1 4.01Å; Y345-F393 HydrophobicContact CG-CE1 4.13Å; Y345-R396 HydrophobicContact CE2-CB 3.86Å; Y345-R396 VanDerWaalsContact OH-C 3.32Å; Y345-R396 PolarHBondContact OH-O 2.98Å; Y345-M397 HydrophobicContact CE2-CG 4.1Å; Y345-D400 WeakPolarHBondContact OH-CB 3.11Å; Y345-D400 PolarHBondContact OH-OD2 3.19Å; Y345-L402 HydrophobicContact CE2-CD1 3.93Å
346	K	84.4	Confident	74.5	Confident	17 Å²	17	33.9 Å²	33.9	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-54.7	-46.8	175.4	-73.7	-179.2	171	-155.3	0	112	D308 I311 D312 L315 E342 A343 M348 Q349 T350	D308-K346 PolarHBondContact O-NZ 3.41Å; I311-K346 HydrophobicContact CB-CD 4.16Å; I311-K346 HydrophobicContact CG2-CB 3.94Å; I311-K346 HydrophobicContact CG2-CD 3.9Å; D312-K346 VanDerWaalsContact OD1-CD 3.3Å; D312-K346 WeakPolarHBondContact OD1-CD 3.25Å; D312-K346 IonicContact OD1-NZ 3.03Å; D312-K346 PolarHBondContact OD1-NZ 3.21Å; D312-K346 WeakPolarHBondContact OD2-CE 3.45Å; D312-K346 IonicContact OD2-NZ 2.74Å; D312-K346 PolarHBondContact OD2-NZ 3.48Å; L315-K346 HydrophobicContact CD1-CB 4.31Å; E342-K346 WeakPolarHBondContact O-CG 3.26Å; E342-K346 PolarHBondContact O-N 3.06Å; A343-K346 PolarHBondContact O-N 2.89Å; K346-M348 VanDerWaalsContact C-N 3.33Å; K346-M348 PolarHBondContact O-N 3.47Å; K346-Q349 WeakPolarHBondContact O-CB 3.36Å; K346-Q349 PolarHBondContact O-N 3.13Å; K346-T350 PolarHBondContact O-N 3.21Å
347	V	85.6	Confident	72.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-40.2	175.2	174.6	0	0	0	0	111.3	L296 L315 A328 A331 L335 A343 Y345 Q349 T350	L296-V347 HydrophobicContact CD2-CG1 3.72Å; L315-V347 HydrophobicContact CD1-CG2 4.03Å; L315-V347 HydrophobicContact CD2-CG2 4.18Å; A328-V347 HydrophobicContact CB-CG1 4.4Å; A328-V347 VanDerWaalsContact O-CG1 3.31Å; A328-V347 WeakPolarHBondContact O-CG1 3.27Å; A331-V347 HydrophobicContact CB-CG1 3.82Å; L335-V347 HydrophobicContact CD1-CB 4.28Å; L335-V347 HydrophobicContact CD1-CG2 3.62Å; A343-V347 WeakPolarHBondContact O-CG2 3.49Å; A343-V347 PolarHBondContact O-N 3.01Å; Y345-V347 VanDerWaalsContact C-N 3.32Å; Y345-V347 PolarHBondContact O-N 3.25Å; V347-Q349 VanDerWaalsContact C-N 3.35Å; V347-Q349 PolarHBondContact O-N 3.3Å; V347-T350 PolarHBondContact O-N 3.39Å; V347-T350 PolarHBondContact O-OG1 2.94Å
348	M	85.3	Confident	71.3	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-36.2	176.1	-170.2	60.7	79.8	0	0	112.9	K329 S344 Y345 K346 T350 V351 V364 L368 L402	K329-M348 HydrophobicContact CG-CE 4.16Å; K329-M348 HydrophobicContact CG-SD 4.07Å; S344-M348 PolarHBondContact O-N 3.25Å; Y345-M348 CarbonylContact O-C 3.56Å; Y345-M348 WeakPolarHBondContact O-CA 3.04Å; Y345-M348 WeakPolarHBondContact O-CB 3.47Å; Y345-M348 PolarHBondContact O-N 3.04Å; K346-M348 VanDerWaalsContact C-N 3.33Å; K346-M348 PolarHBondContact O-N 3.47Å; M348-T350 PolarHBondContact O-N 3.18Å; M348-V351 WeakPolarHBondContact O-CB 3.37Å; M348-V351 WeakPolarHBondContact O-CG2 3.23Å; M348-V351 PolarHBondContact O-N 3.49Å; M348-V351 HydrophobicContact SD-CG2 3.95Å; M348-V364 HydrophobicContact SD-CG1 3.58Å; M348-V364 VanDerWaalsContact SD-CG1 3.58Å; M348-L368 HydrophobicContact CB-CD2 4.17Å; M348-L368 HydrophobicContact CE-CB 3.69Å; M348-L368 HydrophobicContact CE-CD2 3.67Å; M348-L368 HydrophobicContact CE-CG 4.23Å; M348-L368 HydrophobicContact CG-CD2 4.14Å; M348-L402 HydrophobicContact CG-CD1 4.01Å; M348-L402 HydrophobicContact CG-CD2 4.12Å
349	Q	82.8	Confident	69.5	Low	81 Å²	81	51.7 Å²	51.7	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-25.4	176.9	-70.5	176.6	-60	0	0	113.1	Y345 K346 V347 V351 D400 L402	Y345-Q349 HydrophobicContact CD1-CG 4.01Å; Y345-Q349 VanDerWaalsContact CE1-CD 3.4Å; Y345-Q349 HydrophobicContact CE1-CG 3.73Å; Y345-Q349 WeakPolarHBondContact O-CG 3.22Å; Y345-Q349 PolarHBondContact O-N 3.42Å; K346-Q349 WeakPolarHBondContact O-CB 3.36Å; K346-Q349 PolarHBondContact O-N 3.13Å; V347-Q349 VanDerWaalsContact C-N 3.35Å; V347-Q349 PolarHBondContact O-N 3.3Å; Q349-V351 VanDerWaalsContact C-N 3.29Å; Q349-V351 PolarHBondContact O-N 3.39Å; Q349-D400 PolarHBondContact NE2-OD2 2.87Å; Q349-L402 HydrophobicContact CG-CD1 4.5Å
350	T	83.2	Confident	67.8	Low	18 Å²	18	55.8 Å²	55.8	11%	0.11	29%	0.287	C	S	.	.	H	α-helix	trans	-70.6	-24.9	178.2	68.2	0	0	0	0	113.6	L315 L318 K320 F324 K346 V347 M348 N352	L315-T350 HydrophobicContact CB-CG2 3.83Å; L315-T350 HydrophobicContact CD1-CG2 3.68Å; L315-T350 HydrophobicContact CD2-CG2 4.11Å; L315-T350 HydrophobicContact CG-CG2 4.07Å; L318-T350 HydrophobicContact CD1-CG2 3.93Å; K320-T350 WeakPolarHBondContact CE-O 3.38Å; K320-T350 PolarHBondContact NZ-O 3.32Å; F324-T350 WeakPolarHBondContact CE1-O 3.45Å; F324-T350 WeakPolarHBondContact CZ-OG1 3.49Å; K346-T350 PolarHBondContact O-N 3.21Å; V347-T350 PolarHBondContact O-N 3.39Å; V347-T350 PolarHBondContact O-OG1 2.94Å; M348-T350 PolarHBondContact O-N 3.18Å; T350-N352 PolarHBondContact O-N 3.46Å
351	V	79.5	Confident	66.1	Low	5 Å²	5	57.1 Å²	57.1	3%	0.03	29%	0.294	C	S	.	.	S	Bend	trans	-56.7	125.1	-177.4	179.7	0	0	0	0	108.9	T325 A328 K329 M348 Q349 K353 V364	T325-V351 HydrophobicContact CG2-CG1 3.97Å; A328-V351 HydrophobicContact CB-CG2 3.65Å; K329-V351 HydrophobicContact CG-CG2 4.34Å; M348-V351 WeakPolarHBondContact O-CB 3.37Å; M348-V351 WeakPolarHBondContact O-CG2 3.23Å; M348-V351 PolarHBondContact O-N 3.49Å; M348-V351 HydrophobicContact SD-CG2 3.95Å; Q349-V351 VanDerWaalsContact C-N 3.29Å; Q349-V351 PolarHBondContact O-N 3.39Å; V351-K353 PolarHBondContact O-N 2.89Å; V351-V364 HydrophobicContact CB-CG1 3.96Å; V351-V364 HydrophobicContact CG1-CG1 3.59Å; V351-V364 HydrophobicContact CG2-CG1 4.21Å
352	N	67.2	Low	64.9	Low	78 Å²	78	60 Å²	60	42%	0.417	31%	0.313	S	S	.	.			trans	-57.6	113.9	176	-75.1	-13.6	0	0	0	109.2	K320 T325 T350 A354	K320-N352 VanDerWaalsContact CD-OD1 3.25Å; K320-N352 WeakPolarHBondContact CD-OD1 3.36Å; K320-N352 PolarHBondContact NZ-OD1 3.02Å; T325-N352 HydrophobicContact CG2-CB 4.34Å; T350-N352 PolarHBondContact O-N 3.46Å; N352-A354 VanDerWaalsContact C-N 3.31Å; N352-A354 PolarHBondContact O-N 3.15Å
353	K	64.5	Low	64	Low	98 Å²	98	62.4 Å²	62.4	43%	0.426	33%	0.327	S	S	.	.			trans	-63.3	96.5	173.7	-59	-176.6	-170.1	-176.2	0	106.5	V351 N355 L361 D400	V351-K353 PolarHBondContact O-N 2.89Å; K353-N355 PolarHBondContact O-N 3.27Å; K353-L361 HydrophobicContact CB-CD2 4.01Å; K353-D400 WeakPolarHBondContact CE-O 3.36Å; K353-D400 PolarHBondContact NZ-O 3.46Å
354	A	50.9	Low	62.9	Low	49 Å²	49	62.9 Å²	62.9	41%	0.405	33%	0.33	S	S	.	.			trans	-65.9	104.3	-177.1	0	0	0	0	0	108.1	N352 D356 V362	N352-A354 VanDerWaalsContact C-N 3.31Å; N352-A354 PolarHBondContact O-N 3.15Å; A354-D356 PolarHBondContact O-N 3.36Å; A354-V362 HydrophobicContact CB-CG2 4.2Å
355	N	46.8	Very low	62.1	Low	128 Å²	128	62.9 Å²	62.9	68%	0.684	33%	0.33	S	S	*	.	B	Isolated β-bridge	trans	-68.9	91	156.9	-75	-17.1	0	0	0	106.2	K353	K353-N355 PolarHBondContact O-N 3.27Å
356	D	42.5	Very low	61.4	Low	70 Å²	70	64.3 Å²	64.3	37%	0.374	34%	0.337	S	S	.	.			trans	-50.8	139.3	158.9	-173.3	37.3	0	0	0	107.6	A354 T358 R359 M360	A354-D356 PolarHBondContact O-N 3.36Å; D356-T358 VanDerWaalsContact CG-OG1 3.32Å; D356-T358 PolarHBondContact O-N 3.14Å; D356-T358 WeakPolarHBondContact OD2-CB 3.43Å; D356-T358 VanDerWaalsContact OD2-CG2 3.27Å; D356-T358 WeakPolarHBondContact OD2-CG2 3.08Å; D356-T358 PolarHBondContact OD2-OG1 3.31Å; D356-R359 WeakPolarHBondContact O-CA 3.26Å; D356-R359 PolarHBondContact O-N 2.68Å; D356-M360 HydrophobicContact CB-CB 4.48Å
357	P	43.7	Very low	60.8	Low	132 Å²	132	65 Å²	65	86%	0.857	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-16.4	178.1	11.8	-30	0	0	0	115.4	R359	P357-R359 VanDerWaalsContact C-N 3.26Å; P357-R359 PolarHBondContact O-N 3.24Å
358	T	47	Very low	60.3	Low	86 Å²	86	65 Å²	65	53%	0.528	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.6	169.9	65.3	0	0	0	0	115.3	D356 M360	D356-T358 VanDerWaalsContact CG-OG1 3.32Å; D356-T358 PolarHBondContact O-N 3.14Å; D356-T358 WeakPolarHBondContact OD2-CB 3.43Å; D356-T358 VanDerWaalsContact OD2-CG2 3.27Å; D356-T358 WeakPolarHBondContact OD2-CG2 3.08Å; D356-T358 PolarHBondContact OD2-OG1 3.31Å; T358-M360 PolarHBondContact O-N 3.45Å; T358-M360 VanDerWaalsContact OG1-CB 3.29Å; T358-M360 WeakPolarHBondContact OG1-CB 3.47Å; T358-M360 WeakPolarHBondContact OG1-CG 3.28Å; T358-M360 PolarHBondContact OG1-N 2.88Å
359	R	37	Very low	59.6	Low	225 Å²	225	65.4 Å²	65.4	85%	0.849	34%	0.342	S	S	*	.			trans	58.6	19.5	-165.3	-61.4	-179	173.1	-178.9	-2.5	114.4	D356 P357	D356-R359 WeakPolarHBondContact O-CA 3.26Å; D356-R359 PolarHBondContact O-N 2.68Å; P357-R359 VanDerWaalsContact C-N 3.26Å; P357-R359 PolarHBondContact O-N 3.24Å
360	M	37.1	Very low	59.1	Low	93 Å²	93	67.8 Å²	67.8	46%	0.458	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-80.6	119.5	171.7	-64.8	-89.7	85.1	0	0	110.4	D356 T358 V362	D356-M360 HydrophobicContact CB-CB 4.48Å; T358-M360 PolarHBondContact O-N 3.45Å; T358-M360 VanDerWaalsContact OG1-CB 3.29Å; T358-M360 WeakPolarHBondContact OG1-CB 3.47Å; T358-M360 WeakPolarHBondContact OG1-CG 3.28Å; T358-M360 PolarHBondContact OG1-N 2.88Å; M360-V362 PolarHBondContact O-N 2.95Å
361	L	43.8	Very low	58.6	Low	71 Å²	71	67.3 Å²	67.3	37%	0.372	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-65.2	118.5	161.8	-80.2	159.4	0	0	0	108.5	K353	K353-L361 HydrophobicContact CB-CD2 4.01Å
362	V	52.6	Low	58.2	Low	73 Å²	73	67.6 Å²	67.6	44%	0.442	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-67	132.7	172.2	-179.6	0	0	0	0	109	A354 M360 V364	A354-V362 HydrophobicContact CB-CG2 4.2Å; M360-V362 PolarHBondContact O-N 2.95Å; V362-V364 VanDerWaalsContact C-N 3.3Å; V362-V364 WeakPolarHBondContact O-CG2 3.21Å; V362-V364 PolarHBondContact O-N 3.43Å
363	D	59.3	Low	58.1	Low	80 Å²	80	65 Å²	65	43%	0.428	33%	0.332	S	S	.	.			trans	-65.6	86.8	175.3	-80	-47.6	0	0	0	110.7	G365 H403 R404	D363-G365 VanDerWaalsContact C-N 3.31Å; D363-G365 PolarHBondContact O-N 3.46Å; D363-H403 VanDerWaalsContact OD1-CA 3.31Å; D363-H403 WeakPolarHBondContact OD1-CA 3.28Å; D363-H403 IonicContact OD1-CD2 2.63Å; D363-H403 IonicContact OD1-CG 3.96Å; D363-R404 PolarHBondContact OD1-N 2.86Å
364	V	60.3	Low	58.3	Low	10 Å²	10	65 Å²	65	6%	0.061	33%	0.332	C	S	.	.			trans	-66.6	-35.4	-177	-170.3	0	0	0	0	111.1	K329 M348 V351 V362 L402	K329-V364 HydrophobicContact CD-CG1 4.43Å; K329-V364 WeakPolarHBondContact CE-O 3.48Å; K329-V364 HydrophobicContact CG-CG1 4.3Å; M348-V364 HydrophobicContact SD-CG1 3.58Å; M348-V364 VanDerWaalsContact SD-CG1 3.58Å; V351-V364 HydrophobicContact CB-CG1 3.96Å; V351-V364 HydrophobicContact CG1-CG1 3.59Å; V351-V364 HydrophobicContact CG2-CG1 4.21Å; V362-V364 VanDerWaalsContact C-N 3.3Å; V362-V364 WeakPolarHBondContact O-CG2 3.21Å; V362-V364 PolarHBondContact O-N 3.43Å; V364-L402 HydrophobicContact CB-CD2 4.38Å; V364-L402 PolarHBondContact N-O 2.78Å
365	G	66.8	Low	59.1	Low	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	-95.5	-8	-167.6	0	0	0	0	0	117.4	D363 R367 L368 L369 L402	D363-G365 VanDerWaalsContact C-N 3.31Å; D363-G365 PolarHBondContact O-N 3.46Å; G365-R367 VanDerWaalsContact C-N 3.29Å; G365-R367 PolarHBondContact O-N 3.49Å; G365-L368 CarbonylContact O-C 3.53Å; G365-L368 WeakPolarHBondContact O-CA 3.42Å; G365-L368 WeakPolarHBondContact O-CB 3.35Å; G365-L368 PolarHBondContact O-N 3.36Å; G365-L369 PolarHBondContact O-N 3.46Å; G365-L402 PolarHBondContact N-O 3.14Å
366	D	69.1	Low	59.8	Low	34 Å²	34	58.1 Å²	58.1	18%	0.182	29%	0.292	C	S	.	.	H	α-helix	trans	-54.2	-43.2	-175.5	169.5	74	0	0	0	112.9	L368 L369 R370 H403	D366-L368 PolarHBondContact O-N 3.04Å; D366-L369 PolarHBondContact O-N 2.81Å; D366-R370 WeakPolarHBondContact O-CG 3.47Å; D366-R370 PolarHBondContact O-N 3.05Å; D366-R370 IonicContact OD1-NE 3.2Å; D366-R370 IonicContact OD2-CZ 2.82Å; D366-R370 IonicContact OD2-NE 2.77Å; D366-R370 PolarHBondContact OD2-NE 3.1Å; D366-R370 IonicContact OD2-NH2 2.83Å; D366-R370 PolarHBondContact OD2-NH2 3.16Å; D366-H403 IonicContact OD1-NE2 2.81Å
367	R	73	Confident	60.6	Low	31 Å²	31	57.7 Å²	57.7	12%	0.117	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-40.3	177.4	-171.6	179.1	-179.3	176.9	5.2	112.2	Y49 E84 I333 G365 H371	Y49-R367 VanDerWaalsContact CD1-NH2 3.34Å; Y49-R367 PolarHBondContact OH-NH1 2.69Å; E84-R367 IonicContact OE1-CZ 3.85Å; E84-R367 IonicContact OE1-NE 3.83Å; E84-R367 PolarHBondContact OE1-NE 3Å; E84-R367 IonicContact OE1-NH2 3.17Å; E84-R367 PolarHBondContact OE1-NH2 3.42Å; I333-R367 HydrophobicContact CD1-CB 4.33Å; I333-R367 HydrophobicContact CD1-CG 3.7Å; G365-R367 VanDerWaalsContact C-N 3.29Å; G365-R367 PolarHBondContact O-N 3.49Å; R367-H371 WeakPolarHBondContact O-CB 3.49Å; R367-H371 PolarHBondContact O-N 3.47Å; R367-H371 VanDerWaalsContact O-N 3.1Å
368	L	74.7	Confident	61.4	Low	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-44.4	176.1	175.4	65.2	0	0	0	110.6	I333 A336 S344 M348 G365 D366 H371 M372 M397	I333-L368 HydrophobicContact CG1-CD1 4.34Å; A336-L368 HydrophobicContact CB-CD1 3.66Å; S344-L368 WeakPolarHBondContact OG-CD1 3.47Å; M348-L368 HydrophobicContact CB-CD2 4.17Å; M348-L368 HydrophobicContact CE-CB 3.69Å; M348-L368 HydrophobicContact CE-CD2 3.67Å; M348-L368 HydrophobicContact CE-CG 4.23Å; M348-L368 HydrophobicContact CG-CD2 4.14Å; G365-L368 CarbonylContact O-C 3.53Å; G365-L368 WeakPolarHBondContact O-CA 3.42Å; G365-L368 WeakPolarHBondContact O-CB 3.35Å; G365-L368 PolarHBondContact O-N 3.36Å; D366-L368 PolarHBondContact O-N 3.04Å; L368-H371 PolarHBondContact O-N 3.47Å; L368-M372 HydrophobicContact CD1-CG 3.93Å; L368-M372 HydrophobicContact CD1-SD 3.79Å; L368-M372 HydrophobicContact CD2-SD 4.14Å; L368-M372 HydrophobicContact CG-CG 4.22Å; L368-M372 HydrophobicContact CG-SD 3.65Å; L368-M372 WeakPolarHBondContact O-CB 3.4Å; L368-M372 VanDerWaalsContact O-CG 3.25Å; L368-M372 WeakPolarHBondContact O-CG 3.41Å; L368-M372 PolarHBondContact O-N 2.91Å; L368-M397 HydrophobicContact CB-CE 4.47Å; L368-M397 HydrophobicContact CD2-CE 3.65Å; L368-M397 HydrophobicContact CG-CE 3.82Å
369	L	71.2	Confident	61.7	Low	10 Å²	10	54.6 Å²	54.6	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-47.9	178	-176.5	64.7	0	0	0	111.8	G365 D366 H371 M372 V373 M397 A406	G365-L369 PolarHBondContact O-N 3.46Å; D366-L369 PolarHBondContact O-N 2.81Å; L369-H371 VanDerWaalsContact C-N 3.29Å; L369-H371 PolarHBondContact O-N 3.26Å; L369-M372 PolarHBondContact O-N 3.19Å; L369-V373 WeakPolarHBondContact O-CG2 3.45Å; L369-V373 PolarHBondContact O-N 3.37Å; L369-M397 HydrophobicContact CB-CE 4.48Å; L369-M397 HydrophobicContact CB-SD 4.06Å; L369-M397 HydrophobicContact CD1-SD 4.37Å; L369-A406 HydrophobicContact CD2-CB 3.87Å
370	R	71.1	Confident	62.2	Low	132 Å²	132	46.5 Å²	46.5	50%	0.498	25%	0.249	S	C	.	.	H	α-helix	trans	-56.6	-44	174.9	-76.5	-170.8	-82.3	144.2	-9.9	111.8	D366 K374	D366-R370 WeakPolarHBondContact O-CG 3.47Å; D366-R370 PolarHBondContact O-N 3.05Å; D366-R370 IonicContact OD1-NE 3.2Å; D366-R370 IonicContact OD2-CZ 2.82Å; D366-R370 IonicContact OD2-NE 2.77Å; D366-R370 PolarHBondContact OD2-NE 3.1Å; D366-R370 IonicContact OD2-NH2 2.83Å; D366-R370 PolarHBondContact OD2-NH2 3.16Å; R370-K374 WeakPolarHBondContact O-CB 3.39Å; R370-K374 PolarHBondContact O-N 3.17Å
371	H	73	Confident	62.2	Low	8 Å²	8	49.3 Å²	49.3	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-68.2	-42.2	178.4	-171.3	48.7	0	0	0	112.9	E84 I333 S337 R367 L368 L369 V373 K374 I375	E84-H371 VanDerWaalsContact CA-CE1 3.44Å; E84-H371 WeakPolarHBondContact CA-CE1 3.46Å; E84-H371 PolarHBondContact O-CE1 3.48Å; I333-H371 PolarHBondContact O-NE2 3.33Å; I333-H371 VanDerWaalsContact O-NE2 3.12Å; S337-H371 WeakPolarHBondContact CA-NE2 3.5Å; S337-H371 WeakPolarHBondContact CB-NE2 3.36Å; S337-H371 PolarHBondContact N-NE2 3.23Å; S337-H371 PolarHBondContact OG-CE1 2.95Å; S337-H371 PolarHBondContact OG-NE2 3.35Å; R367-H371 WeakPolarHBondContact O-CB 3.49Å; R367-H371 PolarHBondContact O-N 3.47Å; R367-H371 VanDerWaalsContact O-N 3.1Å; L368-H371 PolarHBondContact O-N 3.47Å; L369-H371 VanDerWaalsContact C-N 3.29Å; L369-H371 PolarHBondContact O-N 3.26Å; H371-V373 PolarHBondContact O-N 3.14Å; H371-K374 WeakPolarHBondContact O-CB 3.26Å; H371-K374 PolarHBondContact O-N 2.68Å; H371-I375 VanDerWaalsContact NE2-CD1 3.29Å; H371-I375 WeakPolarHBondContact NE2-CD1 3.38Å; H371-I375 WeakPolarHBondContact O-CB 3.35Å; H371-I375 WeakPolarHBondContact O-CG1 3.47Å; H371-I375 PolarHBondContact O-N 3.01Å
372	M	70	Confident	62.2	Low	11 Å²	11	57.2 Å²	57.2	5%	0.054	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-38.4	176.8	-72.6	177.3	68.3	0	0	112.4	A336 F341 L368 L369 I375 A376 F393 M397	A336-M372 HydrophobicContact CB-CG 4.01Å; F341-M372 HydrophobicContact CB-CE 3.85Å; F341-M372 HydrophobicContact CD1-CE 3.74Å; F341-M372 HydrophobicContact CD1-CG 4.08Å; F341-M372 HydrophobicContact CD1-SD 4.47Å; F341-M372 HydrophobicContact CE1-CE 4.41Å; F341-M372 HydrophobicContact CE1-CG 4.17Å; F341-M372 HydrophobicContact CG-CE 3.83Å; L368-M372 HydrophobicContact CD1-CG 3.93Å; L368-M372 HydrophobicContact CD1-SD 3.79Å; L368-M372 HydrophobicContact CD2-SD 4.14Å; L368-M372 HydrophobicContact CG-CG 4.22Å; L368-M372 HydrophobicContact CG-SD 3.65Å; L368-M372 WeakPolarHBondContact O-CB 3.4Å; L368-M372 VanDerWaalsContact O-CG 3.25Å; L368-M372 WeakPolarHBondContact O-CG 3.41Å; L368-M372 PolarHBondContact O-N 2.91Å; L369-M372 PolarHBondContact O-N 3.19Å; M372-I375 PolarHBondContact O-N 2.91Å; M372-A376 VanDerWaalsContact O-CB 3.31Å; M372-A376 WeakPolarHBondContact O-CB 3.45Å; M372-A376 PolarHBondContact O-N 3.41Å; M372-F393 HydrophobicContact CE-CB 3.83Å; M372-F393 HydrophobicContact CE-CD1 3.78Å; M372-F393 HydrophobicContact CE-CD2 3.23Å; M372-F393 HydrophobicContact CE-CE1 4.17Å; M372-F393 HydrophobicContact CE-CE2 3.69Å; M372-F393 HydrophobicContact CE-CG 3.31Å; M372-F393 HydrophobicContact CE-CZ 4.15Å; M372-M397 HydrophobicContact SD-CE 3.57Å; M372-M397 VanDerWaalsContact SD-CE 3.57Å
373	V	67.1	Low	61.9	Low	22 Å²	22	60.5 Å²	60.5	13%	0.133	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-45.6	172.7	174.3	0	0	0	0	110.7	L369 H371 I375 A376 V377 I390 L413	L369-V373 WeakPolarHBondContact O-CG2 3.45Å; L369-V373 PolarHBondContact O-N 3.37Å; H371-V373 PolarHBondContact O-N 3.14Å; V373-I375 VanDerWaalsContact C-N 3.27Å; V373-I375 PolarHBondContact O-N 3.03Å; V373-A376 PolarHBondContact O-N 2.84Å; V373-V377 HydrophobicContact CG1-CG2 4.23Å; V373-V377 WeakPolarHBondContact O-CB 3.41Å; V373-V377 VanDerWaalsContact O-CG2 3.26Å; V373-V377 WeakPolarHBondContact O-CG2 3.18Å; V373-V377 PolarHBondContact O-N 2.85Å; V373-I390 HydrophobicContact CG2-CG2 3.97Å; V373-L413 HydrophobicContact CG1-CD1 4.45Å; V373-L413 HydrophobicContact CG1-CD2 3.91Å
374	K	68.1	Low	61	Low	100 Å²	100	62 Å²	62	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-55.1	-41.6	174.6	-174.3	-177.9	-179.5	178.6	0	112	E51 R370 H371 S378	E51-K374 IonicContact OE1-NZ 2.91Å; R370-K374 WeakPolarHBondContact O-CB 3.39Å; R370-K374 PolarHBondContact O-N 3.17Å; H371-K374 WeakPolarHBondContact O-CB 3.26Å; H371-K374 PolarHBondContact O-N 2.68Å; K374-S378 WeakPolarHBondContact O-CB 3.5Å; K374-S378 PolarHBondContact O-N 3.41Å; K374-S378 VanDerWaalsContact O-N 3.09Å; K374-S378 PolarHBondContact O-OG 3Å
375	I	66.5	Low	60.5	Low	8 Å²	8	66.3 Å²	66.3	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-72.8	-46.9	177.3	-71.3	-179.5	0	0	0	112.5	A336 S337 F341 H371 M372 V373 V377 S378 Q379	A336-I375 WeakPolarHBondContact O-CD1 3.35Å; S337-I375 VanDerWaalsContact CA-CD1 3.45Å; F341-I375 HydrophobicContact CE1-CG2 4.05Å; F341-I375 HydrophobicContact CZ-CG2 3.82Å; H371-I375 VanDerWaalsContact NE2-CD1 3.29Å; H371-I375 WeakPolarHBondContact NE2-CD1 3.38Å; H371-I375 WeakPolarHBondContact O-CB 3.35Å; H371-I375 WeakPolarHBondContact O-CG1 3.47Å; H371-I375 PolarHBondContact O-N 3.01Å; M372-I375 PolarHBondContact O-N 2.91Å; V373-I375 VanDerWaalsContact C-N 3.27Å; V373-I375 PolarHBondContact O-N 3.03Å; I375-V377 VanDerWaalsContact C-N 3.26Å; I375-V377 PolarHBondContact O-N 3.25Å; I375-S378 WeakPolarHBondContact CA-OG 3.26Å; I375-S378 PolarHBondContact O-N 3.49Å; I375-S378 PolarHBondContact O-OG 2.91Å; I375-Q379 VanDerWaalsContact CG2-CD 3.43Å; I375-Q379 HydrophobicContact CG2-CG 3.91Å; I375-Q379 VanDerWaalsContact O-CB 3.29Å; I375-Q379 WeakPolarHBondContact O-CB 3.4Å; I375-Q379 WeakPolarHBondContact O-CG 3.19Å; I375-Q379 PolarHBondContact O-N 2.98Å
376	A	61.4	Low	59.8	Low	24 Å²	24	68.1 Å²	68.1	20%	0.198	34%	0.335	C	S	.	.	H	α-helix	trans	-63.6	-34.7	179.9	0	0	0	0	0	112	M372 V373 A380 I390	M372-A376 VanDerWaalsContact O-CB 3.31Å; M372-A376 WeakPolarHBondContact O-CB 3.45Å; M372-A376 PolarHBondContact O-N 3.41Å; V373-A376 PolarHBondContact O-N 2.84Å; A376-A380 PolarHBondContact O-N 3.41Å; A376-I390 HydrophobicContact CB-CD1 3.47Å; A376-I390 VanDerWaalsContact CB-CD1 3.47Å; A376-I390 HydrophobicContact CB-CG1 3.81Å
377	V	60	Low	58.9	Low	61 Å²	61	69.9 Å²	69.9	37%	0.37	35%	0.347	S	S	.	.	H	α-helix	trans	-70.6	-39.5	173.7	172.6	0	0	0	0	112	V373 I375	V373-V377 HydrophobicContact CG1-CG2 4.23Å; V373-V377 WeakPolarHBondContact O-CB 3.41Å; V373-V377 VanDerWaalsContact O-CG2 3.26Å; V373-V377 WeakPolarHBondContact O-CG2 3.18Å; V373-V377 PolarHBondContact O-N 2.85Å; I375-V377 VanDerWaalsContact C-N 3.26Å; I375-V377 PolarHBondContact O-N 3.25Å
378	S	59.6	Low	58	Low	79 Å²	79	71 Å²	71	55%	0.552	35%	0.354	S	S	*	.	H	α-helix	trans	-81.9	-31.8	-178.9	53.5	0	0	0	0	114.4	K374 I375	K374-S378 WeakPolarHBondContact O-CB 3.5Å; K374-S378 PolarHBondContact O-N 3.41Å; K374-S378 VanDerWaalsContact O-N 3.09Å; K374-S378 PolarHBondContact O-OG 3Å; I375-S378 WeakPolarHBondContact CA-OG 3.26Å; I375-S378 PolarHBondContact O-N 3.49Å; I375-S378 PolarHBondContact O-OG 2.91Å
379	Q	54.3	Low	57.3	Low	73 Å²	73	72.7 Å²	72.7	34%	0.341	36%	0.364	S	S	.	.	H	α-helix	trans	-83.2	-8.6	178.5	-67.8	-171.8	-6.8	0	0	113.8	I375 Y381 R382 Q383	I375-Q379 VanDerWaalsContact CG2-CD 3.43Å; I375-Q379 HydrophobicContact CG2-CG 3.91Å; I375-Q379 VanDerWaalsContact O-CB 3.29Å; I375-Q379 WeakPolarHBondContact O-CB 3.4Å; I375-Q379 WeakPolarHBondContact O-CG 3.19Å; I375-Q379 PolarHBondContact O-N 2.98Å; Q379-Y381 PolarHBondContact O-N 2.93Å; Q379-R382 PolarHBondContact O-N 3.33Å; Q379-Q383 PolarHBondContact O-N 2.81Å
380	A	47	Very low	56.7	Low	55 Å²	55	74.2 Å²	74.2	46%	0.455	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-21	179.9	0	0	0	0	0	114.7	A376	A376-A380 PolarHBondContact O-N 3.41Å
381	Y	37.5	Very low	56.2	Low	152 Å²	152	69.4 Å²	69.4	60%	0.596	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.6	176.6	-81.5	-89.7	0	0	0	115.7	Q379 R425	Q379-Y381 PolarHBondContact O-N 2.93Å; Y381-R425 PolarHBondContact OH-NH2 3.3Å
382	R	44.2	Very low	55.8	Low	237 Å²	237	70.2 Å²	70.2	89%	0.894	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-39.5	-176.4	-76.5	-172.7	175.8	-177.7	-1.2	114.2	Q379	Q379-R382 PolarHBondContact O-N 3.33Å
383	Q	45.7	Very low	55.5	Low	143 Å²	143	70 Å²	70	67%	0.668	37%	0.366	S	S	*	.			trans	-147.3	127.5	163.4	-71.7	-169.9	-11.6	0	0	107.9	Q379 K385	Q379-Q383 PolarHBondContact O-N 2.81Å; Q383-K385 VanDerWaalsContact C-N 3.27Å; Q383-K385 PolarHBondContact O-N 3.37Å
384	P	41.1	Very low	55.4	Low	111 Å²	111	69.8 Å²	69.8	72%	0.721	37%	0.366	S	S	*	.			trans	-74.2	84.3	175.6	31.3	-33.7	0	0	0	109	P386	P384-P386 WeakPolarHBondContact O-CD 3.26Å
385	K	48.7	Very low	55.3	Low	100 Å²	100	69.3 Å²	69.3	44%	0.435	36%	0.361	S	S	.	.			trans	-61.7	118	158.6	-79.7	-169.6	177.2	-171.6	0	106.1	G339 F341 Q383	G339-K385 PolarHBondContact O-NZ 3.15Å; F341-K385 HydrophobicContact CD2-CD 4.13Å; F341-K385 HydrophobicContact CE2-CD 3.71Å; Q383-K385 VanDerWaalsContact C-N 3.27Å; Q383-K385 PolarHBondContact O-N 3.37Å
386	P	52.5	Low	55.4	Low	39 Å²	39	71.7 Å²	71.7	25%	0.253	37%	0.369	S	S	.	.			trans	-64.6	152.2	-165.8	18.2	-25.4	0	0	0	110.3	P384 E388 V389 S1084	P384-P386 WeakPolarHBondContact O-CD 3.26Å; P386-E388 HydrophobicContact CB-CB 4.35Å; P386-E388 PolarHBondContact O-N 3.37Å; P386-E388 VanDerWaalsContact O-N 3.09Å; P386-V389 HydrophobicContact CG-CG2 4Å; P386-V389 VanDerWaalsContact O-CB 3.3Å; P386-V389 WeakPolarHBondContact O-CB 3.3Å; P386-V389 WeakPolarHBondContact O-CG2 3.46Å; P386-V389 PolarHBondContact O-N 2.81Å; P386-S1084 WeakPolarHBondContact CB-OG 3.38Å; P386-S1084 WeakPolarHBondContact CG-OG 3.45Å
387	V	50.8	Low	55.8	Low	70 Å²	70	70.6 Å²	70.6	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-22.8	-177.2	-168.5	0	0	0	0	111.4	V389 I390 G391 P431	V387-V389 PolarHBondContact O-N 3.1Å; V387-I390 HydrophobicContact CG1-CD1 4.41Å; V387-I390 PolarHBondContact O-N 3.08Å; V387-G391 PolarHBondContact O-N 2.93Å; V387-G391 VanDerWaalsContact O-N 3.07Å; V387-P431 HydrophobicContact CB-CG 4.12Å; V387-P431 HydrophobicContact CG1-CB 4.14Å; V387-P431 HydrophobicContact CG1-CG 3.41Å; V387-P431 VanDerWaalsContact CG1-CG 3.41Å
388	E	53.9	Low	56.1	Low	56 Å²	56	68.8 Å²	68.8	26%	0.262	35%	0.348	S	S	.	.	H	α-helix	trans	-47.9	-35.9	164.1	-68.8	132.8	-101.1	0	0	113.7	P386 I390 G391 D392 S1084 R1088	P386-E388 HydrophobicContact CB-CB 4.35Å; P386-E388 PolarHBondContact O-N 3.37Å; P386-E388 VanDerWaalsContact O-N 3.09Å; E388-I390 PolarHBondContact O-N 3.3Å; E388-G391 PolarHBondContact O-N 2.8Å; E388-D392 VanDerWaalsContact O-CB 3.29Å; E388-D392 WeakPolarHBondContact O-CB 3.08Å; E388-D392 PolarHBondContact O-N 2.92Å; E388-S1084 WeakPolarHBondContact OE2-CB 3.5Å; E388-S1084 PolarHBondContact OE2-OG 3.38Å; E388-R1088 IonicContact OE1-CZ 2.68Å; E388-R1088 IonicContact OE1-NH2 2.63Å; E388-R1088 PolarHBondContact OE1-NH2 3.23Å; E388-R1088 IonicContact OE2-CZ 3.24Å; E388-R1088 IonicContact OE2-NE 3.17Å; E388-R1088 PolarHBondContact OE2-NE 2.81Å; E388-R1088 IonicContact OE2-NH2 2.66Å; E388-R1088 PolarHBondContact OE2-NH2 3.37Å
389	V	58.9	Low	56.5	Low	36 Å²	36	67.7 Å²	67.7	22%	0.218	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-41.1	177	178.4	0	0	0	0	110.9	F341 P386 V387 D392 F393	F341-V389 HydrophobicContact CD2-CG1 4.21Å; P386-V389 HydrophobicContact CG-CG2 4Å; P386-V389 VanDerWaalsContact O-CB 3.3Å; P386-V389 WeakPolarHBondContact O-CB 3.3Å; P386-V389 WeakPolarHBondContact O-CG2 3.46Å; P386-V389 PolarHBondContact O-N 2.81Å; V387-V389 PolarHBondContact O-N 3.1Å; V389-D392 PolarHBondContact O-N 3.44Å; V389-F393 HydrophobicContact CG1-CD2 3.65Å; V389-F393 HydrophobicContact CG1-CE2 3.54Å; V389-F393 WeakPolarHBondContact O-CD2 3.34Å; V389-F393 PolarHBondContact O-N 3.02Å
390	I	60.3	Low	57.1	Low	41 Å²	41	66.5 Å²	66.5	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-42.8	175.2	-50.4	178.5	0	0	0	109.8	V373 A376 V387 E388 F393 C394	V373-I390 HydrophobicContact CG2-CG2 3.97Å; A376-I390 HydrophobicContact CB-CD1 3.47Å; A376-I390 VanDerWaalsContact CB-CD1 3.47Å; A376-I390 HydrophobicContact CB-CG1 3.81Å; V387-I390 HydrophobicContact CG1-CD1 4.41Å; V387-I390 PolarHBondContact O-N 3.08Å; E388-I390 PolarHBondContact O-N 3.3Å; I390-F393 PolarHBondContact O-N 2.74Å; I390-C394 WeakPolarHBondContact O-CB 3.28Å; I390-C394 PolarHBondContact O-N 3.29Å; I390-C394 PolarHBondContact O-SG 3.47Å
391	G	60.5	Low	57.9	Low	31 Å²	31	64.9 Å²	64.9	32%	0.32	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.8	0	0	0	0	0	112.7	V387 E388 C394 R395	V387-G391 PolarHBondContact O-N 2.93Å; V387-G391 VanDerWaalsContact O-N 3.07Å; E388-G391 PolarHBondContact O-N 2.8Å; G391-C394 PolarHBondContact O-N 2.91Å; G391-R395 WeakPolarHBondContact O-CG 3.29Å; G391-R395 PolarHBondContact O-N 2.77Å
392	D	62.8	Low	59.1	Low	26 Å²	26	57.8 Å²	57.8	14%	0.139	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-42.2	175.5	-75.1	-5.4	0	0	0	111.5	E388 V389 R395 R396	E388-D392 VanDerWaalsContact O-CB 3.29Å; E388-D392 WeakPolarHBondContact O-CB 3.08Å; E388-D392 PolarHBondContact O-N 2.92Å; V389-D392 PolarHBondContact O-N 3.44Å; D392-R395 PolarHBondContact O-N 3.08Å; D392-R395 IonicContact OD1-CZ 2.64Å; D392-R395 IonicContact OD1-NE 2.77Å; D392-R395 IonicContact OD1-NH2 3.75Å; D392-R395 PolarHBondContact OD1-NH2 2.81Å; D392-R396 WeakPolarHBondContact O-CB 3.41Å; D392-R396 WeakPolarHBondContact O-CG 3.42Å; D392-R396 PolarHBondContact O-N 2.91Å
393	F	65.6	Low	59.9	Low	7 Å²	7	46.7 Å²	46.7	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-36.4	174.7	-81	-63	0	0	0	113.4	F341 E342 Y345 M372 V389 I390 R396 M397	F341-F393 HydrophobicContact CB-CD2 4.32Å; F341-F393 HydrophobicContact CB-CE1 4.3Å; F341-F393 HydrophobicContact CB-CE2 3.36Å; F341-F393 HydrophobicContact CB-CZ 3.36Å; F341-F393 HydrophobicContact CD2-CE2 4.15Å; F341-F393 HydrophobicContact CG-CE2 4.05Å; F341-F393 HydrophobicContact CG-CZ 4.49Å; E342-F393 HydrophobicContact CG-CZ 4.43Å; Y345-F393 AromaticContact CD2-CD1 3.93Å; Y345-F393 HydrophobicContact CD2-CD1 3.93Å; Y345-F393 HydrophobicContact CD2-CE1 4.01Å; Y345-F393 HydrophobicContact CG-CE1 4.13Å; M372-F393 HydrophobicContact CE-CB 3.83Å; M372-F393 HydrophobicContact CE-CD1 3.78Å; M372-F393 HydrophobicContact CE-CD2 3.23Å; M372-F393 HydrophobicContact CE-CE1 4.17Å; M372-F393 HydrophobicContact CE-CE2 3.69Å; M372-F393 HydrophobicContact CE-CG 3.31Å; M372-F393 HydrophobicContact CE-CZ 4.15Å; V389-F393 HydrophobicContact CG1-CD2 3.65Å; V389-F393 HydrophobicContact CG1-CE2 3.54Å; V389-F393 WeakPolarHBondContact O-CD2 3.34Å; V389-F393 PolarHBondContact O-N 3.02Å; I390-F393 PolarHBondContact O-N 2.74Å; F393-R396 PolarHBondContact O-N 2.89Å; F393-M397 WeakPolarHBondContact O-CB 3.19Å; F393-M397 VanDerWaalsContact O-CG 3.28Å; F393-M397 WeakPolarHBondContact O-CG 3.19Å; F393-M397 PolarHBondContact O-N 3.3Å
394	C	64.3	Low	60.4	Low	17 Å²	17	47.9 Å²	47.9	12%	0.115	25%	0.25	C	C	.	.	H	α-helix	trans	-59.3	-50.6	171.5	-69.2	0	0	0	0	110.5	I390 G391 M397 E398 A406	I390-C394 WeakPolarHBondContact O-CB 3.28Å; I390-C394 PolarHBondContact O-N 3.29Å; I390-C394 PolarHBondContact O-SG 3.47Å; G391-C394 PolarHBondContact O-N 2.91Å; C394-M397 PolarHBondContact O-N 3.29Å; C394-E398 WeakPolarHBondContact O-CB 3.5Å; C394-E398 WeakPolarHBondContact O-CG 3.38Å; C394-E398 PolarHBondContact O-N 2.88Å; C394-A406 HydrophobicContact CB-CB 3.71Å
395	R	66	Low	61.4	Low	90 Å²	90	49.5 Å²	49.5	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-49.1	176.5	-73.3	-169.9	-71.4	-169	-4.7	111.9	G391 D392 E398 N399	G391-R395 WeakPolarHBondContact O-CG 3.29Å; G391-R395 PolarHBondContact O-N 2.77Å; D392-R395 PolarHBondContact O-N 3.08Å; D392-R395 IonicContact OD1-CZ 2.64Å; D392-R395 IonicContact OD1-NE 2.77Å; D392-R395 IonicContact OD1-NH2 3.75Å; D392-R395 PolarHBondContact OD1-NH2 2.81Å; R395-E398 PolarHBondContact O-N 3.16Å; R395-N399 WeakPolarHBondContact O-CB 3.24Å; R395-N399 PolarHBondContact O-N 3.28Å; R395-N399 PolarHBondContact O-ND2 3.02Å; R395-N399 PolarHBondContact O-OD1 3.13Å
396	R	68.9	Low	61.9	Low	57 Å²	57	44.8 Å²	44.8	22%	0.215	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-44.4	179.1	-72.6	179	-166.1	-178.4	11.8	112.6	E342 Y345 D392 F393 E398 N399 D400	E342-R396 IonicContact OE1-CZ 2.68Å; E342-R396 IonicContact OE1-NH1 3.62Å; E342-R396 PolarHBondContact OE1-NH1 2.77Å; E342-R396 IonicContact OE1-NH2 3.66Å; E342-R396 PolarHBondContact OE1-NH2 2.84Å; E342-R396 IonicContact OE2-NH1 2.84Å; E342-R396 PolarHBondContact OE2-NH1 3.08Å; Y345-R396 HydrophobicContact CE2-CB 3.86Å; Y345-R396 VanDerWaalsContact OH-C 3.32Å; Y345-R396 PolarHBondContact OH-O 2.98Å; D392-R396 WeakPolarHBondContact O-CB 3.41Å; D392-R396 WeakPolarHBondContact O-CG 3.42Å; D392-R396 PolarHBondContact O-N 2.91Å; F393-R396 PolarHBondContact O-N 2.89Å; R396-E398 VanDerWaalsContact C-N 3.33Å; R396-E398 PolarHBondContact O-N 3.27Å; R396-N399 PolarHBondContact O-N 3.1Å; R396-D400 PolarHBondContact O-N 2.63Å
397	M	68.6	Low	62	Low	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-34.8	176.2	-71.7	-171.6	-157.9	0	0	113.2	Y345 L368 L369 M372 F393 C394 L402 H403	Y345-M397 HydrophobicContact CE2-CG 4.1Å; L368-M397 HydrophobicContact CB-CE 4.47Å; L368-M397 HydrophobicContact CD2-CE 3.65Å; L368-M397 HydrophobicContact CG-CE 3.82Å; L369-M397 HydrophobicContact CB-CE 4.48Å; L369-M397 HydrophobicContact CB-SD 4.06Å; L369-M397 HydrophobicContact CD1-SD 4.37Å; M372-M397 HydrophobicContact SD-CE 3.57Å; M372-M397 VanDerWaalsContact SD-CE 3.57Å; F393-M397 WeakPolarHBondContact O-CB 3.19Å; F393-M397 VanDerWaalsContact O-CG 3.28Å; F393-M397 WeakPolarHBondContact O-CG 3.19Å; F393-M397 PolarHBondContact O-N 3.3Å; C394-M397 PolarHBondContact O-N 3.29Å; M397-L402 HydrophobicContact CB-CB 4.27Å; M397-L402 HydrophobicContact CG-CB 4.46Å; M397-L402 WeakPolarHBondContact O-CA 3.32Å; M397-L402 PolarHBondContact O-N 3.28Å; M397-H403 HydrophobicContact CB-CB 4.17Å; M397-H403 PolarHBondContact O-N 3.1Å
398	E	67.6	Low	62.7	Low	23 Å²	23	46 Å²	46	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-45.5	171.8	-75.4	175.1	163.5	0	0	111.2	C394 R395 R396 G401 H403 A406 F407 N1116	C394-E398 WeakPolarHBondContact O-CB 3.5Å; C394-E398 WeakPolarHBondContact O-CG 3.38Å; C394-E398 PolarHBondContact O-N 2.88Å; R395-E398 PolarHBondContact O-N 3.16Å; R396-E398 VanDerWaalsContact C-N 3.33Å; R396-E398 PolarHBondContact O-N 3.27Å; E398-G401 PolarHBondContact O-N 3.05Å; E398-H403 WeakPolarHBondContact CA-O 3.45Å; E398-H403 VanDerWaalsContact CG-O 3.26Å; E398-H403 WeakPolarHBondContact CG-O 3.46Å; E398-A406 HydrophobicContact CG-CB 3.87Å; E398-A406 WeakPolarHBondContact OE1-CA 3.15Å; E398-A406 WeakPolarHBondContact OE1-CB 3.42Å; E398-A406 PolarHBondContact OE1-N 2.94Å; E398-F407 PolarHBondContact OE1-N 3.12Å; E398-N1116 PolarHBondContact OE2-ND2 3.35Å
399	N	67.7	Low	63.1	Low	56 Å²	56	44.2 Å²	44.2	30%	0.299	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-45.8	-179	-67.2	-9	0	0	0	112.9	R395 R396 G401 P1112	R395-N399 WeakPolarHBondContact O-CB 3.24Å; R395-N399 PolarHBondContact O-N 3.28Å; R395-N399 PolarHBondContact O-ND2 3.02Å; R395-N399 PolarHBondContact O-OD1 3.13Å; R396-N399 PolarHBondContact O-N 3.1Å; N399-G401 PolarHBondContact O-N 3.07Å; N399-P1112 HydrophobicContact CB-CB 4.47Å; N399-P1112 HydrophobicContact CB-CG 4.41Å; N399-P1112 WeakPolarHBondContact OD1-CB 3.13Å
400	D	66.1	Low	63.3	Low	49 Å²	49	44.1 Å²	44.1	26%	0.262	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	0.4	-179.7	-78.2	10.7	0	0	0	113	Y345 Q349 K353 R396 L402	Y345-D400 WeakPolarHBondContact OH-CB 3.11Å; Y345-D400 PolarHBondContact OH-OD2 3.19Å; Q349-D400 PolarHBondContact NE2-OD2 2.87Å; K353-D400 WeakPolarHBondContact CE-O 3.36Å; K353-D400 PolarHBondContact NZ-O 3.46Å; R396-D400 PolarHBondContact O-N 2.63Å; D400-L402 VanDerWaalsContact C-N 3.3Å; D400-L402 HydrophobicContact CB-CD1 4.13Å; D400-L402 HydrophobicContact CB-CG 4.07Å; D400-L402 PolarHBondContact O-N 3.09Å
401	G	63.9	Low	63.5	Low	21 Å²	21	44.5 Å²	44.5	22%	0.216	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	28	-178.4	0	0	0	0	0	113.5	E398 N399	E398-G401 PolarHBondContact O-N 3.05Å; N399-G401 PolarHBondContact O-N 3.07Å
402	L	62.8	Low	63.8	Low	2 Å²	2	49.4 Å²	49.4	1%	0.01	24%	0.238	C	C	.	.	S	Bend	trans	-87.1	-28.8	176.8	-64.9	173.2	0	0	0	112.2	Y345 M348 Q349 V364 G365 M397 D400	Y345-L402 HydrophobicContact CE2-CD1 3.93Å; M348-L402 HydrophobicContact CG-CD1 4.01Å; M348-L402 HydrophobicContact CG-CD2 4.12Å; Q349-L402 HydrophobicContact CG-CD1 4.5Å; V364-L402 HydrophobicContact CB-CD2 4.38Å; V364-L402 PolarHBondContact N-O 2.78Å; G365-L402 PolarHBondContact N-O 3.14Å; M397-L402 HydrophobicContact CB-CB 4.27Å; M397-L402 HydrophobicContact CG-CB 4.46Å; M397-L402 WeakPolarHBondContact O-CA 3.32Å; M397-L402 PolarHBondContact O-N 3.28Å; D400-L402 VanDerWaalsContact C-N 3.3Å; D400-L402 HydrophobicContact CB-CD1 4.13Å; D400-L402 HydrophobicContact CB-CG 4.07Å; D400-L402 PolarHBondContact O-N 3.09Å
403	H	62.2	Low	63.9	Low	5 Å²	5	50.1 Å²	50.1	2%	0.023	24%	0.242	C	C	.	.			trans	-152.3	122.1	175	-175.4	-92.3	0	0	0	112	D363 D366 M397 E398 K405 A406 S409	D363-H403 VanDerWaalsContact OD1-CA 3.31Å; D363-H403 WeakPolarHBondContact OD1-CA 3.28Å; D363-H403 IonicContact OD1-CD2 2.63Å; D363-H403 IonicContact OD1-CG 3.96Å; D366-H403 IonicContact OD1-NE2 2.81Å; M397-H403 HydrophobicContact CB-CB 4.17Å; M397-H403 PolarHBondContact O-N 3.1Å; E398-H403 WeakPolarHBondContact CA-O 3.45Å; E398-H403 VanDerWaalsContact CG-O 3.26Å; E398-H403 WeakPolarHBondContact CG-O 3.46Å; H403-K405 PolarHBondContact CE1-O 2.6Å; H403-K405 PolarHBondContact O-N 3.42Å; H403-A406 PolarHBondContact CE1-N 2.83Å; H403-A406 WeakPolarHBondContact ND1-CA 3.24Å; H403-A406 PolarHBondContact ND1-N 2.7Å; H403-A406 VanDerWaalsContact ND1-N 3.16Å; H403-S409 PolarHBondContact CE1-OG 3.11Å
404	R	55.4	Low	64.1	Low	168 Å²	168	50.9 Å²	50.9	63%	0.634	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-9.6	-163.9	-150.2	177.3	-172	-174	3.8	116.2	D363	D363-R404 PolarHBondContact OD1-N 2.86Å
405	K	62.6	Low	64.4	Low	145 Å²	145	57.3 Å²	57.3	63%	0.63	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149	52.4	-175.9	-63.8	-172.3	178.6	178.4	0	113.2	H403 F407 A408 S409	H403-K405 PolarHBondContact CE1-O 2.6Å; H403-K405 PolarHBondContact O-N 3.42Å; K405-F407 PolarHBondContact O-N 2.82Å; K405-A408 HydrophobicContact CB-CB 4.28Å; K405-A408 PolarHBondContact O-N 2.85Å; K405-S409 WeakPolarHBondContact O-CB 3.49Å; K405-S409 PolarHBondContact O-N 3.36Å; K405-S409 PolarHBondContact O-OG 3.15Å
406	A	58.9	Low	64.4	Low	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-42.5	-176.4	0	0	0	0	0	112.6	L369 C394 E398 H403 S409 A410	L369-A406 HydrophobicContact CD2-CB 3.87Å; C394-A406 HydrophobicContact CB-CB 3.71Å; E398-A406 HydrophobicContact CG-CB 3.87Å; E398-A406 WeakPolarHBondContact OE1-CA 3.15Å; E398-A406 WeakPolarHBondContact OE1-CB 3.42Å; E398-A406 PolarHBondContact OE1-N 2.94Å; H403-A406 PolarHBondContact CE1-N 2.83Å; H403-A406 WeakPolarHBondContact ND1-CA 3.24Å; H403-A406 PolarHBondContact ND1-N 2.7Å; H403-A406 VanDerWaalsContact ND1-N 3.16Å; A406-S409 CarbonylContact O-C 3.55Å; A406-S409 PolarHBondContact O-N 2.8Å; A406-A410 WeakPolarHBondContact O-CB 3.19Å; A406-A410 PolarHBondContact O-N 2.67Å
407	F	55.1	Low	64.1	Low	81 Å²	81	56.7 Å²	56.7	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-45.9	177.6	178	-105.9	0	0	0	113.5	E398 K405 S409 A410 L411 L432 M435	E398-F407 PolarHBondContact OE1-N 3.12Å; K405-F407 PolarHBondContact O-N 2.82Å; F407-S409 VanDerWaalsContact C-N 3.31Å; F407-S409 PolarHBondContact O-N 2.9Å; F407-A410 PolarHBondContact O-N 3.08Å; F407-A410 VanDerWaalsContact O-N 3.11Å; F407-L411 HydrophobicContact CD1-CD1 4.24Å; F407-L411 HydrophobicContact CE1-CD1 3.46Å; F407-L411 VanDerWaalsContact CE1-CD1 3.46Å; F407-L411 HydrophobicContact CE1-CG 4.34Å; F407-L411 HydrophobicContact CE2-CD1 4.19Å; F407-L411 HydrophobicContact CE2-CG 4.33Å; F407-L411 HydrophobicContact CZ-CD1 3.44Å; F407-L411 VanDerWaalsContact CZ-CD1 3.44Å; F407-L411 HydrophobicContact CZ-CG 4.07Å; F407-L411 PolarHBondContact O-N 2.82Å; F407-L432 HydrophobicContact CE2-CD2 4.17Å; F407-M435 HydrophobicContact CD2-CE 3.78Å; F407-M435 HydrophobicContact CD2-SD 3.91Å; F407-M435 HydrophobicContact CE2-CE 3.56Å; F407-M435 HydrophobicContact CE2-SD 3.61Å; F407-M435 HydrophobicContact CZ-CE 4.18Å
408	A	64.4	Low	64.1	Low	53 Å²	53	58.3 Å²	58.3	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-67	-34.1	177.2	0	0	0	0	0	111.7	K405 R412	K405-A408 HydrophobicContact CB-CB 4.28Å; K405-A408 PolarHBondContact O-N 2.85Å; A408-R412 WeakPolarHBondContact O-CB 3.42Å; A408-R412 PolarHBondContact O-N 3.44Å
409	S	62.8	Low	64.2	Low	19 Å²	19	63.7 Å²	63.7	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-39	169.4	-79.7	0	0	0	0	112	H403 K405 A406 F407 L413	H403-S409 PolarHBondContact CE1-OG 3.11Å; K405-S409 WeakPolarHBondContact O-CB 3.49Å; K405-S409 PolarHBondContact O-N 3.36Å; K405-S409 PolarHBondContact O-OG 3.15Å; A406-S409 CarbonylContact O-C 3.55Å; A406-S409 PolarHBondContact O-N 2.8Å; F407-S409 VanDerWaalsContact C-N 3.31Å; F407-S409 PolarHBondContact O-N 2.9Å; S409-L413 WeakPolarHBondContact O-CB 3.33Å; S409-L413 PolarHBondContact O-N 3.08Å
410	A	62	Low	63.7	Low	35 Å²	35	65.1 Å²	65.1	29%	0.289	33%	0.334	S	S	.	.	H	α-helix	trans	-68.9	-46.5	177.9	0	0	0	0	0	113	A406 F407 L413 I414	A406-A410 WeakPolarHBondContact O-CB 3.19Å; A406-A410 PolarHBondContact O-N 2.67Å; F407-A410 PolarHBondContact O-N 3.08Å; F407-A410 VanDerWaalsContact O-N 3.11Å; A410-L413 CarbonylContact O-C 3.56Å; A410-L413 WeakPolarHBondContact O-CA 3.36Å; A410-L413 WeakPolarHBondContact O-CB 3.46Å; A410-L413 PolarHBondContact O-N 3.02Å; A410-L413 VanDerWaalsContact O-N 3.09Å; A410-I414 PolarHBondContact O-N 2.8Å
411	L	65.3	Low	63.5	Low	48 Å²	48	66 Å²	66	25%	0.251	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-39.7	173.2	-85.9	177.7	0	0	0	112.3	F407 L413 I414 R415 L432	F407-L411 HydrophobicContact CD1-CD1 4.24Å; F407-L411 HydrophobicContact CE1-CD1 3.46Å; F407-L411 VanDerWaalsContact CE1-CD1 3.46Å; F407-L411 HydrophobicContact CE1-CG 4.34Å; F407-L411 HydrophobicContact CE2-CD1 4.19Å; F407-L411 HydrophobicContact CE2-CG 4.33Å; F407-L411 HydrophobicContact CZ-CD1 3.44Å; F407-L411 VanDerWaalsContact CZ-CD1 3.44Å; F407-L411 HydrophobicContact CZ-CG 4.07Å; F407-L411 PolarHBondContact O-N 2.82Å; L411-L413 PolarHBondContact O-N 3.42Å; L411-I414 PolarHBondContact O-N 2.91Å; L411-R415 WeakPolarHBondContact O-CB 3.33Å; L411-R415 WeakPolarHBondContact O-CG 3.38Å; L411-R415 PolarHBondContact O-N 3.22Å; L411-L432 HydrophobicContact CD2-CD1 3.81Å; L411-L432 HydrophobicContact CD2-CD2 4.01Å
412	R	67.3	Low	63.4	Low	134 Å²	134	67.9 Å²	67.9	51%	0.506	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-37.6	171.4	-177.1	177.3	65.9	162.9	-1.5	110.8	A408 R415 Q416	A408-R412 WeakPolarHBondContact O-CB 3.42Å; A408-R412 PolarHBondContact O-N 3.44Å; R412-R415 PolarHBondContact O-N 2.88Å; R412-Q416 HydrophobicContact CG-CG 4.47Å; R412-Q416 VanDerWaalsContact O-CB 3.3Å; R412-Q416 WeakPolarHBondContact O-CB 3.38Å; R412-Q416 WeakPolarHBondContact O-CG 3.44Å; R412-Q416 PolarHBondContact O-N 3.36Å
413	L	65	Low	63.6	Low	41 Å²	41	70.4 Å²	70.4	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-71.5	-39.6	178.2	-168.9	148.8	0	0	0	112	V373 S409 A410 L411 Q416 M417	V373-L413 HydrophobicContact CG1-CD1 4.45Å; V373-L413 HydrophobicContact CG1-CD2 3.91Å; S409-L413 WeakPolarHBondContact O-CB 3.33Å; S409-L413 PolarHBondContact O-N 3.08Å; A410-L413 CarbonylContact O-C 3.56Å; A410-L413 WeakPolarHBondContact O-CA 3.36Å; A410-L413 WeakPolarHBondContact O-CB 3.46Å; A410-L413 PolarHBondContact O-N 3.02Å; A410-L413 VanDerWaalsContact O-N 3.09Å; L411-L413 PolarHBondContact O-N 3.42Å; L413-Q416 CarbonylContact O-C 3.38Å; L413-Q416 PolarHBondContact O-N 3.32Å; L413-M417 HydrophobicContact CD2-CG 4.11Å; L413-M417 HydrophobicContact CD2-SD 3.58Å; L413-M417 VanDerWaalsContact CD2-SD 3.58Å; L413-M417 WeakPolarHBondContact O-CB 3.35Å; L413-M417 VanDerWaalsContact O-CG 3.27Å; L413-M417 WeakPolarHBondContact O-CG 3.44Å; L413-M417 PolarHBondContact O-N 2.84Å
414	I	68.6	Low	63.9	Low	23 Å²	23	71.5 Å²	71.5	12%	0.118	39%	0.388	C	S	.	.	H	α-helix	trans	-63.9	-41.9	171.9	-67.4	171	0	0	0	111	A410 L411 M417 A418 L424 L432 M453	A410-I414 PolarHBondContact O-N 2.8Å; L411-I414 PolarHBondContact O-N 2.91Å; I414-M417 WeakPolarHBondContact O-CB 3.34Å; I414-M417 PolarHBondContact O-N 3.38Å; I414-A418 PolarHBondContact O-N 3.44Å; I414-L424 HydrophobicContact CG2-CD2 4.33Å; I414-L432 HydrophobicContact CD1-CD1 4.01Å; I414-M453 HydrophobicContact CG2-CE 4.05Å
415	R	71.5	Confident	64.6	Low	153 Å²	153	65.3 Å²	65.3	58%	0.577	37%	0.365	S	S	*	.	H	α-helix	trans	-63.8	-40.2	172.4	-74.5	179.7	170.6	-176.7	-4.6	111.9	L411 R412 A418 V419 M453	L411-R415 WeakPolarHBondContact O-CB 3.33Å; L411-R415 WeakPolarHBondContact O-CG 3.38Å; L411-R415 PolarHBondContact O-N 3.22Å; R412-R415 PolarHBondContact O-N 2.88Å; R415-A418 WeakPolarHBondContact O-CB 3.49Å; R415-A418 PolarHBondContact O-N 3Å; R415-V419 VanDerWaalsContact O-CG2 3.31Å; R415-V419 WeakPolarHBondContact O-CG2 3.49Å; R415-V419 PolarHBondContact O-N 2.96Å; R415-M453 HydrophobicContact CG-CE 4.44Å
416	Q	65.1	Low	65.1	Low	107 Å²	107	58.4 Å²	58.4	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-66.9	-36.7	174.4	-78.4	172.8	-27	0	0	112.2	R412 L413 A418 V419 S420	R412-Q416 HydrophobicContact CG-CG 4.47Å; R412-Q416 VanDerWaalsContact O-CB 3.3Å; R412-Q416 WeakPolarHBondContact O-CB 3.38Å; R412-Q416 WeakPolarHBondContact O-CG 3.44Å; R412-Q416 PolarHBondContact O-N 3.36Å; L413-Q416 CarbonylContact O-C 3.38Å; L413-Q416 PolarHBondContact O-N 3.32Å; Q416-A418 VanDerWaalsContact C-N 3.33Å; Q416-V419 PolarHBondContact O-N 3.2Å; Q416-S420 WeakPolarHBondContact O-CB 3.29Å; Q416-S420 PolarHBondContact O-N 2.83Å; Q416-S420 PolarHBondContact O-OG 3.32Å
417	M	64.2	Low	65.8	Low	26 Å²	26	61 Å²	61	13%	0.128	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-43.6	172.3	-78	172.8	76.3	0	0	110.7	L413 I414 S420 G421 V422 L424 Y428	L413-M417 HydrophobicContact CD2-CG 4.11Å; L413-M417 HydrophobicContact CD2-SD 3.58Å; L413-M417 VanDerWaalsContact CD2-SD 3.58Å; L413-M417 WeakPolarHBondContact O-CB 3.35Å; L413-M417 VanDerWaalsContact O-CG 3.27Å; L413-M417 WeakPolarHBondContact O-CG 3.44Å; L413-M417 PolarHBondContact O-N 2.84Å; I414-M417 WeakPolarHBondContact O-CB 3.34Å; I414-M417 PolarHBondContact O-N 3.38Å; M417-S420 WeakPolarHBondContact CA-OG 3.37Å; M417-S420 CarbonylContact O-C 3.22Å; M417-S420 PolarHBondContact O-N 2.96Å; M417-S420 PolarHBondContact O-OG 3.24Å; M417-G421 PolarHBondContact O-N 3.26Å; M417-V422 HydrophobicContact CB-CB 4.02Å; M417-V422 HydrophobicContact CB-CG2 4.24Å; M417-V422 HydrophobicContact CE-CB 4.38Å; M417-V422 HydrophobicContact CE-CG1 3.71Å; M417-V422 HydrophobicContact CG-CB 4.47Å; M417-V422 HydrophobicContact CG-CG2 4.36Å; M417-V422 WeakPolarHBondContact O-CB 3.47Å; M417-V422 PolarHBondContact O-N 3.11Å; M417-L424 HydrophobicContact CB-CD2 4.41Å; M417-Y428 HydrophobicContact CE-CE2 4.21Å
418	A	67	Low	66.4	Low	36 Å²	36	59.7 Å²	59.7	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-49.8	174.6	0	0	0	0	0	112.3	I414 R415 Q416 S420 G421 L424 M453	I414-A418 PolarHBondContact O-N 3.44Å; R415-A418 WeakPolarHBondContact O-CB 3.49Å; R415-A418 PolarHBondContact O-N 3Å; Q416-A418 VanDerWaalsContact C-N 3.33Å; A418-S420 PolarHBondContact O-N 3.08Å; A418-G421 PolarHBondContact O-N 3.16Å; A418-G421 VanDerWaalsContact O-N 3.11Å; A418-L424 HydrophobicContact CB-CD1 3.73Å; A418-M453 HydrophobicContact CB-CE 3.41Å; A418-M453 VanDerWaalsContact CB-CE 3.41Å
419	V	70.7	Confident	66.9	Low	136 Å²	136	57.1 Å²	57.1	82%	0.824	32%	0.319	S	S	*	.	H	α-helix	trans	-66	-26	179.1	171.7	0	0	0	0	112.2	R415 Q416	R415-V419 VanDerWaalsContact O-CG2 3.31Å; R415-V419 WeakPolarHBondContact O-CG2 3.49Å; R415-V419 PolarHBondContact O-N 2.96Å; Q416-V419 PolarHBondContact O-N 3.2Å
420	S	57.4	Low	67.4	Low	86 Å²	86	58.5 Å²	58.5	60%	0.601	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	11.3	174.5	54.6	0	0	0	0	114.2	Q416 M417 A418 V422	Q416-S420 WeakPolarHBondContact O-CB 3.29Å; Q416-S420 PolarHBondContact O-N 2.83Å; Q416-S420 PolarHBondContact O-OG 3.32Å; M417-S420 WeakPolarHBondContact CA-OG 3.37Å; M417-S420 CarbonylContact O-C 3.22Å; M417-S420 PolarHBondContact O-N 2.96Å; M417-S420 PolarHBondContact O-OG 3.24Å; A418-S420 PolarHBondContact O-N 3.08Å; S420-V422 VanDerWaalsContact C-N 3.33Å; S420-V422 PolarHBondContact O-N 3.42Å
421	G	60.7	Low	67.6	Low	66 Å²	66	58.9 Å²	58.9	68%	0.68	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	14.3	172.4	0	0	0	0	0	115.4	M417 A418 A423	M417-G421 PolarHBondContact O-N 3.26Å; A418-G421 PolarHBondContact O-N 3.16Å; A418-G421 VanDerWaalsContact O-N 3.11Å; G421-A423 PolarHBondContact O-N 2.89Å
422	V	63.1	Low	67.6	Low	62 Å²	62	57.6 Å²	57.6	38%	0.376	31%	0.314	S	S	.	.			trans	-71	124.1	175	-175.5	0	0	0	0	109.3	M417 S420 L424	M417-V422 HydrophobicContact CB-CB 4.02Å; M417-V422 HydrophobicContact CB-CG2 4.24Å; M417-V422 HydrophobicContact CE-CB 4.38Å; M417-V422 HydrophobicContact CE-CG1 3.71Å; M417-V422 HydrophobicContact CG-CB 4.47Å; M417-V422 HydrophobicContact CG-CG2 4.36Å; M417-V422 WeakPolarHBondContact O-CB 3.47Å; M417-V422 PolarHBondContact O-N 3.11Å; S420-V422 VanDerWaalsContact C-N 3.33Å; S420-V422 PolarHBondContact O-N 3.42Å; V422-L424 PolarHBondContact O-N 2.89Å
423	A	66.1	Low	67.8	Low	54 Å²	54	51.3 Å²	51.3	45%	0.446	29%	0.29	S	S	.	.			trans	-60.3	111.9	-178.3	0	0	0	0	0	111.5	G421 R425	G421-A423 PolarHBondContact O-N 2.89Å; A423-R425 PolarHBondContact O-N 2.91Å
424	L	68.1	Low	67.8	Low	28 Å²	28	51.7 Å²	51.7	15%	0.147	30%	0.296	C	S	.	.			trans	-80	119	-176.8	-65	170.9	0	0	0	110.8	I414 M417 A418 V422 Y428 F429 M453 V455	I414-L424 HydrophobicContact CG2-CD2 4.33Å; M417-L424 HydrophobicContact CB-CD2 4.41Å; A418-L424 HydrophobicContact CB-CD1 3.73Å; V422-L424 PolarHBondContact O-N 2.89Å; L424-Y428 HydrophobicContact CD2-CD2 3.98Å; L424-F429 HydrophobicContact CB-CE2 4.18Å; L424-F429 HydrophobicContact CB-CZ 4.49Å; L424-F429 HydrophobicContact CD1-CZ 4.26Å; L424-M453 HydrophobicContact CD1-CB 3.81Å; L424-M453 HydrophobicContact CD1-CE 3.61Å; L424-M453 HydrophobicContact CD1-CG 4.16Å; L424-M453 HydrophobicContact CD1-SD 4Å; L424-V455 HydrophobicContact CB-CG2 3.7Å; L424-V455 HydrophobicContact CD1-CG2 4.33Å
425	R	71	Confident	67.3	Low	38 Å²	38	53.5 Å²	53.5	14%	0.143	30%	0.304	C	S	.	.			trans	-83.7	141.4	171.1	-47.8	-160.2	175.5	-169.6	-3.5	107.9	Y381 A423 Q427 Y428 F429 R1300	Y381-R425 PolarHBondContact OH-NH2 3.3Å; A423-R425 PolarHBondContact O-N 2.91Å; R425-Q427 HydrophobicContact CB-CB 3.67Å; R425-Q427 PolarHBondContact O-N 2.95Å; R425-Y428 HydrophobicContact CB-CD1 4.33Å; R425-Y428 HydrophobicContact CB-CD2 4.17Å; R425-Y428 HydrophobicContact CB-CE1 4.17Å; R425-Y428 HydrophobicContact CB-CE2 4.01Å; R425-Y428 HydrophobicContact CB-CG 4.33Å; R425-Y428 HydrophobicContact CG-CD2 4.36Å; R425-Y428 HydrophobicContact CG-CE1 4.04Å; R425-Y428 HydrophobicContact CG-CE2 3.7Å; R425-Y428 PolarHBondContact O-N 3.21Å; R425-F429 WeakPolarHBondContact O-CD2 3.49Å; R425-F429 WeakPolarHBondContact O-CE2 3.44Å; R425-R1300 WeakPolarHBondContact CD-O 3.24Å; R425-R1300 WeakPolarHBondContact CG-O 3.3Å; R425-R1300 PolarHBondContact NE-O 3.42Å
426	P	72.9	Confident	66.4	Low	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-49.4	-25.6	162.6	-15.3	20.5	0	0	0	112	Y428 F429 W430 M450 V455 P456 P1298 V1299	P426-Y428 PolarHBondContact O-N 2.94Å; P426-Y428 VanDerWaalsContact O-N 3.16Å; P426-F429 WeakPolarHBondContact O-CB 3.2Å; P426-F429 PolarHBondContact O-N 3.23Å; P426-W430 VanDerWaalsContact C-CD1 3.5Å; P426-W430 VanDerWaalsContact C-NE1 3.29Å; P426-W430 PolarHBondContact O-N 3.34Å; P426-W430 PolarHBondContact O-NE1 3.4Å; P426-M450 HydrophobicContact CB-CE 3.87Å; P426-V455 HydrophobicContact CB-CG1 3.77Å; P426-V455 HydrophobicContact CG-CG1 3.52Å; P426-P456 HydrophobicContact CG-CG 4.09Å; P426-P456 WeakPolarHBondContact CG-O 3.4Å; P426-P1298 CarbonylContact C-O 3.53Å; P426-P1298 HydrophobicContact CB-CB 4.25Å; P426-P1298 HydrophobicContact CB-CG 3.81Å; P426-P1298 VanDerWaalsContact CB-O 3.22Å; P426-P1298 WeakPolarHBondContact CB-O 3.42Å; P426-P1298 HydrophobicContact CG-CG 4.42Å; P426-V1299 WeakPolarHBondContact CD-O 3.34Å; P426-V1299 WeakPolarHBondContact CG-O 3.32Å
427	Q	73	Confident	65.6	Low	55 Å²	55	45.9 Å²	45.9	26%	0.257	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-47.4	-32	167.3	-87	160.8	-15.7	0	0	116.4	R425 F429 W430 P1298	R425-Q427 HydrophobicContact CB-CB 3.67Å; R425-Q427 PolarHBondContact O-N 2.95Å; Q427-F429 VanDerWaalsContact C-N 3.29Å; Q427-W430 HydrophobicContact CB-CD2 4.37Å; Q427-W430 HydrophobicContact CB-CZ2 4.18Å; Q427-W430 HydrophobicContact CG-CD2 3.95Å; Q427-W430 HydrophobicContact CG-CE3 4.25Å; Q427-W430 HydrophobicContact CG-CH2 3.45Å; Q427-W430 VanDerWaalsContact CG-CH2 3.45Å; Q427-W430 HydrophobicContact CG-CZ2 3.03Å; Q427-W430 HydrophobicContact CG-CZ3 4.02Å; Q427-W430 VanDerWaalsContact N-NE1 3.18Å; Q427-P1298 WeakPolarHBondContact CG-O 3.18Å; Q427-P1298 PolarHBondContact N-O 3.39Å
428	Y	69.1	Low	64.7	Low	53 Å²	53	45.7 Å²	45.7	21%	0.208	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-82.3	-15.4	-178.9	-52.3	-27.8	0	0	0	112.2	M417 L424 R425 P426	M417-Y428 HydrophobicContact CE-CE2 4.21Å; L424-Y428 HydrophobicContact CD2-CD2 3.98Å; R425-Y428 HydrophobicContact CB-CD1 4.33Å; R425-Y428 HydrophobicContact CB-CD2 4.17Å; R425-Y428 HydrophobicContact CB-CE1 4.17Å; R425-Y428 HydrophobicContact CB-CE2 4.01Å; R425-Y428 HydrophobicContact CB-CG 4.33Å; R425-Y428 HydrophobicContact CG-CD2 4.36Å; R425-Y428 HydrophobicContact CG-CE1 4.04Å; R425-Y428 HydrophobicContact CG-CE2 3.7Å; R425-Y428 PolarHBondContact O-N 3.21Å; P426-Y428 PolarHBondContact O-N 2.94Å; P426-Y428 VanDerWaalsContact O-N 3.16Å
429	F	74.1	Confident	63.9	Low	0 Å²	0	45.8 Å²	45.8	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-13	177.1	-54.9	-99.4	0	0	0	111.7	L424 R425 P426 Q427 L432 I433 T446 L449 M450 M453 V455	L424-F429 HydrophobicContact CB-CE2 4.18Å; L424-F429 HydrophobicContact CB-CZ 4.49Å; L424-F429 HydrophobicContact CD1-CZ 4.26Å; R425-F429 WeakPolarHBondContact O-CD2 3.49Å; R425-F429 WeakPolarHBondContact O-CE2 3.44Å; P426-F429 WeakPolarHBondContact O-CB 3.2Å; P426-F429 PolarHBondContact O-N 3.23Å; Q427-F429 VanDerWaalsContact C-N 3.29Å; F429-L432 HydrophobicContact CD1-CD1 4.27Å; F429-L432 CarbonylContact O-C 3.58Å; F429-L432 WeakPolarHBondContact O-CA 3.27Å; F429-L432 WeakPolarHBondContact O-CB 2.93Å; F429-L432 PolarHBondContact O-N 2.97Å; F429-I433 WeakPolarHBondContact O-CG1 3.49Å; F429-I433 PolarHBondContact O-N 3.43Å; F429-T446 HydrophobicContact CB-CG2 3.88Å; F429-T446 HydrophobicContact CD1-CG2 4.02Å; F429-T446 HydrophobicContact CG-CG2 4.44Å; F429-L449 HydrophobicContact CD1-CD2 4.16Å; F429-L449 HydrophobicContact CE1-CD2 3.81Å; F429-L449 HydrophobicContact CE1-CG 4.13Å; F429-M450 HydrophobicContact CB-CG 3.94Å; F429-M450 HydrophobicContact CB-SD 3.77Å; F429-M450 HydrophobicContact CD1-CG 3.42Å; F429-M450 VanDerWaalsContact CD1-CG 3.42Å; F429-M450 HydrophobicContact CD1-SD 4.38Å; F429-M450 HydrophobicContact CD2-CG 3.95Å; F429-M450 HydrophobicContact CE1-CG 3.84Å; F429-M450 HydrophobicContact CE2-CG 4.36Å; F429-M450 HydrophobicContact CG-CG 3.47Å; F429-M450 VanDerWaalsContact CG-CG 3.47Å; F429-M450 HydrophobicContact CG-SD 4Å; F429-M450 HydrophobicContact CZ-CG 4.3Å; F429-M453 HydrophobicContact CE1-SD 3.63Å; F429-M453 HydrophobicContact CZ-CB 4.41Å; F429-M453 HydrophobicContact CZ-SD 3.62Å; F429-V455 HydrophobicContact CD2-CG1 4.01Å; F429-V455 HydrophobicContact CE2-CB 4.15Å; F429-V455 HydrophobicContact CE2-CG1 3.78Å; F429-V455 HydrophobicContact CE2-CG2 3.66Å; F429-V455 HydrophobicContact CZ-CB 4.41Å; F429-V455 HydrophobicContact CZ-CG1 4.5Å; F429-V455 HydrophobicContact CZ-CG2 3.78Å
430	W	73.5	Confident	63.2	Low	48 Å²	48	43.8 Å²	43.8	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-56.4	-51.9	176.6	-54.7	-6.7	0	0	0	113	P426 Q427 L432 I433 C434 A1296 I1297 P1298	P426-W430 VanDerWaalsContact C-CD1 3.5Å; P426-W430 VanDerWaalsContact C-NE1 3.29Å; P426-W430 PolarHBondContact O-N 3.34Å; P426-W430 PolarHBondContact O-NE1 3.4Å; Q427-W430 HydrophobicContact CB-CD2 4.37Å; Q427-W430 HydrophobicContact CB-CZ2 4.18Å; Q427-W430 HydrophobicContact CG-CD2 3.95Å; Q427-W430 HydrophobicContact CG-CE3 4.25Å; Q427-W430 HydrophobicContact CG-CH2 3.45Å; Q427-W430 VanDerWaalsContact CG-CH2 3.45Å; Q427-W430 HydrophobicContact CG-CZ2 3.03Å; Q427-W430 HydrophobicContact CG-CZ3 4.02Å; Q427-W430 VanDerWaalsContact N-NE1 3.18Å; W430-L432 PolarHBondContact O-N 3.01Å; W430-L432 VanDerWaalsContact O-N 3.07Å; W430-I433 PolarHBondContact O-N 3.32Å; W430-C434 WeakPolarHBondContact O-CB 3.31Å; W430-C434 PolarHBondContact O-N 3.14Å; W430-C434 PolarHBondContact O-SG 3.27Å; W430-C434 VanDerWaalsContact O-SG 3.33Å; W430-A1296 HydrophobicContact CB-CB 3.71Å; W430-A1296 VanDerWaalsContact CB-O 3.26Å; W430-A1296 WeakPolarHBondContact CB-O 3.17Å; W430-A1296 VanDerWaalsContact CD2-O 3.26Å; W430-A1296 HydrophobicContact CG-CB 4.35Å; W430-A1296 WeakPolarHBondContact O-CB 3.27Å; W430-I1297 HydrophobicContact CD2-CB 4.27Å; W430-I1297 HydrophobicContact CD2-CG1 4.08Å; W430-I1297 HydrophobicContact CE3-CB 4.41Å; W430-I1297 HydrophobicContact CE3-CG1 3.76Å; W430-I1297 HydrophobicContact CH2-CB 3.79Å; W430-I1297 HydrophobicContact CH2-CD1 4.02Å; W430-I1297 HydrophobicContact CH2-CG1 3.56Å; W430-I1297 HydrophobicContact CH2-CG2 3.56Å; W430-I1297 VanDerWaalsContact CZ2-CA 3.45Å; W430-I1297 HydrophobicContact CZ2-CB 3.63Å; W430-I1297 HydrophobicContact CZ2-CG1 3.9Å; W430-I1297 HydrophobicContact CZ2-CG2 3.42Å; W430-I1297 VanDerWaalsContact CZ2-CG2 3.42Å; W430-I1297 HydrophobicContact CZ3-CB 4.21Å; W430-I1297 HydrophobicContact CZ3-CD1 4Å; W430-I1297 HydrophobicContact CZ3-CG1 3.52Å; W430-I1297 HydrophobicContact CZ3-CG2 4.42Å; W430-P1298 WeakPolarHBondContact CZ2-O 3.45Å; W430-P1298 PolarHBondContact NE1-O 3.41Å
431	P	64.9	Low	63.4	Low	42 Å²	42	41.4 Å²	41.4	27%	0.273	25%	0.25	S	S	.	.	H	α-helix	trans	-66.6	-17.3	-178.7	-11.1	28.4	0	0	0	111.5	V387 M435	V387-P431 HydrophobicContact CB-CG 4.12Å; V387-P431 HydrophobicContact CG1-CB 4.14Å; V387-P431 HydrophobicContact CG1-CG 3.41Å; V387-P431 VanDerWaalsContact CG1-CG 3.41Å; P431-M435 WeakPolarHBondContact O-CG 3.17Å; P431-M435 PolarHBondContact O-N 3.07Å
432	L	67.2	Low	63.7	Low	21 Å²	21	41.9 Å²	41.9	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-82.6	-33.2	175.4	-51.5	179.6	0	0	0	112.1	F407 L411 I414 F429 W430 T446	F407-L432 HydrophobicContact CE2-CD2 4.17Å; L411-L432 HydrophobicContact CD2-CD1 3.81Å; L411-L432 HydrophobicContact CD2-CD2 4.01Å; I414-L432 HydrophobicContact CD1-CD1 4.01Å; F429-L432 HydrophobicContact CD1-CD1 4.27Å; F429-L432 CarbonylContact O-C 3.58Å; F429-L432 WeakPolarHBondContact O-CA 3.27Å; F429-L432 WeakPolarHBondContact O-CB 2.93Å; F429-L432 PolarHBondContact O-N 2.97Å; W430-L432 PolarHBondContact O-N 3.01Å; W430-L432 VanDerWaalsContact O-N 3.07Å; L432-T446 HydrophobicContact CB-CG2 4.03Å
433	I	71.2	Confident	64.2	Low	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-77.6	-42.7	171.9	-59.9	166.7	0	0	0	110	F429 W430 M435 T443 T446 L447 M450 T461 H469 A1296	F429-I433 WeakPolarHBondContact O-CG1 3.49Å; F429-I433 PolarHBondContact O-N 3.43Å; W430-I433 PolarHBondContact O-N 3.32Å; I433-M435 PolarHBondContact O-N 2.81Å; I433-T443 HydrophobicContact CG2-CG2 4.47Å; I433-T446 HydrophobicContact CD1-CG2 4.25Å; I433-T446 HydrophobicContact CG1-CG2 3.61Å; I433-L447 HydrophobicContact CD1-CD2 4.47Å; I433-M450 HydrophobicContact CD1-SD 4.21Å; I433-T461 HydrophobicContact CD1-CG2 4.21Å; I433-H469 PolarHBondContact O-CD2 2.89Å; I433-A1296 HydrophobicContact CB-CB 3.73Å; I433-A1296 HydrophobicContact CG2-CB 3.97Å
434	C	63.8	Low	64.8	Low	50 Å²	50	37.2 Å²	37.2	34%	0.338	20%	0.201	S	C	.	.	S	Bend	trans	-60.2	-20.8	176.7	-73.3	0	0	0	0	115	W430 E436 E1295 A1296	W430-C434 WeakPolarHBondContact O-CB 3.31Å; W430-C434 PolarHBondContact O-N 3.14Å; W430-C434 PolarHBondContact O-SG 3.27Å; W430-C434 VanDerWaalsContact O-SG 3.33Å; C434-E436 PolarHBondContact O-N 3.07Å; C434-E1295 PolarHBondContact SG-O 3.44Å; C434-A1296 HydrophobicContact CB-CB 4.38Å; C434-A1296 WeakPolarHBondContact SG-CB 3.17Å
435	M	59	Low	65.1	Low	60 Å²	60	41.5 Å²	41.5	30%	0.296	22%	0.218	S	C	.	.			trans	-72.9	104.7	-172	-97.8	178.9	63.9	0	0	109.2	F407 P431 I433 D437 A438	F407-M435 HydrophobicContact CD2-CE 3.78Å; F407-M435 HydrophobicContact CD2-SD 3.91Å; F407-M435 HydrophobicContact CE2-CE 3.56Å; F407-M435 HydrophobicContact CE2-SD 3.61Å; F407-M435 HydrophobicContact CZ-CE 4.18Å; P431-M435 WeakPolarHBondContact O-CG 3.17Å; P431-M435 PolarHBondContact O-N 3.07Å; I433-M435 PolarHBondContact O-N 2.81Å; M435-D437 PolarHBondContact O-N 2.9Å; M435-A438 WeakPolarHBondContact O-CB 3.35Å; M435-A438 PolarHBondContact O-N 3.33Å
436	E	51.4	Low	65.4	Low	96 Å²	96	40.4 Å²	40.4	45%	0.449	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-5	-171.5	-26	149.4	90.8	0	0	113.8	C434 V1120 R1189	C434-E436 PolarHBondContact O-N 3.07Å; E436-V1120 HydrophobicContact CB-CB 3.97Å; E436-V1120 HydrophobicContact CB-CG1 3.58Å; E436-V1120 HydrophobicContact CB-CG2 3.55Å; E436-V1120 HydrophobicContact CG-CB 4.35Å; E436-V1120 HydrophobicContact CG-CG1 4.28Å; E436-V1120 HydrophobicContact CG-CG2 3.99Å; E436-V1120 VanDerWaalsContact OE2-CB 3.29Å; E436-V1120 WeakPolarHBondContact OE2-CB 3.4Å; E436-R1189 IonicContact OE1-NH2 3.54Å
437	D	49.5	Very low	66	Low	5 Å²	5	40.4 Å²	40.4	3%	0.027	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	5.1	172.8	-81.4	1.5	0	0	0	113.4	M435 A439 A1118 S1119 V1120 G1151 N1152	M435-D437 PolarHBondContact O-N 2.9Å; D437-A439 PolarHBondContact O-N 3.48Å; D437-A1118 HydrophobicContact CB-CB 4.44Å; D437-A1118 WeakPolarHBondContact OD2-CA 3.33Å; D437-S1119 PolarHBondContact OD2-N 3.37Å; D437-V1120 HydrophobicContact CB-CG2 3.99Å; D437-V1120 WeakPolarHBondContact OD1-CA 3.12Å; D437-V1120 WeakPolarHBondContact OD1-CB 3.41Å; D437-V1120 VanDerWaalsContact OD1-CG1 3.24Å; D437-V1120 WeakPolarHBondContact OD1-CG1 3.26Å; D437-V1120 WeakPolarHBondContact OD1-CG2 3.26Å; D437-V1120 PolarHBondContact OD2-N 3.17Å; D437-G1151 CarbonylContact O-C 3.53Å; D437-G1151 VanDerWaalsContact O-C 3.31Å; D437-N1152 HydrophobicContact CB-CB 4.03Å; D437-N1152 VanDerWaalsContact OD1-CB 3.29Å; D437-N1152 WeakPolarHBondContact OD1-CB 3.29Å; D437-N1152 PolarHBondContact OD1-ND2 3.31Å; D437-N1152 PolarHBondContact OD1-OD1 2.81Å; D437-N1152 WeakPolarHBondContact OD2-CB 2.83Å; D437-N1152 VanDerWaalsContact OD2-CG 3.27Å; D437-N1152 PolarHBondContact OD2-ND2 3.06Å
438	A	45.8	Very low	66.4	Low	21 Å²	21	41 Å²	41	17%	0.174	22%	0.218	C	C	.	.			trans	-71.7	85	165.7	0	0	0	0	0	110.2	M435 E440 H442 T443	M435-A438 WeakPolarHBondContact O-CB 3.35Å; M435-A438 PolarHBondContact O-N 3.33Å; A438-E440 PolarHBondContact O-N 3.36Å; A438-H442 HydrophobicContact CB-CB 3.52Å; A438-T443 HydrophobicContact CB-CG2 4.23Å
439	A	50.3	Low	66.9	Low	39 Å²	39	39.3 Å²	39.3	32%	0.322	21%	0.213	S	C	.	.			trans	-40.8	145.9	161	0	0	0	0	0	110.5	D437 G441 H442 G1151	D437-A439 PolarHBondContact O-N 3.48Å; A439-G441 CarbonylContact O-C 3.46Å; A439-G441 PolarHBondContact O-N 2.86Å; A439-H442 PolarHBondContact N-ND1 3.36Å; A439-H442 WeakPolarHBondContact O-CA 3.32Å; A439-H442 VanDerWaalsContact O-CB 3.28Å; A439-H442 WeakPolarHBondContact O-CB 3.27Å; A439-H442 PolarHBondContact O-N 3.39Å; A439-G1151 VanDerWaalsContact CB-CA 3.48Å; A439-G1151 WeakPolarHBondContact CB-O 2.83Å; A439-G1151 PolarHBondContact N-O 2.77Å
440	E	54.5	Low	67.5	Low	93 Å²	93	39.4 Å²	39.4	44%	0.435	21%	0.213	S	C	.	.	H	α-helix	trans	-46.2	-33.4	-167.9	-59.7	177.7	-177.6	0	0	115.4	A438 H442 T443 V444 S472	A438-E440 PolarHBondContact O-N 3.36Å; E440-H442 PolarHBondContact O-N 2.88Å; E440-T443 PolarHBondContact O-N 2.92Å; E440-T443 PolarHBondContact O-OG1 3.43Å; E440-V444 WeakPolarHBondContact O-CG2 3.48Å; E440-V444 PolarHBondContact O-N 2.95Å; E440-S472 WeakPolarHBondContact OE1-CB 3.44Å; E440-S472 PolarHBondContact OE1-OG 3.35Å
441	G	62.3	Low	68	Low	37 Å²	37	39.2 Å²	39.2	38%	0.381	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-15.9	172.4	0	0	0	0	0	115.4	A439 K445	A439-G441 CarbonylContact O-C 3.46Å; A439-G441 PolarHBondContact O-N 2.86Å; G441-K445 WeakPolarHBondContact O-CA 3.48Å; G441-K445 WeakPolarHBondContact O-CB 3.45Å; G441-K445 WeakPolarHBondContact O-CD 3.46Å; G441-K445 WeakPolarHBondContact O-CG 3.37Å; G441-K445 PolarHBondContact O-N 2.91Å
442	H	67.4	Low	68.8	Low	75 Å²	75	44.2 Å²	44.2	35%	0.347	24%	0.235	S	C	.	.	H	α-helix	trans	-88.7	-35.8	177.9	-71.8	128.6	0	0	0	112.7	A438 A439 E440 T446	A438-H442 HydrophobicContact CB-CB 3.52Å; A439-H442 PolarHBondContact N-ND1 3.36Å; A439-H442 WeakPolarHBondContact O-CA 3.32Å; A439-H442 VanDerWaalsContact O-CB 3.28Å; A439-H442 WeakPolarHBondContact O-CB 3.27Å; A439-H442 PolarHBondContact O-N 3.39Å; E440-H442 PolarHBondContact O-N 2.88Å; H442-T446 VanDerWaalsContact O-CB 3.27Å; H442-T446 WeakPolarHBondContact O-CB 3.33Å; H442-T446 PolarHBondContact O-N 3.25Å; H442-T446 PolarHBondContact O-OG1 3.21Å
443	T	72.6	Confident	69.3	Low	4 Å²	4	45 Å²	45	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-69	-44.1	170.2	59.3	0	0	0	0	109.6	I433 A438 E440 T446 L447 S470	I433-T443 HydrophobicContact CG2-CG2 4.47Å; A438-T443 HydrophobicContact CB-CG2 4.23Å; E440-T443 PolarHBondContact O-N 2.92Å; E440-T443 PolarHBondContact O-OG1 3.43Å; T443-T446 PolarHBondContact O-N 2.89Å; T443-T446 VanDerWaalsContact O-N 3.1Å; T443-L447 PolarHBondContact O-N 2.91Å; T443-S470 PolarHBondContact OG1-OG 3.02Å; T443-S470 VanDerWaalsContact OG1-OG 3.1Å
444	V	78.1	Confident	69.7	Low	15 Å²	15	52 Å²	52	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-48.5	171	179.1	0	0	0	0	111	E440 T446 L447 E448 M473 L481 V483	E440-V444 WeakPolarHBondContact O-CG2 3.48Å; E440-V444 PolarHBondContact O-N 2.95Å; V444-T446 PolarHBondContact O-N 3.38Å; V444-L447 CarbonylContact O-C 3.54Å; V444-L447 WeakPolarHBondContact O-CA 3.15Å; V444-L447 WeakPolarHBondContact O-CB 3.5Å; V444-L447 PolarHBondContact O-N 2.85Å; V444-E448 HydrophobicContact CG1-CG 4.37Å; V444-E448 WeakPolarHBondContact O-CG 3.45Å; V444-E448 PolarHBondContact O-N 3.4Å; V444-M473 HydrophobicContact CG2-CE 3.58Å; V444-L481 HydrophobicContact CG1-CD1 4.3Å; V444-L481 HydrophobicContact CG2-CD1 4.29Å; V444-V483 HydrophobicContact CG1-CG2 4.25Å
445	K	76.2	Confident	70.6	Confident	118 Å²	118	49.9 Å²	49.9	51%	0.513	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-25.7	173	-81	163.3	-161.3	166.6	0	113.2	G441 E448 L449	G441-K445 WeakPolarHBondContact O-CA 3.48Å; G441-K445 WeakPolarHBondContact O-CB 3.45Å; G441-K445 WeakPolarHBondContact O-CD 3.46Å; G441-K445 WeakPolarHBondContact O-CG 3.37Å; G441-K445 PolarHBondContact O-N 2.91Å; K445-E448 WeakPolarHBondContact CG-OE2 3.49Å; K445-L449 WeakPolarHBondContact O-CA 3.35Å; K445-L449 WeakPolarHBondContact O-CB 3.2Å; K445-L449 PolarHBondContact O-N 3.03Å
446	T	77.2	Confident	71.7	Confident	14 Å²	14	49.1 Å²	49.1	9%	0.086	26%	0.261	C	S	.	.	H	α-helix	trans	-76.1	-36.2	175.1	-59.2	0	0	0	0	110.3	F429 L432 I433 H442 T443 V444 M450	F429-T446 HydrophobicContact CB-CG2 3.88Å; F429-T446 HydrophobicContact CD1-CG2 4.02Å; F429-T446 HydrophobicContact CG-CG2 4.44Å; L432-T446 HydrophobicContact CB-CG2 4.03Å; I433-T446 HydrophobicContact CD1-CG2 4.25Å; I433-T446 HydrophobicContact CG1-CG2 3.61Å; H442-T446 VanDerWaalsContact O-CB 3.27Å; H442-T446 WeakPolarHBondContact O-CB 3.33Å; H442-T446 PolarHBondContact O-N 3.25Å; H442-T446 PolarHBondContact O-OG1 3.21Å; T443-T446 PolarHBondContact O-N 2.89Å; T443-T446 VanDerWaalsContact O-N 3.1Å; V444-T446 PolarHBondContact O-N 3.38Å; T446-M450 WeakPolarHBondContact O-CB 3.42Å; T446-M450 WeakPolarHBondContact O-CG 3.47Å; T446-M450 PolarHBondContact O-N 3.03Å
447	L	83.8	Confident	73.2	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-66.9	-38.1	167.2	-63.1	-169	0	0	0	112.5	I433 T443 V444 M450 L451 I457 T461 M462 F466 V483	I433-L447 HydrophobicContact CD1-CD2 4.47Å; T443-L447 PolarHBondContact O-N 2.91Å; V444-L447 CarbonylContact O-C 3.54Å; V444-L447 WeakPolarHBondContact O-CA 3.15Å; V444-L447 WeakPolarHBondContact O-CB 3.5Å; V444-L447 PolarHBondContact O-N 2.85Å; L447-M450 HydrophobicContact CD2-SD 4.05Å; L447-M450 PolarHBondContact O-N 2.67Å; L447-L451 WeakPolarHBondContact O-CB 3.5Å; L447-L451 VanDerWaalsContact O-CG 3.26Å; L447-L451 WeakPolarHBondContact O-CG 3.48Å; L447-L451 PolarHBondContact O-N 3.21Å; L447-I457 HydrophobicContact CB-CD1 4.06Å; L447-I457 HydrophobicContact CD1-CD1 4.45Å; L447-I457 HydrophobicContact CD2-CD1 3.93Å; L447-I457 HydrophobicContact CD2-CG1 4.15Å; L447-I457 HydrophobicContact CD2-CG2 4.49Å; L447-I457 HydrophobicContact CG-CD1 4.37Å; L447-T461 HydrophobicContact CD2-CG2 4.22Å; L447-M462 HydrophobicContact CD1-SD 4.39Å; L447-F466 HydrophobicContact CD1-CD2 3.5Å; L447-F466 VanDerWaalsContact CD1-CD2 3.5Å; L447-F466 HydrophobicContact CD1-CE2 3.43Å; L447-F466 VanDerWaalsContact CD1-CE2 3.43Å; L447-F466 HydrophobicContact CD1-CG 4.21Å; L447-F466 HydrophobicContact CD1-CZ 4.11Å; L447-F466 HydrophobicContact CG-CD2 4.08Å; L447-F466 HydrophobicContact CG-CE2 4.2Å; L447-V483 HydrophobicContact CB-CG1 3.75Å; L447-V483 HydrophobicContact CB-CG2 4.42Å; L447-V483 HydrophobicContact CD1-CG1 3.79Å; L447-V483 HydrophobicContact CG-CG1 4.45Å
448	E	82.2	Confident	74.8	Confident	66 Å²	66	47 Å²	47	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-63.3	-47.7	172.6	-66.9	173.1	154	0	0	110.5	V444 K445 M450 L451 E452 V483	V444-E448 HydrophobicContact CG1-CG 4.37Å; V444-E448 WeakPolarHBondContact O-CG 3.45Å; V444-E448 PolarHBondContact O-N 3.4Å; K445-E448 WeakPolarHBondContact CG-OE2 3.49Å; E448-M450 VanDerWaalsContact C-N 3.32Å; E448-M450 PolarHBondContact O-N 3.22Å; E448-L451 CarbonylContact O-C 3.5Å; E448-L451 WeakPolarHBondContact O-CA 3.29Å; E448-L451 WeakPolarHBondContact O-CB 3.26Å; E448-L451 PolarHBondContact O-N 3.25Å; E448-E452 WeakPolarHBondContact O-CB 3.46Å; E448-E452 WeakPolarHBondContact O-CG 3.39Å; E448-E452 PolarHBondContact O-N 2.92Å; E448-V483 HydrophobicContact CG-CG2 3.46Å; E448-V483 VanDerWaalsContact CG-CG2 3.46Å
449	L	79.5	Confident	76.4	Confident	19 Å²	19	47.6 Å²	47.6	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-39.5	175.8	-172	81.7	0	0	0	111.2	F429 K445 E452 M453	F429-L449 HydrophobicContact CD1-CD2 4.16Å; F429-L449 HydrophobicContact CE1-CD2 3.81Å; F429-L449 HydrophobicContact CE1-CG 4.13Å; K445-L449 WeakPolarHBondContact O-CA 3.35Å; K445-L449 WeakPolarHBondContact O-CB 3.2Å; K445-L449 PolarHBondContact O-N 3.03Å; L449-E452 PolarHBondContact O-N 3.46Å; L449-M453 HydrophobicContact CD1-SD 4Å; L449-M453 HydrophobicContact CD2-SD 4.06Å; L449-M453 HydrophobicContact CG-CG 4.5Å; L449-M453 HydrophobicContact CG-SD 3.6Å; L449-M453 WeakPolarHBondContact O-CB 3.35Å; L449-M453 WeakPolarHBondContact O-CG 3.21Å; L449-M453 PolarHBondContact O-N 2.89Å
450	M	86.4	Confident	77.7	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-44.9	171.5	-76.1	171	67.8	0	0	111	P426 F429 I433 T446 L447 E448 M453 N454 V455 I457 T461	P426-M450 HydrophobicContact CB-CE 3.87Å; F429-M450 HydrophobicContact CB-CG 3.94Å; F429-M450 HydrophobicContact CB-SD 3.77Å; F429-M450 HydrophobicContact CD1-CG 3.42Å; F429-M450 VanDerWaalsContact CD1-CG 3.42Å; F429-M450 HydrophobicContact CD1-SD 4.38Å; F429-M450 HydrophobicContact CD2-CG 3.95Å; F429-M450 HydrophobicContact CE1-CG 3.84Å; F429-M450 HydrophobicContact CE2-CG 4.36Å; F429-M450 HydrophobicContact CG-CG 3.47Å; F429-M450 VanDerWaalsContact CG-CG 3.47Å; F429-M450 HydrophobicContact CG-SD 4Å; F429-M450 HydrophobicContact CZ-CG 4.3Å; I433-M450 HydrophobicContact CD1-SD 4.21Å; T446-M450 WeakPolarHBondContact O-CB 3.42Å; T446-M450 WeakPolarHBondContact O-CG 3.47Å; T446-M450 PolarHBondContact O-N 3.03Å; L447-M450 HydrophobicContact CD2-SD 4.05Å; L447-M450 PolarHBondContact O-N 2.67Å; E448-M450 VanDerWaalsContact C-N 3.32Å; E448-M450 PolarHBondContact O-N 3.22Å; M450-M453 CarbonylContact O-C 3.59Å; M450-M453 PolarHBondContact O-N 3.37Å; M450-N454 PolarHBondContact O-N 3.03Å; M450-N454 VanDerWaalsContact O-N 3.1Å; M450-V455 HydrophobicContact CB-CB 4.02Å; M450-V455 HydrophobicContact CB-CG1 4.39Å; M450-V455 HydrophobicContact CE-CG1 3.92Å; M450-V455 HydrophobicContact CG-CB 4.21Å; M450-V455 HydrophobicContact CG-CG1 4.13Å; M450-V455 WeakPolarHBondContact O-CB 3.46Å; M450-V455 PolarHBondContact O-N 2.89Å; M450-I457 HydrophobicContact CE-CG1 3.97Å; M450-T461 HydrophobicContact CE-CG2 4.19Å
451	L	84	Confident	79.1	Confident	45 Å²	45	43.3 Å²	43.3	24%	0.236	23%	0.23	C	C	.	.	H	α-helix	trans	-68.8	-33.8	176.8	-70.9	167.1	0	0	0	113.2	L447 E448 I457 V483 K486	L447-L451 WeakPolarHBondContact O-CB 3.5Å; L447-L451 VanDerWaalsContact O-CG 3.26Å; L447-L451 WeakPolarHBondContact O-CG 3.48Å; L447-L451 PolarHBondContact O-N 3.21Å; E448-L451 CarbonylContact O-C 3.5Å; E448-L451 WeakPolarHBondContact O-CA 3.29Å; E448-L451 WeakPolarHBondContact O-CB 3.26Å; E448-L451 PolarHBondContact O-N 3.25Å; L451-I457 HydrophobicContact CD1-CD1 4.08Å; L451-I457 HydrophobicContact CD2-CD1 4.12Å; L451-I457 HydrophobicContact CG-CD1 3.88Å; L451-V483 HydrophobicContact CD1-CB 4.28Å; L451-V483 HydrophobicContact CD1-CG1 3.96Å; L451-V483 HydrophobicContact CD1-CG2 4.16Å; L451-K486 HydrophobicContact CD1-CD 4Å; L451-K486 HydrophobicContact CD2-CD 4.4Å
452	E	82.3	Confident	80.1	Confident	146 Å²	146	41.5 Å²	41.5	68%	0.682	21%	0.212	S	C	*	.	H	α-helix	trans	-67	-36.6	172.2	-75.4	175.9	178	0	0	111.5	E448 L449	E448-E452 WeakPolarHBondContact O-CB 3.46Å; E448-E452 WeakPolarHBondContact O-CG 3.39Å; E448-E452 PolarHBondContact O-N 2.92Å; L449-E452 PolarHBondContact O-N 3.46Å
453	M	78.2	Confident	80.7	Confident	37 Å²	37	38 Å²	38	18%	0.182	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	8.8	-179.1	-65	171.1	113.6	0	0	113.5	I414 R415 A418 L424 F429 L449 M450 V455	I414-M453 HydrophobicContact CG2-CE 4.05Å; R415-M453 HydrophobicContact CG-CE 4.44Å; A418-M453 HydrophobicContact CB-CE 3.41Å; A418-M453 VanDerWaalsContact CB-CE 3.41Å; L424-M453 HydrophobicContact CD1-CB 3.81Å; L424-M453 HydrophobicContact CD1-CE 3.61Å; L424-M453 HydrophobicContact CD1-CG 4.16Å; L424-M453 HydrophobicContact CD1-SD 4Å; F429-M453 HydrophobicContact CE1-SD 3.63Å; F429-M453 HydrophobicContact CZ-CB 4.41Å; F429-M453 HydrophobicContact CZ-SD 3.62Å; L449-M453 HydrophobicContact CD1-SD 4Å; L449-M453 HydrophobicContact CD2-SD 4.06Å; L449-M453 HydrophobicContact CG-CG 4.5Å; L449-M453 HydrophobicContact CG-SD 3.6Å; L449-M453 WeakPolarHBondContact O-CB 3.35Å; L449-M453 WeakPolarHBondContact O-CG 3.21Å; L449-M453 PolarHBondContact O-N 2.89Å; M450-M453 CarbonylContact O-C 3.59Å; M450-M453 PolarHBondContact O-N 3.37Å; M453-V455 VanDerWaalsContact C-N 3.3Å; M453-V455 HydrophobicContact CB-CG2 3.94Å; M453-V455 PolarHBondContact O-N 2.97Å
454	N	79.9	Confident	80.7	Confident	151 Å²	151	38.1 Å²	38.1	81%	0.807	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	35.6	-177.5	-72	-44.7	0	0	0	115	M450	M450-N454 PolarHBondContact O-N 3.03Å; M450-N454 VanDerWaalsContact O-N 3.1Å
455	V	82.3	Confident	80.8	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.03	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-96.8	121.9	-178.9	180	0	0	0	0	109.7	L424 P426 F429 M450 M453	L424-V455 HydrophobicContact CB-CG2 3.7Å; L424-V455 HydrophobicContact CD1-CG2 4.33Å; P426-V455 HydrophobicContact CB-CG1 3.77Å; P426-V455 HydrophobicContact CG-CG1 3.52Å; F429-V455 HydrophobicContact CD2-CG1 4.01Å; F429-V455 HydrophobicContact CE2-CB 4.15Å; F429-V455 HydrophobicContact CE2-CG1 3.78Å; F429-V455 HydrophobicContact CE2-CG2 3.66Å; F429-V455 HydrophobicContact CZ-CB 4.41Å; F429-V455 HydrophobicContact CZ-CG1 4.5Å; F429-V455 HydrophobicContact CZ-CG2 3.78Å; M450-V455 HydrophobicContact CB-CB 4.02Å; M450-V455 HydrophobicContact CB-CG1 4.39Å; M450-V455 HydrophobicContact CE-CG1 3.92Å; M450-V455 HydrophobicContact CG-CB 4.21Å; M450-V455 HydrophobicContact CG-CG1 4.13Å; M450-V455 WeakPolarHBondContact O-CB 3.46Å; M450-V455 PolarHBondContact O-N 2.89Å; M453-V455 VanDerWaalsContact C-N 3.3Å; M453-V455 HydrophobicContact CB-CG2 3.94Å; M453-V455 PolarHBondContact O-N 2.97Å
456	P	81.6	Confident	81.2	Confident	44 Å²	44	34 Å²	34	29%	0.286	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-73.9	131.7	-170.3	28.7	-35.5	0	0	0	113	P426	P426-P456 HydrophobicContact CG-CG 4.09Å; P426-P456 WeakPolarHBondContact CG-O 3.4Å
457	I	83.2	Confident	81.4	Confident	20 Å²	20	33.5 Å²	33.5	10%	0.103	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-86.6	119.8	171.1	-58.2	169.9	0	0	0	107.8	L447 M450 L451 T461 M462 V483 L487	L447-I457 HydrophobicContact CB-CD1 4.06Å; L447-I457 HydrophobicContact CD1-CD1 4.45Å; L447-I457 HydrophobicContact CD2-CD1 3.93Å; L447-I457 HydrophobicContact CD2-CG1 4.15Å; L447-I457 HydrophobicContact CD2-CG2 4.49Å; L447-I457 HydrophobicContact CG-CD1 4.37Å; M450-I457 HydrophobicContact CE-CG1 3.97Å; L451-I457 HydrophobicContact CD1-CD1 4.08Å; L451-I457 HydrophobicContact CD2-CD1 4.12Å; L451-I457 HydrophobicContact CG-CD1 3.88Å; I457-T461 HydrophobicContact CG2-CG2 4.23Å; I457-M462 HydrophobicContact CG2-CG 3.91Å; I457-M462 HydrophobicContact CG2-SD 3.54Å; I457-M462 VanDerWaalsContact CG2-SD 3.54Å; I457-V483 HydrophobicContact CD1-CG1 4.44Å; I457-L487 HydrophobicContact CB-CD2 3.82Å; I457-L487 HydrophobicContact CD1-CD2 4Å; I457-L487 HydrophobicContact CG1-CD2 4.49Å; I457-L487 HydrophobicContact CG2-CD1 4.41Å; I457-L487 HydrophobicContact CG2-CD2 3.83Å
458	T	83	Confident	81	Confident	36 Å²	36	34.9 Å²	34.9	22%	0.221	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-104	169	-176.4	72.8	0	0	0	0	111.6	T460 T461 M462 P1298	T458-T460 PolarHBondContact O-N 3.16Å; T458-T460 PolarHBondContact OG1-N 2.67Å; T458-T460 VanDerWaalsContact OG1-N 3.14Å; T458-T460 PolarHBondContact OG1-OG1 2.99Å; T458-T461 PolarHBondContact N-OG1 2.74Å; T458-T461 WeakPolarHBondContact O-CB 3.25Å; T458-T461 PolarHBondContact O-N 3.16Å; T458-T461 PolarHBondContact OG1-N 3.06Å; T458-T461 PolarHBondContact OG1-OG1 2.93Å; T458-M462 PolarHBondContact O-N 3.43Å; T458-P1298 HydrophobicContact CG2-CB 3.77Å; T458-P1298 HydrophobicContact CG2-CG 3.9Å; T458-P1298 WeakPolarHBondContact OG1-CB 3.45Å; T458-P1298 WeakPolarHBondContact OG1-CG 3.49Å
459	M	78.6	Confident	80.4	Confident	33 Å²	33	34 Å²	34	16%	0.163	18%	0.178	C	C	.	.	H	α-helix	trans	-52.5	-35.3	167.3	-88.5	-67.1	114.8	0	0	112.7	M462 A463 F491	M459-M462 PolarHBondContact O-N 3.03Å; M459-A463 WeakPolarHBondContact O-CB 3.11Å; M459-A463 PolarHBondContact O-N 3.48Å; M459-F491 HydrophobicContact CE-CB 4.35Å; M459-F491 HydrophobicContact CE-CD1 3.73Å; M459-F491 HydrophobicContact CE-CD2 3.28Å; M459-F491 HydrophobicContact CE-CE1 3.81Å; M459-F491 HydrophobicContact CE-CE2 3.35Å; M459-F491 HydrophobicContact CE-CG 3.48Å; M459-F491 VanDerWaalsContact CE-CG 3.48Å; M459-F491 HydrophobicContact CE-CZ 3.63Å; M459-F491 WeakPolarHBondContact CE-O 3.42Å; M459-F491 HydrophobicContact CG-CE2 4.39Å
460	T	79.3	Confident	80.1	Confident	42 Å²	42	33.4 Å²	33.4	26%	0.258	18%	0.175	S	C	.	.	H	α-helix	trans	-68.9	-50	174.5	65.1	0	0	0	0	109.4	T458 M462 D464 W465 I1297 P1298	T458-T460 PolarHBondContact O-N 3.16Å; T458-T460 PolarHBondContact OG1-N 2.67Å; T458-T460 VanDerWaalsContact OG1-N 3.14Å; T458-T460 PolarHBondContact OG1-OG1 2.99Å; T460-M462 PolarHBondContact O-N 2.77Å; T460-D464 PolarHBondContact O-N 3.29Å; T460-W465 VanDerWaalsContact O-CB 3.23Å; T460-W465 WeakPolarHBondContact O-CB 3.36Å; T460-W465 PolarHBondContact O-N 3.02Å; T460-I1297 CarbonylContact C-O 3.56Å; T460-I1297 VanDerWaalsContact CB-O 3.23Å; T460-I1297 WeakPolarHBondContact CB-O 3.43Å; T460-I1297 PolarHBondContact OG1-O 3.49Å; T460-P1298 WeakPolarHBondContact OG1-CB 3.48Å
461	T	82.9	Confident	79.2	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-49.6	-35	176.4	-34.1	0	0	0	0	111.5	I433 L447 M450 I457 T458 W465 F466 I1297 P1298	I433-T461 HydrophobicContact CD1-CG2 4.21Å; L447-T461 HydrophobicContact CD2-CG2 4.22Å; M450-T461 HydrophobicContact CE-CG2 4.19Å; I457-T461 HydrophobicContact CG2-CG2 4.23Å; T458-T461 PolarHBondContact N-OG1 2.74Å; T458-T461 WeakPolarHBondContact O-CB 3.25Å; T458-T461 PolarHBondContact O-N 3.16Å; T458-T461 PolarHBondContact OG1-N 3.06Å; T458-T461 PolarHBondContact OG1-OG1 2.93Å; T461-W465 CarbonylContact O-C 3.17Å; T461-F466 WeakPolarHBondContact O-CA 3.42Å; T461-F466 WeakPolarHBondContact O-CB 3.27Å; T461-F466 PolarHBondContact O-N 2.81Å; T461-I1297 PolarHBondContact N-O 3.46Å; T461-P1298 HydrophobicContact CG2-CG 4.33Å; T461-P1298 WeakPolarHBondContact OG1-CD 3.2Å; T461-P1298 WeakPolarHBondContact OG1-CG 3.5Å
462	M	84.4	Confident	78.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-84	-70.5	179.7	-61.1	-53.5	-62.9	0	0	112.9	L447 I457 T458 M459 T460 D464 W465 F466 W467 L478 L487 F491 S495	L447-M462 HydrophobicContact CD1-SD 4.39Å; I457-M462 HydrophobicContact CG2-CG 3.91Å; I457-M462 HydrophobicContact CG2-SD 3.54Å; I457-M462 VanDerWaalsContact CG2-SD 3.54Å; T458-M462 PolarHBondContact O-N 3.43Å; M459-M462 PolarHBondContact O-N 3.03Å; T460-M462 PolarHBondContact O-N 2.77Å; M462-D464 PolarHBondContact O-N 3.03Å; M462-W465 PolarHBondContact O-N 3.2Å; M462-F466 HydrophobicContact CE-CB 4.47Å; M462-F466 HydrophobicContact CE-CD1 3.34Å; M462-F466 HydrophobicContact CE-CE1 3.69Å; M462-F466 HydrophobicContact CE-CG 4.01Å; M462-F466 PolarHBondContact O-N 2.94Å; M462-F466 HydrophobicContact SD-CB 4.27Å; M462-F466 HydrophobicContact SD-CD1 4.17Å; M462-F466 HydrophobicContact SD-CG 4.25Å; M462-W467 VanDerWaalsContact C-CD1 3.45Å; M462-W467 HydrophobicContact CE-CZ2 3.94Å; M462-W467 PolarHBondContact O-N 3.32Å; M462-L478 HydrophobicContact CE-CD2 3.39Å; M462-L487 HydrophobicContact CE-CD1 4.18Å; M462-L487 HydrophobicContact SD-CD1 3.99Å; M462-F491 HydrophobicContact CG-CD1 4.44Å; M462-F491 HydrophobicContact CG-CE1 3.58Å; M462-F491 HydrophobicContact CG-CZ 4.29Å; M462-S495 VanDerWaalsContact CB-CB 3.42Å
463	A	78.4	Confident	78.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.3	-36.6	-164.6	0	0	0	0	0	114.4	M459 S495 C498 H499	M459-A463 WeakPolarHBondContact O-CB 3.11Å; M459-A463 PolarHBondContact O-N 3.48Å; A463-S495 WeakPolarHBondContact CB-O 3.42Å; A463-C498 HydrophobicContact CB-CB 3.74Å; A463-H499 PolarHBondContact O-ND1 3.3Å
464	D	74.3	Confident	78.2	Confident	8 Å²	8	31.4 Å²	31.4	4%	0.043	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-11.7	-175.4	-67.8	-16.4	0	0	0	111.5	T460 M462 K502 K525 E1295	T460-D464 PolarHBondContact O-N 3.29Å; M462-D464 PolarHBondContact O-N 3.03Å; D464-K502 WeakPolarHBondContact OD1-CD 3.42Å; D464-K502 WeakPolarHBondContact OD1-CE 3.4Å; D464-K502 IonicContact OD1-NZ 3.98Å; D464-K502 PolarHBondContact OD1-NZ 3.06Å; D464-K502 IonicContact OD2-NZ 2.74Å; D464-K502 PolarHBondContact OD2-NZ 2.92Å; D464-K525 VanDerWaalsContact CG-NZ 3.32Å; D464-K525 WeakPolarHBondContact OD1-CE 3.48Å; D464-K525 IonicContact OD1-NZ 3.16Å; D464-K525 PolarHBondContact OD1-NZ 2.89Å; D464-K525 VanDerWaalsContact OD1-NZ 3.07Å; D464-K525 WeakPolarHBondContact OD2-CE 3.23Å; D464-K525 IonicContact OD2-NZ 2.65Å; D464-K525 PolarHBondContact OD2-NZ 3.03Å; D464-E1295 WeakPolarHBondContact O-CA 2.99Å; D464-E1295 WeakPolarHBondContact O-CG 2.85Å
465	W	79.8	Confident	78.2	Confident	45 Å²	45	25 Å²	25	17%	0.17	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-155.9	16.6	-152.3	-53.4	118.2	0	0	0	116.8	T460 T461 M462 K1294 E1295 A1296 I1297	T460-W465 VanDerWaalsContact O-CB 3.23Å; T460-W465 WeakPolarHBondContact O-CB 3.36Å; T460-W465 PolarHBondContact O-N 3.02Å; T461-W465 CarbonylContact O-C 3.17Å; M462-W465 PolarHBondContact O-N 3.2Å; W465-K1294 HydrophobicContact CH2-CB 4.01Å; W465-K1294 HydrophobicContact CH2-CG 4.4Å; W465-K1294 HydrophobicContact CZ2-CB 4.47Å; W465-K1294 HydrophobicContact CZ3-CB 4.18Å; W465-E1295 WeakPolarHBondContact CA-OE1 3.45Å; W465-E1295 VanDerWaalsContact CE3-N 3.27Å; W465-E1295 VanDerWaalsContact N-CD 3.34Å; W465-E1295 PolarHBondContact N-OE1 3.33Å; W465-A1296 VanDerWaalsContact CA-N 3.27Å; W465-A1296 VanDerWaalsContact CB-CA 3.44Å; W465-A1296 VanDerWaalsContact CE3-C 3.44Å; W465-A1296 PolarHBondContact O-N 3.19Å; W465-I1297 HydrophobicContact CD2-CB 3.55Å; W465-I1297 HydrophobicContact CD2-CD1 4.3Å; W465-I1297 HydrophobicContact CD2-CG1 3.7Å; W465-I1297 VanDerWaalsContact CD2-N 3.31Å; W465-I1297 HydrophobicContact CE3-CB 3.99Å; W465-I1297 HydrophobicContact CE3-CD1 4.13Å; W465-I1297 HydrophobicContact CE3-CG1 3.59Å; W465-I1297 HydrophobicContact CG-CB 3.72Å; W465-I1297 HydrophobicContact CG-CG1 4.37Å; W465-I1297 HydrophobicContact CH2-CD1 3.76Å; W465-I1297 HydrophobicContact CH2-CG1 4.17Å; W465-I1297 HydrophobicContact CZ2-CB 4.31Å; W465-I1297 HydrophobicContact CZ2-CD1 3.72Å; W465-I1297 HydrophobicContact CZ2-CG1 4.09Å; W465-I1297 HydrophobicContact CZ3-CD1 3.91Å; W465-I1297 HydrophobicContact CZ3-CG1 3.87Å
466	F	84.5	Confident	78.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.8	-35.3	163.8	160.5	-89.3	0	0	0	113.4	L447 T461 M462 S470 M473 L478 E1295	L447-F466 HydrophobicContact CD1-CD2 3.5Å; L447-F466 VanDerWaalsContact CD1-CD2 3.5Å; L447-F466 HydrophobicContact CD1-CE2 3.43Å; L447-F466 VanDerWaalsContact CD1-CE2 3.43Å; L447-F466 HydrophobicContact CD1-CG 4.21Å; L447-F466 HydrophobicContact CD1-CZ 4.11Å; L447-F466 HydrophobicContact CG-CD2 4.08Å; L447-F466 HydrophobicContact CG-CE2 4.2Å; T461-F466 WeakPolarHBondContact O-CA 3.42Å; T461-F466 WeakPolarHBondContact O-CB 3.27Å; T461-F466 PolarHBondContact O-N 2.81Å; M462-F466 HydrophobicContact CE-CB 4.47Å; M462-F466 HydrophobicContact CE-CD1 3.34Å; M462-F466 HydrophobicContact CE-CE1 3.69Å; M462-F466 HydrophobicContact CE-CG 4.01Å; M462-F466 PolarHBondContact O-N 2.94Å; M462-F466 HydrophobicContact SD-CB 4.27Å; M462-F466 HydrophobicContact SD-CD1 4.17Å; M462-F466 HydrophobicContact SD-CG 4.25Å; F466-S470 WeakPolarHBondContact CD2-OG 3.09Å; F466-S470 VanDerWaalsContact CE2-OG 3.32Å; F466-S470 WeakPolarHBondContact CE2-OG 3.22Å; F466-S470 WeakPolarHBondContact O-CA 3.48Å; F466-S470 WeakPolarHBondContact O-CB 3.48Å; F466-S470 PolarHBondContact O-N 3.35Å; F466-S470 PolarHBondContact O-OG 3.39Å; F466-M473 HydrophobicContact CE1-CB 4.17Å; F466-M473 HydrophobicContact CE1-CG 3.97Å; F466-M473 HydrophobicContact CZ-CB 4.21Å; F466-M473 HydrophobicContact CZ-CE 4.28Å; F466-M473 HydrophobicContact CZ-CG 3.89Å; F466-L478 HydrophobicContact CE1-CD2 3.87Å; F466-L478 HydrophobicContact CZ-CD1 4.18Å; F466-L478 HydrophobicContact CZ-CD2 4.27Å; F466-E1295 WeakPolarHBondContact CA-OE2 3.35Å; F466-E1295 PolarHBondContact N-OE1 3.2Å; F466-E1295 VanDerWaalsContact N-OE1 3.12Å; F466-E1295 PolarHBondContact N-OE2 2.91Å
467	W	81.7	Confident	77.9	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.015	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-38.2	-174.3	-70.7	119	0	0	0	113.9	M462 S470 P471 M473 V475 L478 V492 S495 Y496 H499 E1295	M462-W467 VanDerWaalsContact C-CD1 3.45Å; M462-W467 HydrophobicContact CE-CZ2 3.94Å; M462-W467 PolarHBondContact O-N 3.32Å; W467-S470 CarbonylContact O-C 3.58Å; W467-S470 PolarHBondContact O-N 3.49Å; W467-P471 WeakPolarHBondContact O-CA 3.48Å; W467-P471 VanDerWaalsContact O-N 3.13Å; W467-M473 HydrophobicContact CE3-CB 4.14Å; W467-M473 HydrophobicContact CE3-CG 4.47Å; W467-M473 HydrophobicContact CH2-CG 4.43Å; W467-M473 HydrophobicContact CZ3-CB 3.79Å; W467-M473 HydrophobicContact CZ3-CG 3.72Å; W467-M473 VanDerWaalsContact CZ3-O 3.26Å; W467-M473 WeakPolarHBondContact CZ3-O 3.34Å; W467-V475 HydrophobicContact CH2-CG2 4.49Å; W467-L478 HydrophobicContact CH2-CB 4.05Å; W467-L478 HydrophobicContact CH2-CD2 3.64Å; W467-L478 HydrophobicContact CZ2-CD2 3.93Å; W467-L478 HydrophobicContact CZ3-CD2 4.38Å; W467-V492 HydrophobicContact CH2-CG1 3.73Å; W467-V492 HydrophobicContact CZ2-CG1 3.7Å; W467-S495 PolarHBondContact NE1-OG 3.09Å; W467-Y496 HydrophobicContact CD2-CD2 4.11Å; W467-Y496 HydrophobicContact CE3-CD2 4.15Å; W467-Y496 HydrophobicContact CZ3-CD2 4.38Å; W467-H499 HydrophobicContact CB-CB 4.44Å; W467-E1295 PolarHBondContact N-OE1 3.06Å; W467-E1295 VanDerWaalsContact N-OE1 3.13Å; W467-E1295 PolarHBondContact N-OE2 3.42Å; W467-E1295 VanDerWaalsContact N-OE2 3.14Å
468	S	75.4	Confident	77.9	Confident	31 Å²	31	30.6 Å²	30.6	22%	0.217	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.8	177.1	-2.1	0	0	0	0	114.1	H499 N503 E1295	S468-H499 PolarHBondContact OG-CE1 3.17Å; S468-H499 PolarHBondContact OG-ND1 2.66Å; S468-N503 PolarHBondContact OG-ND2 3.5Å; S468-E1295 VanDerWaalsContact CA-CD 3.43Å; S468-E1295 VanDerWaalsContact CB-CD 3.48Å; S468-E1295 VanDerWaalsContact CB-CG 3.48Å; S468-E1295 WeakPolarHBondContact CB-OE1 3.04Å; S468-E1295 PolarHBondContact N-OE1 3.49Å; S468-E1295 PolarHBondContact N-OE2 3.49Å; S468-E1295 VanDerWaalsContact OG-CG 3.28Å; S468-E1295 WeakPolarHBondContact OG-CG 3.23Å; S468-E1295 PolarHBondContact OG-OE1 3.44Å
469	H	69.2	Low	77.7	Confident	48 Å²	48	30.4 Å²	30.4	22%	0.222	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-6.8	163.1	-79.5	19.4	0	0	0	113	I433 E1295	I433-H469 PolarHBondContact O-CD2 2.89Å; H469-E1295 HydrophobicContact CB-CB 4.26Å; H469-E1295 WeakPolarHBondContact CB-OE2 3.35Å; H469-E1295 IonicContact CG-OE2 3.14Å; H469-E1295 PolarHBondContact N-OE2 3.08Å; H469-E1295 VanDerWaalsContact ND1-CB 3.33Å; H469-E1295 WeakPolarHBondContact ND1-CB 3.46Å
470	S	72.3	Confident	77.7	Confident	5 Å²	5	36.2 Å²	36.2	4%	0.035	20%	0.195	C	C	.	.			trans	-124.7	52.9	169.2	-45.5	0	0	0	0	111.9	T443 F466 W467 S472 M473	T443-S470 PolarHBondContact OG1-OG 3.02Å; T443-S470 VanDerWaalsContact OG1-OG 3.1Å; F466-S470 WeakPolarHBondContact CD2-OG 3.09Å; F466-S470 VanDerWaalsContact CE2-OG 3.32Å; F466-S470 WeakPolarHBondContact CE2-OG 3.22Å; F466-S470 WeakPolarHBondContact O-CA 3.48Å; F466-S470 WeakPolarHBondContact O-CB 3.48Å; F466-S470 PolarHBondContact O-N 3.35Å; F466-S470 PolarHBondContact O-OG 3.39Å; W467-S470 CarbonylContact O-C 3.58Å; W467-S470 PolarHBondContact O-N 3.49Å; S470-S472 PolarHBondContact O-N 3.24Å; S470-M473 WeakPolarHBondContact O-CB 3.42Å; S470-M473 PolarHBondContact O-N 3.22Å
471	P	66.9	Low	77.8	Confident	73 Å²	73	37 Å²	37	47%	0.474	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-3.7	-176.3	22.9	-31.3	0	0	0	115.1	W467 K1186	W467-P471 WeakPolarHBondContact O-CA 3.48Å; W467-P471 VanDerWaalsContact O-N 3.13Å; P471-K1186 HydrophobicContact CB-CD 4.24Å; P471-K1186 HydrophobicContact CB-CG 4.27Å; P471-K1186 HydrophobicContact CG-CB 4.34Å; P471-K1186 HydrophobicContact CG-CD 3.88Å; P471-K1186 HydrophobicContact CG-CG 3.8Å; P471-K1186 WeakPolarHBondContact O-CE 3.42Å
472	S	68.4	Low	77.7	Confident	30 Å²	30	41.2 Å²	41.2	21%	0.21	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-17	168.1	-46.7	0	0	0	0	113.8	E440 S470 K1186	E440-S472 WeakPolarHBondContact OE1-CB 3.44Å; E440-S472 PolarHBondContact OE1-OG 3.35Å; S470-S472 PolarHBondContact O-N 3.24Å; S472-K1186 WeakPolarHBondContact OG-CD 3.29Å; S472-K1186 WeakPolarHBondContact OG-CE 3.44Å; S472-K1186 PolarHBondContact OG-NZ 3.48Å
473	M	76.5	Confident	77.6	Confident	20 Å²	20	41.2 Å²	41.2	10%	0.099	23%	0.225	C	C	.	.			trans	-82	121.4	-178.4	-159.4	68.4	58.5	0	0	109	V444 F466 W467 S470 T477 L478 L481	V444-M473 HydrophobicContact CG2-CE 3.58Å; F466-M473 HydrophobicContact CE1-CB 4.17Å; F466-M473 HydrophobicContact CE1-CG 3.97Å; F466-M473 HydrophobicContact CZ-CB 4.21Å; F466-M473 HydrophobicContact CZ-CE 4.28Å; F466-M473 HydrophobicContact CZ-CG 3.89Å; W467-M473 HydrophobicContact CE3-CB 4.14Å; W467-M473 HydrophobicContact CE3-CG 4.47Å; W467-M473 HydrophobicContact CH2-CG 4.43Å; W467-M473 HydrophobicContact CZ3-CB 3.79Å; W467-M473 HydrophobicContact CZ3-CG 3.72Å; W467-M473 VanDerWaalsContact CZ3-O 3.26Å; W467-M473 WeakPolarHBondContact CZ3-O 3.34Å; S470-M473 WeakPolarHBondContact O-CB 3.42Å; S470-M473 PolarHBondContact O-N 3.22Å; M473-T477 PolarHBondContact SD-OG1 2.8Å; M473-L478 HydrophobicContact CG-CB 3.64Å; M473-L478 HydrophobicContact CG-CD1 4.3Å; M473-L478 HydrophobicContact CG-CG 4.36Å; M473-L478 HydrophobicContact SD-CB 3.9Å; M473-L478 HydrophobicContact SD-CD1 4.21Å; M473-L481 HydrophobicContact CE-CD1 3.75Å; M473-L481 HydrophobicContact SD-CD1 3.78Å
474	T	78.9	Confident	77.5	Confident	65 Å²	65	41.3 Å²	41.3	40%	0.399	23%	0.225	S	C	.	.			trans	-96	163.7	167.5	69.2	0	0	0	0	109.4	E476 T477 L478	T474-E476 PolarHBondContact O-N 2.82Å; T474-E476 PolarHBondContact OG1-N 2.69Å; T474-T477 PolarHBondContact N-OG1 2.65Å; T474-T477 PolarHBondContact O-N 3.4Å; T474-T477 PolarHBondContact O-OG1 2.82Å; T474-T477 PolarHBondContact OG1-N 3.29Å; T474-T477 PolarHBondContact OG1-OG1 1.88Å; T474-L478 PolarHBondContact O-N 3.12Å
475	V	80.6	Confident	77.7	Confident	17 Å²	17	44.4 Å²	44.4	10%	0.103	25%	0.252	C	S	.	.	H	α-helix	trans	-52	-37.7	170.1	171.2	0	0	0	0	111.1	W467 S479 V492 S493 Y496 F512	W467-V475 HydrophobicContact CH2-CG2 4.49Å; V475-S479 WeakPolarHBondContact O-CB 3.26Å; V475-S479 PolarHBondContact O-N 3.49Å; V475-S479 VanDerWaalsContact O-N 3.11Å; V475-S479 PolarHBondContact O-OG 2.7Å; V475-V492 HydrophobicContact CB-CG1 4.11Å; V475-V492 HydrophobicContact CG1-CG1 3.85Å; V475-V492 HydrophobicContact CG2-CG1 4.2Å; V475-S493 WeakPolarHBondContact CG1-OG 3.44Å; V475-Y496 VanDerWaalsContact CG2-CB 3.45Å; V475-Y496 HydrophobicContact CG2-CD1 3.82Å; V475-Y496 HydrophobicContact CG2-CD2 4.02Å; V475-Y496 HydrophobicContact CG2-CG 3.48Å; V475-Y496 VanDerWaalsContact CG2-CG 3.48Å; V475-F512 HydrophobicContact CG2-CE2 4.17Å; V475-F512 HydrophobicContact CG2-CZ 4.05Å
476	E	79.5	Confident	77.7	Confident	128 Å²	128	49.3 Å²	49.3	60%	0.598	28%	0.275	S	S	*	.	H	α-helix	trans	-74.9	-42.2	178.8	-65	-170.5	-163.4	0	0	113.9	T474 S479 K480	T474-E476 PolarHBondContact O-N 2.82Å; T474-E476 PolarHBondContact OG1-N 2.69Å; E476-S479 PolarHBondContact O-N 3.35Å; E476-K480 VanDerWaalsContact O-CD 3.32Å; E476-K480 WeakPolarHBondContact O-CD 3.24Å; E476-K480 WeakPolarHBondContact O-CG 3.4Å; E476-K480 PolarHBondContact O-N 3.32Å; E476-K480 VanDerWaalsContact O-N 3.14Å; E476-K480 IonicContact OE2-NZ 2.65Å; E476-K480 PolarHBondContact OE2-NZ 3.2Å
477	T	78	Confident	77.5	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-70.9	-39.3	179.6	54.7	0	0	0	0	111.1	M473 T474 K480 L481	M473-T477 PolarHBondContact SD-OG1 2.8Å; T474-T477 PolarHBondContact N-OG1 2.65Å; T474-T477 PolarHBondContact O-N 3.4Å; T474-T477 PolarHBondContact O-OG1 2.82Å; T474-T477 PolarHBondContact OG1-N 3.29Å; T474-T477 PolarHBondContact OG1-OG1 1.88Å; T477-K480 PolarHBondContact O-N 2.86Å; T477-L481 PolarHBondContact O-N 2.9Å
478	L	82.2	Confident	77.4	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-46.6	173	-171.4	56	0	0	0	111.1	M462 F466 W467 M473 T474 K480 L481 V483 G484 L487 V492	M462-L478 HydrophobicContact CE-CD2 3.39Å; F466-L478 HydrophobicContact CE1-CD2 3.87Å; F466-L478 HydrophobicContact CZ-CD1 4.18Å; F466-L478 HydrophobicContact CZ-CD2 4.27Å; W467-L478 HydrophobicContact CH2-CB 4.05Å; W467-L478 HydrophobicContact CH2-CD2 3.64Å; W467-L478 HydrophobicContact CZ2-CD2 3.93Å; W467-L478 HydrophobicContact CZ3-CD2 4.38Å; M473-L478 HydrophobicContact CG-CB 3.64Å; M473-L478 HydrophobicContact CG-CD1 4.3Å; M473-L478 HydrophobicContact CG-CG 4.36Å; M473-L478 HydrophobicContact SD-CB 3.9Å; M473-L478 HydrophobicContact SD-CD1 4.21Å; T474-L478 PolarHBondContact O-N 3.12Å; L478-K480 PolarHBondContact O-N 2.3Å; L478-K480 VanDerWaalsContact O-N 3.14Å; L478-L481 HydrophobicContact CD1-CD1 4.34Å; L478-L481 WeakPolarHBondContact O-CB 3.41Å; L478-L481 PolarHBondContact O-N 3.35Å; L478-V483 HydrophobicContact CD1-CB 4.48Å; L478-V483 HydrophobicContact CD1-CG1 4.39Å; L478-G484 WeakPolarHBondContact O-CA 3.46Å; L478-G484 PolarHBondContact O-N 2.74Å; L478-L487 HydrophobicContact CD2-CD1 4.35Å; L478-V492 HydrophobicContact CB-CG1 4.33Å; L478-V492 HydrophobicContact CD2-CG1 4.13Å; L478-V492 HydrophobicContact CD2-CG2 4.22Å
479	S	79.8	Confident	77.6	Confident	33 Å²	33	56.6 Å²	56.6	23%	0.231	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-21	179.1	-60.4	0	0	0	0	113.5	V475 E476	V475-S479 WeakPolarHBondContact O-CB 3.26Å; V475-S479 PolarHBondContact O-N 3.49Å; V475-S479 VanDerWaalsContact O-N 3.11Å; V475-S479 PolarHBondContact O-OG 2.7Å; E476-S479 PolarHBondContact O-N 3.35Å
480	K	79.3	Confident	77.9	Confident	155 Å²	155	57.4 Å²	57.4	67%	0.674	32%	0.32	S	S	*	.	H	α-helix	trans	-85.2	-18.3	173.1	-70.6	162.1	-170.8	162.6	0	113.3	E476 T477 L478	E476-K480 VanDerWaalsContact O-CD 3.32Å; E476-K480 WeakPolarHBondContact O-CD 3.24Å; E476-K480 WeakPolarHBondContact O-CG 3.4Å; E476-K480 PolarHBondContact O-N 3.32Å; E476-K480 VanDerWaalsContact O-N 3.14Å; E476-K480 IonicContact OE2-NZ 2.65Å; E476-K480 PolarHBondContact OE2-NZ 3.2Å; T477-K480 PolarHBondContact O-N 2.86Å; L478-K480 PolarHBondContact O-N 2.3Å; L478-K480 VanDerWaalsContact O-N 3.14Å
481	L	81.1	Confident	78.3	Confident	58 Å²	58	59.8 Å²	59.8	30%	0.304	33%	0.33	S	S	.	.	S	Bend	trans	-81.2	152.7	175.9	-70.8	171.8	0	0	0	111.8	V444 M473 T477 L478 V483 G484 A485	V444-L481 HydrophobicContact CG1-CD1 4.3Å; V444-L481 HydrophobicContact CG2-CD1 4.29Å; M473-L481 HydrophobicContact CE-CD1 3.75Å; M473-L481 HydrophobicContact SD-CD1 3.78Å; T477-L481 PolarHBondContact O-N 2.9Å; L478-L481 HydrophobicContact CD1-CD1 4.34Å; L478-L481 WeakPolarHBondContact O-CB 3.41Å; L478-L481 PolarHBondContact O-N 3.35Å; L481-V483 PolarHBondContact O-N 3.22Å; L481-V483 VanDerWaalsContact O-N 3.1Å; L481-G484 PolarHBondContact O-N 3.34Å; L481-G484 VanDerWaalsContact O-N 3.09Å; L481-A485 PolarHBondContact O-N 3.46Å
482	P	80.2	Confident	79.1	Confident	88 Å²	88	56.3 Å²	56.3	57%	0.571	31%	0.307	S	S	*	.	H	α-helix	trans	-55.6	-30.1	176.4	-25.5	34.6	0	0	0	113.9	K486	P482-K486 WeakPolarHBondContact O-CG 3.26Å; P482-K486 PolarHBondContact O-N 2.93Å
483	V	82.6	Confident	79.7	Confident	1 Å²	1	55 Å²	55	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-53.2	174.8	178.2	0	0	0	0	111.3	V444 L447 E448 L451 I457 L478 L481 A485 K486 L487	V444-V483 HydrophobicContact CG1-CG2 4.25Å; L447-V483 HydrophobicContact CB-CG1 3.75Å; L447-V483 HydrophobicContact CB-CG2 4.42Å; L447-V483 HydrophobicContact CD1-CG1 3.79Å; L447-V483 HydrophobicContact CG-CG1 4.45Å; E448-V483 HydrophobicContact CG-CG2 3.46Å; E448-V483 VanDerWaalsContact CG-CG2 3.46Å; L451-V483 HydrophobicContact CD1-CB 4.28Å; L451-V483 HydrophobicContact CD1-CG1 3.96Å; L451-V483 HydrophobicContact CD1-CG2 4.16Å; I457-V483 HydrophobicContact CD1-CG1 4.44Å; L478-V483 HydrophobicContact CD1-CB 4.48Å; L478-V483 HydrophobicContact CD1-CG1 4.39Å; L481-V483 PolarHBondContact O-N 3.22Å; L481-V483 VanDerWaalsContact O-N 3.1Å; V483-A485 PolarHBondContact O-N 3.44Å; V483-K486 WeakPolarHBondContact O-CB 3.29Å; V483-K486 PolarHBondContact O-N 3.28Å; V483-K486 VanDerWaalsContact O-N 3.14Å; V483-L487 HydrophobicContact CG1-CD1 4.1Å; V483-L487 WeakPolarHBondContact O-CG 3.15Å; V483-L487 PolarHBondContact O-N 2.8Å; V483-L487 VanDerWaalsContact O-N 3.13Å
484	G	75.8	Confident	79.9	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-71.9	-30.2	-177.9	0	0	0	0	0	113.7	L478 L481 K486 L487 G488	L478-G484 WeakPolarHBondContact O-CA 3.46Å; L478-G484 PolarHBondContact O-N 2.74Å; L481-G484 PolarHBondContact O-N 3.34Å; L481-G484 VanDerWaalsContact O-N 3.09Å; G484-K486 PolarHBondContact O-N 3.13Å; G484-L487 PolarHBondContact O-N 3.34Å; G484-L487 VanDerWaalsContact O-N 3.09Å; G484-G488 PolarHBondContact O-N 3.44Å
485	A	78.8	Confident	80.1	Confident	73 Å²	73	51.1 Å²	51.1	60%	0.603	28%	0.276	S	S	*	.	H	α-helix	trans	-58.7	-35.2	168.9	0	0	0	0	0	112.3	L481 V483	L481-A485 PolarHBondContact O-N 3.46Å; V483-A485 PolarHBondContact O-N 3.44Å
486	K	80.6	Confident	80.3	Confident	149 Å²	149	53.4 Å²	53.4	65%	0.648	28%	0.283	S	S	*	.	H	α-helix	trans	-76.2	-26.3	173	-75.9	175.1	173.4	-178.8	0	113.9	L451 P482 V483 G484	L451-K486 HydrophobicContact CD1-CD 4Å; L451-K486 HydrophobicContact CD2-CD 4.4Å; P482-K486 WeakPolarHBondContact O-CG 3.26Å; P482-K486 PolarHBondContact O-N 2.93Å; V483-K486 WeakPolarHBondContact O-CB 3.29Å; V483-K486 PolarHBondContact O-N 3.28Å; V483-K486 VanDerWaalsContact O-N 3.14Å; G484-K486 PolarHBondContact O-N 3.13Å
487	L	79.3	Confident	80.5	Confident	30 Å²	30	47.5 Å²	47.5	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-82	-32.6	179	-66.8	171.6	0	0	0	112.9	I457 M462 L478 V483 G484 F491 V492	I457-L487 HydrophobicContact CB-CD2 3.82Å; I457-L487 HydrophobicContact CD1-CD2 4Å; I457-L487 HydrophobicContact CG1-CD2 4.49Å; I457-L487 HydrophobicContact CG2-CD1 4.41Å; I457-L487 HydrophobicContact CG2-CD2 3.83Å; M462-L487 HydrophobicContact CE-CD1 4.18Å; M462-L487 HydrophobicContact SD-CD1 3.99Å; L478-L487 HydrophobicContact CD2-CD1 4.35Å; V483-L487 HydrophobicContact CG1-CD1 4.1Å; V483-L487 WeakPolarHBondContact O-CG 3.15Å; V483-L487 PolarHBondContact O-N 2.8Å; V483-L487 VanDerWaalsContact O-N 3.13Å; G484-L487 PolarHBondContact O-N 3.34Å; G484-L487 VanDerWaalsContact O-N 3.09Å; L487-F491 HydrophobicContact CB-CD1 4.03Å; L487-F491 HydrophobicContact CB-CE1 4.45Å; L487-F491 HydrophobicContact CD2-CD1 4.32Å; L487-F491 HydrophobicContact CD2-CE1 3.9Å; L487-F491 WeakPolarHBondContact O-CB 3.42Å; L487-V492 HydrophobicContact CB-CG2 4.13Å
488	G	80	Confident	80.7	Confident	30 Å²	30	44.8 Å²	44.8	31%	0.309	24%	0.239	S	C	.	.			trans	86	137.6	178	0	0	0	0	0	113.9	G484 N490 F491 V492	G484-G488 PolarHBondContact O-N 3.44Å; G488-N490 VanDerWaalsContact C-N 3.34Å; G488-N490 PolarHBondContact O-N 3.17Å; G488-F491 WeakPolarHBondContact O-CB 3.4Å; G488-F491 PolarHBondContact O-N 2.87Å; G488-V492 WeakPolarHBondContact O-CG2 3.5Å; G488-V492 PolarHBondContact O-N 3.45Å
489	Q	79.1	Confident	80.7	Confident	128 Å²	128	45.7 Å²	45.7	60%	0.598	24%	0.243	S	C	*	.	H	α-helix	trans	-56.3	-41	-169.5	-169.4	178.1	6.9	0	0	113.8	F491 V492 S493	Q489-F491 PolarHBondContact O-N 3.44Å; Q489-V492 PolarHBondContact O-N 3.25Å; Q489-S493 WeakPolarHBondContact O-CB 3.43Å; Q489-S493 PolarHBondContact O-N 3.24Å; Q489-S493 PolarHBondContact O-OG 2.88Å
490	N	76.2	Confident	80.9	Confident	64 Å²	64	44.9 Å²	44.9	34%	0.342	24%	0.236	S	C	.	.	H	α-helix	trans	-63	-40.3	178.5	-69.4	-14.5	0	0	0	112.3	G488 L494 L521	G488-N490 VanDerWaalsContact C-N 3.34Å; G488-N490 PolarHBondContact O-N 3.17Å; N490-L494 VanDerWaalsContact O-CB 3.27Å; N490-L494 WeakPolarHBondContact O-CB 3.43Å; N490-L494 WeakPolarHBondContact O-CD1 3.34Å; N490-L494 WeakPolarHBondContact O-CG 3.2Å; N490-L494 PolarHBondContact O-N 3.35Å; N490-L521 HydrophobicContact CB-CD1 3.75Å
491	F	81.3	Confident	81	Confident	55 Å²	55	37.5 Å²	37.5	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-45.2	176.2	-177.5	-87.7	0	0	0	110.2	M459 M462 L487 G488 Q489 L494 S495	M459-F491 HydrophobicContact CE-CB 4.35Å; M459-F491 HydrophobicContact CE-CD1 3.73Å; M459-F491 HydrophobicContact CE-CD2 3.28Å; M459-F491 HydrophobicContact CE-CE1 3.81Å; M459-F491 HydrophobicContact CE-CE2 3.35Å; M459-F491 HydrophobicContact CE-CG 3.48Å; M459-F491 VanDerWaalsContact CE-CG 3.48Å; M459-F491 HydrophobicContact CE-CZ 3.63Å; M459-F491 WeakPolarHBondContact CE-O 3.42Å; M459-F491 HydrophobicContact CG-CE2 4.39Å; M462-F491 HydrophobicContact CG-CD1 4.44Å; M462-F491 HydrophobicContact CG-CE1 3.58Å; M462-F491 HydrophobicContact CG-CZ 4.29Å; L487-F491 HydrophobicContact CB-CD1 4.03Å; L487-F491 HydrophobicContact CB-CE1 4.45Å; L487-F491 HydrophobicContact CD2-CD1 4.32Å; L487-F491 HydrophobicContact CD2-CE1 3.9Å; L487-F491 WeakPolarHBondContact O-CB 3.42Å; G488-F491 WeakPolarHBondContact O-CB 3.4Å; G488-F491 PolarHBondContact O-N 2.87Å; Q489-F491 PolarHBondContact O-N 3.44Å; F491-L494 PolarHBondContact O-N 3.49Å; F491-S495 WeakPolarHBondContact O-CB 3.29Å; F491-S495 PolarHBondContact O-N 3.09Å; F491-S495 PolarHBondContact O-OG 3.1Å
492	V	83	Confident	80.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-52.9	175.8	180	0	0	0	0	110.4	W467 V475 L478 L487 G488 Q489 L494 S495 Y496	W467-V492 HydrophobicContact CH2-CG1 3.73Å; W467-V492 HydrophobicContact CZ2-CG1 3.7Å; V475-V492 HydrophobicContact CB-CG1 4.11Å; V475-V492 HydrophobicContact CG1-CG1 3.85Å; V475-V492 HydrophobicContact CG2-CG1 4.2Å; L478-V492 HydrophobicContact CB-CG1 4.33Å; L478-V492 HydrophobicContact CD2-CG1 4.13Å; L478-V492 HydrophobicContact CD2-CG2 4.22Å; L487-V492 HydrophobicContact CB-CG2 4.13Å; G488-V492 WeakPolarHBondContact O-CG2 3.5Å; G488-V492 PolarHBondContact O-N 3.45Å; Q489-V492 PolarHBondContact O-N 3.25Å; V492-L494 PolarHBondContact O-N 3.49Å; V492-S495 PolarHBondContact O-N 3.44Å; V492-S495 PolarHBondContact O-OG 2.88Å; V492-Y496 WeakPolarHBondContact O-CB 3.37Å; V492-Y496 PolarHBondContact O-N 3.46Å
493	S	81.8	Confident	80.4	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-41.2	178.1	-64.9	0	0	0	0	113.6	V475 Q489 Y496 L497 F512	V475-S493 WeakPolarHBondContact CG1-OG 3.44Å; Q489-S493 WeakPolarHBondContact O-CB 3.43Å; Q489-S493 PolarHBondContact O-N 3.24Å; Q489-S493 PolarHBondContact O-OG 2.88Å; S493-Y496 PolarHBondContact O-N 2.85Å; S493-L497 WeakPolarHBondContact O-CB 3.49Å; S493-L497 PolarHBondContact O-N 2.71Å; S493-F512 WeakPolarHBondContact O-CE1 3.33Å
494	L	80.6	Confident	79.6	Confident	5 Å²	5	32.9 Å²	32.9	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-71.3	-36.4	177.6	-81.1	160.5	0	0	0	112.7	N490 F491 V492 Y496 L497 C498 M520 L521	N490-L494 VanDerWaalsContact O-CB 3.27Å; N490-L494 WeakPolarHBondContact O-CB 3.43Å; N490-L494 WeakPolarHBondContact O-CD1 3.34Å; N490-L494 WeakPolarHBondContact O-CG 3.2Å; N490-L494 PolarHBondContact O-N 3.35Å; F491-L494 PolarHBondContact O-N 3.49Å; V492-L494 PolarHBondContact O-N 3.49Å; L494-Y496 VanDerWaalsContact C-N 3.28Å; L494-Y496 PolarHBondContact O-N 3.45Å; L494-L497 HydrophobicContact CD2-CD2 4.5Å; L494-L497 PolarHBondContact O-N 3.21Å; L494-C498 WeakPolarHBondContact O-CB 3.3Å; L494-C498 PolarHBondContact O-N 3.5Å; L494-C498 PolarHBondContact O-SG 3.4Å; L494-M520 HydrophobicContact CD2-CG 4.15Å; L494-L521 HydrophobicContact CD1-CB 3.72Å; L494-L521 HydrophobicContact CD1-CD1 4.17Å; L494-L521 HydrophobicContact CD1-CG 4.04Å
495	S	81.4	Confident	79.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-36.3	173.6	68.1	0	0	0	0	111.8	M462 A463 W467 F491 V492 H499	M462-S495 VanDerWaalsContact CB-CB 3.42Å; A463-S495 WeakPolarHBondContact CB-O 3.42Å; W467-S495 PolarHBondContact NE1-OG 3.09Å; F491-S495 WeakPolarHBondContact O-CB 3.29Å; F491-S495 PolarHBondContact O-N 3.09Å; F491-S495 PolarHBondContact O-OG 3.1Å; V492-S495 PolarHBondContact O-N 3.44Å; V492-S495 PolarHBondContact O-OG 2.88Å; S495-H499 WeakPolarHBondContact O-CB 3.23Å; S495-H499 PolarHBondContact O-N 3.22Å
496	Y	84.8	Confident	79.2	Confident	65 Å²	65	30.7 Å²	30.7	26%	0.255	15%	0.153	S	C	.	.	H	α-helix	trans	-72.1	-41.2	175.7	-169	-98.2	0	0	0	112	W467 V475 V492 S493 L494 C498 H499 L500 F512	W467-Y496 HydrophobicContact CD2-CD2 4.11Å; W467-Y496 HydrophobicContact CE3-CD2 4.15Å; W467-Y496 HydrophobicContact CZ3-CD2 4.38Å; V475-Y496 VanDerWaalsContact CG2-CB 3.45Å; V475-Y496 HydrophobicContact CG2-CD1 3.82Å; V475-Y496 HydrophobicContact CG2-CD2 4.02Å; V475-Y496 HydrophobicContact CG2-CG 3.48Å; V475-Y496 VanDerWaalsContact CG2-CG 3.48Å; V492-Y496 WeakPolarHBondContact O-CB 3.37Å; V492-Y496 PolarHBondContact O-N 3.46Å; S493-Y496 PolarHBondContact O-N 2.85Å; L494-Y496 VanDerWaalsContact C-N 3.28Å; L494-Y496 PolarHBondContact O-N 3.45Å; Y496-C498 VanDerWaalsContact C-N 3.34Å; Y496-C498 PolarHBondContact O-N 2.95Å; Y496-H499 WeakPolarHBondContact O-CB 3.32Å; Y496-H499 PolarHBondContact O-N 3.39Å; Y496-L500 HydrophobicContact CD1-CD1 3.85Å; Y496-L500 HydrophobicContact CD1-CG 4.08Å; Y496-L500 HydrophobicContact CE1-CD1 3.69Å; Y496-L500 HydrophobicContact CE1-CD2 4.14Å; Y496-L500 HydrophobicContact CE1-CG 3.9Å; Y496-L500 WeakPolarHBondContact O-CG 3.15Å; Y496-L500 PolarHBondContact O-N 3.39Å; Y496-F512 AromaticContact CD1-CD2 3.73Å; Y496-F512 HydrophobicContact CD1-CD2 3.73Å; Y496-F512 HydrophobicContact CD1-CE1 4.24Å; Y496-F512 AromaticContact CD1-CE2 3.3Å; Y496-F512 HydrophobicContact CD1-CE2 3.3Å; Y496-F512 HydrophobicContact CD1-CG 4.35Å; Y496-F512 AromaticContact CD1-CZ 3.59Å; Y496-F512 HydrophobicContact CD1-CZ 3.59Å; Y496-F512 AromaticContact CE1-CD2 3.76Å; Y496-F512 HydrophobicContact CE1-CD2 3.76Å; Y496-F512 AromaticContact CE1-CE2 3.66Å; Y496-F512 HydrophobicContact CE1-CE2 3.66Å; Y496-F512 HydrophobicContact CE1-CZ 4.39Å; Y496-F512 HydrophobicContact CG-CE2 4.38Å; Y496-F512 HydrophobicContact CG-CZ 4.39Å
497	L	84.5	Confident	79.3	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-41.7	171.6	179.8	63.6	0	0	0	111.8	S493 L494 H499 L500 M501 A509 F512 A513 L550 M553	S493-L497 WeakPolarHBondContact O-CB 3.49Å; S493-L497 PolarHBondContact O-N 2.71Å; L494-L497 HydrophobicContact CD2-CD2 4.5Å; L494-L497 PolarHBondContact O-N 3.21Å; L497-H499 VanDerWaalsContact C-N 3.33Å; L497-H499 PolarHBondContact O-N 2.84Å; L497-L500 PolarHBondContact O-N 3.47Å; L497-M501 HydrophobicContact CD1-CG 4.46Å; L497-M501 HydrophobicContact CG-CE 3.9Å; L497-M501 HydrophobicContact CG-SD 4.48Å; L497-M501 WeakPolarHBondContact O-CE 3.44Å; L497-M501 WeakPolarHBondContact O-CG 3.3Å; L497-M501 PolarHBondContact O-N 2.95Å; L497-A509 HydrophobicContact CD1-CB 4.34Å; L497-F512 HydrophobicContact CB-CD1 4.02Å; L497-F512 HydrophobicContact CB-CE1 3.98Å; L497-F512 HydrophobicContact CD1-CD1 4.04Å; L497-A513 HydrophobicContact CD1-CB 4.47Å; L497-L550 HydrophobicContact CD2-CD2 3.99Å; L497-M553 HydrophobicContact CD2-CE 4.49Å
498	C	82.9	Confident	79.4	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-63.2	-37.9	173.8	-72.9	0	0	0	0	112.4	A463 L494 Y496 K502 K525 C529	A463-C498 HydrophobicContact CB-CB 3.74Å; L494-C498 WeakPolarHBondContact O-CB 3.3Å; L494-C498 PolarHBondContact O-N 3.5Å; L494-C498 PolarHBondContact O-SG 3.4Å; Y496-C498 VanDerWaalsContact C-N 3.34Å; Y496-C498 PolarHBondContact O-N 2.95Å; C498-K502 VanDerWaalsContact O-CB 3.29Å; C498-K502 WeakPolarHBondContact O-CB 3.48Å; C498-K502 PolarHBondContact O-N 3.27Å; C498-K525 HydrophobicContact CB-CG 4.46Å; C498-C529 PolarHBondContact O-SG 3.11Å
499	H	81.7	Confident	79.5	Confident	18 Å²	18	25.7 Å²	25.7	8%	0.083	13%	0.13	C	C	.	.	H	α-helix	trans	-64.3	-49.6	173.5	172.7	87.3	0	0	0	110.9	A463 W467 S468 S495 Y496 L497 M501 K502 N503	A463-H499 PolarHBondContact O-ND1 3.3Å; W467-H499 HydrophobicContact CB-CB 4.44Å; S468-H499 PolarHBondContact OG-CE1 3.17Å; S468-H499 PolarHBondContact OG-ND1 2.66Å; S495-H499 WeakPolarHBondContact O-CB 3.23Å; S495-H499 PolarHBondContact O-N 3.22Å; Y496-H499 WeakPolarHBondContact O-CB 3.32Å; Y496-H499 PolarHBondContact O-N 3.39Å; L497-H499 VanDerWaalsContact C-N 3.33Å; L497-H499 PolarHBondContact O-N 2.84Å; H499-M501 PolarHBondContact O-N 3.45Å; H499-K502 PolarHBondContact O-N 2.92Å; H499-N503 PolarHBondContact CE1-ND2 3.02Å; H499-N503 VanDerWaalsContact CE1-ND2 3.29Å; H499-N503 PolarHBondContact ND1-ND2 3.33Å; H499-N503 PolarHBondContact O-N 2.78Å
500	L	83.4	Confident	79.7	Confident	16 Å²	16	21 Å²	21	8%	0.084	11%	0.109	C	C	.	.	H	α-helix	trans	-54.6	-52.2	174.6	-71.3	176.5	0	0	0	111.8	Y496 L497 K502 N503 A504 A509 F512	Y496-L500 HydrophobicContact CD1-CD1 3.85Å; Y496-L500 HydrophobicContact CD1-CG 4.08Å; Y496-L500 HydrophobicContact CE1-CD1 3.69Å; Y496-L500 HydrophobicContact CE1-CD2 4.14Å; Y496-L500 HydrophobicContact CE1-CG 3.9Å; Y496-L500 WeakPolarHBondContact O-CG 3.15Å; Y496-L500 PolarHBondContact O-N 3.39Å; L497-L500 PolarHBondContact O-N 3.47Å; L500-K502 PolarHBondContact O-N 3.09Å; L500-K502 VanDerWaalsContact O-N 3.09Å; L500-N503 PolarHBondContact O-N 3.45Å; L500-A504 HydrophobicContact CD2-CB 4.04Å; L500-A504 WeakPolarHBondContact O-CA 3.37Å; L500-A504 WeakPolarHBondContact O-CB 3.48Å; L500-A504 PolarHBondContact O-N 3.2Å; L500-A509 HydrophobicContact CB-CB 4.42Å; L500-F512 HydrophobicContact CD1-CB 3.46Å; L500-F512 VanDerWaalsContact CD1-CB 3.46Å; L500-F512 HydrophobicContact CD1-CD1 4.2Å; L500-F512 HydrophobicContact CD1-CD2 4.02Å; L500-F512 HydrophobicContact CD1-CG 3.63Å
501	M	82	Confident	80	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-18.3	178.3	-69.9	-178.6	-62	0	0	114	L497 H499 A509 V526 C529 L530 L546 L550	L497-M501 HydrophobicContact CD1-CG 4.46Å; L497-M501 HydrophobicContact CG-CE 3.9Å; L497-M501 HydrophobicContact CG-SD 4.48Å; L497-M501 WeakPolarHBondContact O-CE 3.44Å; L497-M501 WeakPolarHBondContact O-CG 3.3Å; L497-M501 PolarHBondContact O-N 2.95Å; H499-M501 PolarHBondContact O-N 3.45Å; M501-A509 HydrophobicContact CG-CB 3.75Å; M501-V526 HydrophobicContact CE-CB 4.12Å; M501-V526 HydrophobicContact CE-CG1 3.72Å; M501-V526 HydrophobicContact CE-CG2 3.94Å; M501-V526 HydrophobicContact SD-CG1 4.21Å; M501-C529 HydrophobicContact CB-CB 3.55Å; M501-C529 HydrophobicContact CE-CB 4.14Å; M501-L530 HydrophobicContact SD-CD2 3.84Å; M501-L530 HydrophobicContact SD-CG 3.95Å; M501-L546 HydrophobicContact CG-CD2 4.07Å; M501-L546 HydrophobicContact SD-CD2 4.1Å; M501-L550 HydrophobicContact SD-CD1 4.23Å
502	K	77	Confident	80.1	Confident	15 Å²	15	21.4 Å²	21.4	7%	0.065	11%	0.109	C	C	.	.	H	α-helix	trans	-96.8	-24.7	-178.3	-160.8	-173	-172.5	-170.6	0	113.4	D464 C498 H499 L500 C529 R536 K1294	D464-K502 WeakPolarHBondContact OD1-CD 3.42Å; D464-K502 WeakPolarHBondContact OD1-CE 3.4Å; D464-K502 IonicContact OD1-NZ 3.98Å; D464-K502 PolarHBondContact OD1-NZ 3.06Å; D464-K502 IonicContact OD2-NZ 2.74Å; D464-K502 PolarHBondContact OD2-NZ 2.92Å; C498-K502 VanDerWaalsContact O-CB 3.29Å; C498-K502 WeakPolarHBondContact O-CB 3.48Å; C498-K502 PolarHBondContact O-N 3.27Å; H499-K502 PolarHBondContact O-N 2.92Å; L500-K502 PolarHBondContact O-N 3.09Å; L500-K502 VanDerWaalsContact O-N 3.09Å; K502-C529 HydrophobicContact CB-CB 4.45Å; K502-R536 PolarHBondContact O-NH1 3.41Å; K502-K1294 HydrophobicContact CD-CD 4.37Å
503	N	71.1	Confident	80.1	Confident	27 Å²	27	21.4 Å²	21.4	14%	0.144	11%	0.109	C	C	.	.	H	α-helix	trans	-122.3	-36.7	-171.9	-67.7	-9.9	0	0	0	113.4	S468 H499 L500 E1219 K1294	S468-N503 PolarHBondContact OG-ND2 3.5Å; H499-N503 PolarHBondContact CE1-ND2 3.02Å; H499-N503 VanDerWaalsContact CE1-ND2 3.29Å; H499-N503 PolarHBondContact ND1-ND2 3.33Å; H499-N503 PolarHBondContact O-N 2.78Å; L500-N503 PolarHBondContact O-N 3.45Å; N503-E1219 WeakPolarHBondContact CB-OE1 3.25Å; N503-K1294 PolarHBondContact OD1-NZ 3.31Å
504	A	66.1	Low	80.1	Confident	9 Å²	9	25.4 Å²	25.4	7%	0.074	13%	0.13	C	C	.	.	S	Bend	trans	-99.8	179.1	-177.2	0	0	0	0	0	114.3	L500 E1255	L500-A504 HydrophobicContact CD2-CB 4.04Å; L500-A504 WeakPolarHBondContact O-CA 3.37Å; L500-A504 WeakPolarHBondContact O-CB 3.48Å; L500-A504 PolarHBondContact O-N 3.2Å; A504-E1255 VanDerWaalsContact CA-OE2 3.26Å; A504-E1255 WeakPolarHBondContact CA-OE2 3.35Å
505	D	69.7	Low	80.1	Confident	27 Å²	27	32.2 Å²	32.2	14%	0.144	16%	0.16	C	C	.	.			trans	-73.1	166.2	174.5	69.7	-5.1	0	0	0	115	N507 S508 A509 E1255	D505-N507 PolarHBondContact O-N 3.05Å; D505-N507 PolarHBondContact OD1-N 2.82Å; D505-N507 VanDerWaalsContact OD2-CB 3.26Å; D505-N507 WeakPolarHBondContact OD2-CB 3.39Å; D505-N507 PolarHBondContact OD2-ND2 3.25Å; D505-S508 PolarHBondContact O-N 3.29Å; D505-S508 WeakPolarHBondContact OD1-CA 3.18Å; D505-S508 WeakPolarHBondContact OD1-CB 3.43Å; D505-S508 PolarHBondContact OD1-N 2.69Å; D505-S508 PolarHBondContact OD1-OG 2.7Å; D505-A509 PolarHBondContact O-N 3.18Å; D505-E1255 HydrophobicContact CB-CG 3.63Å; D505-E1255 WeakPolarHBondContact CB-OE1 3.45Å; D505-E1255 PolarHBondContact N-OE1 3.48Å; D505-E1255 PolarHBondContact N-OE2 3.23Å
506	A	77	Confident	79.6	Confident	1 Å²	1	34 Å²	34	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-28.2	174.6	0	0	0	0	0	112.1	L510 L533 D537 V542 T543	A506-L510 WeakPolarHBondContact O-CB 3.46Å; A506-L510 PolarHBondContact O-N 3.46Å; A506-L533 HydrophobicContact CB-CD1 4.11Å; A506-L533 HydrophobicContact CB-CD2 3.91Å; A506-L533 HydrophobicContact CB-CG 4.22Å; A506-D537 WeakPolarHBondContact CB-OD2 3.45Å; A506-V542 HydrophobicContact CB-CB 4.12Å; A506-V542 HydrophobicContact CB-CG1 3.6Å; A506-T543 WeakPolarHBondContact CB-OG1 3.17Å
507	N	81.9	Confident	78.6	Confident	58 Å²	58	39.9 Å²	39.9	31%	0.31	20%	0.196	S	C	.	.	H	α-helix	trans	-68	-45	177	-55.3	-74	0	0	0	111.6	D505 L510 E511 V542	D505-N507 PolarHBondContact O-N 3.05Å; D505-N507 PolarHBondContact OD1-N 2.82Å; D505-N507 VanDerWaalsContact OD2-CB 3.26Å; D505-N507 WeakPolarHBondContact OD2-CB 3.39Å; D505-N507 PolarHBondContact OD2-ND2 3.25Å; N507-L510 CarbonylContact O-C 3.28Å; N507-L510 PolarHBondContact O-N 2.79Å; N507-E511 WeakPolarHBondContact O-CB 3.42Å; N507-E511 PolarHBondContact O-N 3.13Å; N507-V542 WeakPolarHBondContact OD1-CG1 3.36Å
508	S	81.1	Confident	77.7	Confident	46 Å²	46	40.5 Å²	40.5	32%	0.322	20%	0.201	S	C	.	.	H	α-helix	trans	-66.2	-41.2	-179.1	-62.3	0	0	0	0	111.4	D505 F512	D505-S508 PolarHBondContact O-N 3.29Å; D505-S508 WeakPolarHBondContact OD1-CA 3.18Å; D505-S508 WeakPolarHBondContact OD1-CB 3.43Å; D505-S508 PolarHBondContact OD1-N 2.69Å; D505-S508 PolarHBondContact OD1-OG 2.7Å; S508-F512 WeakPolarHBondContact O-CB 3.38Å; S508-F512 PolarHBondContact O-N 3.18Å
509	A	83.1	Confident	76.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-43.8	171	0	0	0	0	0	111.9	L497 L500 M501 D505 F512 A513 L546	L497-A509 HydrophobicContact CD1-CB 4.34Å; L500-A509 HydrophobicContact CB-CB 4.42Å; M501-A509 HydrophobicContact CG-CB 3.75Å; D505-A509 PolarHBondContact O-N 3.18Å; A509-F512 PolarHBondContact O-N 2.86Å; A509-A513 VanDerWaalsContact O-CB 3.29Å; A509-A513 WeakPolarHBondContact O-CB 3.37Å; A509-A513 PolarHBondContact O-N 2.78Å; A509-L546 HydrophobicContact CB-CD1 4.23Å; A509-L546 HydrophobicContact CB-CD2 3.69Å
510	L	83.2	Confident	75.9	Confident	29 Å²	29	41.9 Å²	41.9	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-43	177.4	175.8	60.3	0	0	0	112.4	A506 N507 A513 N514 V542 A545 L546 R549	A506-L510 WeakPolarHBondContact O-CB 3.46Å; A506-L510 PolarHBondContact O-N 3.46Å; N507-L510 CarbonylContact O-C 3.28Å; N507-L510 PolarHBondContact O-N 2.79Å; L510-A513 PolarHBondContact O-N 3.38Å; L510-N514 VanDerWaalsContact O-CB 3.3Å; L510-N514 WeakPolarHBondContact O-CB 3.48Å; L510-N514 PolarHBondContact O-N 3.23Å; L510-N514 PolarHBondContact O-ND2 3.5Å; L510-V542 HydrophobicContact CD2-CG1 4.35Å; L510-A545 HydrophobicContact CD2-CB 3.87Å; L510-L546 HydrophobicContact CB-CB 4.42Å; L510-L546 HydrophobicContact CB-CD1 4.38Å; L510-R549 HydrophobicContact CD1-CB 3.86Å; L510-R549 HydrophobicContact CD1-CG 4.31Å
511	E	82.9	Confident	74.6	Confident	98 Å²	98	47 Å²	47	46%	0.458	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-44.1	174.8	-82.8	-159.9	-150.6	0	0	111.7	N507 N514 K515	N507-E511 WeakPolarHBondContact O-CB 3.42Å; N507-E511 PolarHBondContact O-N 3.13Å; E511-N514 PolarHBondContact O-N 3.4Å; E511-K515 WeakPolarHBondContact O-CB 3.44Å; E511-K515 VanDerWaalsContact O-CG 3.26Å; E511-K515 WeakPolarHBondContact O-CG 3.3Å; E511-K515 PolarHBondContact O-N 2.79Å; E511-K515 IonicContact OE2-NZ 3.9Å; E511-K515 PolarHBondContact OE2-NZ 2.84Å
512	F	84	Confident	73.7	Confident	29 Å²	29	48.7 Å²	48.7	13%	0.127	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-40.7	176.4	-174.1	-90.5	0	0	0	111.6	V475 S493 Y496 L497 L500 S508 A509 N514 K515 N516	V475-F512 HydrophobicContact CG2-CE2 4.17Å; V475-F512 HydrophobicContact CG2-CZ 4.05Å; S493-F512 WeakPolarHBondContact O-CE1 3.33Å; Y496-F512 AromaticContact CD1-CD2 3.73Å; Y496-F512 HydrophobicContact CD1-CD2 3.73Å; Y496-F512 HydrophobicContact CD1-CE1 4.24Å; Y496-F512 AromaticContact CD1-CE2 3.3Å; Y496-F512 HydrophobicContact CD1-CE2 3.3Å; Y496-F512 HydrophobicContact CD1-CG 4.35Å; Y496-F512 AromaticContact CD1-CZ 3.59Å; Y496-F512 HydrophobicContact CD1-CZ 3.59Å; Y496-F512 AromaticContact CE1-CD2 3.76Å; Y496-F512 HydrophobicContact CE1-CD2 3.76Å; Y496-F512 AromaticContact CE1-CE2 3.66Å; Y496-F512 HydrophobicContact CE1-CE2 3.66Å; Y496-F512 HydrophobicContact CE1-CZ 4.39Å; Y496-F512 HydrophobicContact CG-CE2 4.38Å; Y496-F512 HydrophobicContact CG-CZ 4.39Å; L497-F512 HydrophobicContact CB-CD1 4.02Å; L497-F512 HydrophobicContact CB-CE1 3.98Å; L497-F512 HydrophobicContact CD1-CD1 4.04Å; L500-F512 HydrophobicContact CD1-CB 3.46Å; L500-F512 VanDerWaalsContact CD1-CB 3.46Å; L500-F512 HydrophobicContact CD1-CD1 4.2Å; L500-F512 HydrophobicContact CD1-CD2 4.02Å; L500-F512 HydrophobicContact CD1-CG 3.63Å; S508-F512 WeakPolarHBondContact O-CB 3.38Å; S508-F512 PolarHBondContact O-N 3.18Å; A509-F512 PolarHBondContact O-N 2.86Å; F512-N514 VanDerWaalsContact C-N 3.34Å; F512-K515 PolarHBondContact O-N 3.47Å; F512-N516 WeakPolarHBondContact CD2-ND2 3.04Å; F512-N516 HydrophobicContact CE1-CB 4.31Å; F512-N516 WeakPolarHBondContact CE1-ND2 3.18Å; F512-N516 WeakPolarHBondContact CE2-ND2 3.39Å; F512-N516 WeakPolarHBondContact CZ-ND2 3.45Å; F512-N516 WeakPolarHBondContact O-CB 3.5Å; F512-N516 PolarHBondContact O-N 3.34Å; F512-N516 PolarHBondContact O-ND2 2.8Å
513	A	82.1	Confident	73.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-29.1	175.2	0	0	0	0	0	113.2	L497 A509 L510 L546 R549 M553	L497-A513 HydrophobicContact CD1-CB 4.47Å; A509-A513 VanDerWaalsContact O-CB 3.29Å; A509-A513 WeakPolarHBondContact O-CB 3.37Å; A509-A513 PolarHBondContact O-N 2.78Å; L510-A513 PolarHBondContact O-N 3.38Å; A513-L546 HydrophobicContact CB-CD1 4.14Å; A513-R549 HydrophobicContact CB-CG 3.75Å; A513-R549 VanDerWaalsContact O-CZ 3.32Å; A513-R549 PolarHBondContact O-NE 3.33Å; A513-R549 PolarHBondContact O-NH2 3.19Å; A513-M553 HydrophobicContact CB-SD 3.91Å
514	N	82.7	Confident	73.1	Confident	86 Å²	86	51.2 Å²	51.2	46%	0.46	28%	0.277	S	S	.	.	H	α-helix	trans	-74.5	-40.2	173.1	-74.6	-22.4	0	0	0	111.7	L510 E511 F512 R549	L510-N514 VanDerWaalsContact O-CB 3.3Å; L510-N514 WeakPolarHBondContact O-CB 3.48Å; L510-N514 PolarHBondContact O-N 3.23Å; L510-N514 PolarHBondContact O-ND2 3.5Å; E511-N514 PolarHBondContact O-N 3.4Å; F512-N514 VanDerWaalsContact C-N 3.34Å; N514-R549 VanDerWaalsContact OD1-CD 3.24Å; N514-R549 WeakPolarHBondContact OD1-CD 3.38Å; N514-R549 WeakPolarHBondContact OD1-CG 3.12Å; N514-R549 PolarHBondContact OD1-NE 2.94Å
515	K	78.7	Confident	73.3	Confident	148 Å²	148	51.9 Å²	51.9	64%	0.643	28%	0.278	S	S	*	.	H	α-helix	trans	-71.3	-41.4	176.6	-69.7	165.3	-169.2	163.4	0	111.9	E511 F512	E511-K515 WeakPolarHBondContact O-CB 3.44Å; E511-K515 VanDerWaalsContact O-CG 3.26Å; E511-K515 WeakPolarHBondContact O-CG 3.3Å; E511-K515 PolarHBondContact O-N 2.79Å; E511-K515 IonicContact OE2-NZ 3.9Å; E511-K515 PolarHBondContact OE2-NZ 2.84Å; F512-K515 PolarHBondContact O-N 3.47Å
516	N	71.4	Confident	73.6	Confident	38 Å²	38	50.6 Å²	50.6	20%	0.203	27%	0.271	C	S	.	.			trans	-92.8	114.5	179.5	-76.6	-72.3	0	0	0	112.6	F512 S518	F512-N516 WeakPolarHBondContact CD2-ND2 3.04Å; F512-N516 HydrophobicContact CE1-CB 4.31Å; F512-N516 WeakPolarHBondContact CE1-ND2 3.18Å; F512-N516 WeakPolarHBondContact CE2-ND2 3.39Å; F512-N516 WeakPolarHBondContact CZ-ND2 3.45Å; F512-N516 WeakPolarHBondContact O-CB 3.5Å; F512-N516 PolarHBondContact O-N 3.34Å; F512-N516 PolarHBondContact O-ND2 2.8Å; N516-S518 PolarHBondContact O-N 3.34Å
517	K	64.8	Low	73.6	Confident	188 Å²	188	50.6 Å²	50.6	82%	0.817	27%	0.272	S	S	*	.			trans	-85.2	16.6	172.5	-58.9	-178.8	-178.8	179.4	0	113.3
518	S	65.4	Low	73.3	Confident	16 Å²	16	52 Å²	52	11%	0.112	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-71.5	132.2	-178.1	52.7	0	0	0	0	111.3	N516 M553	N516-S518 PolarHBondContact O-N 3.34Å; S518-M553 WeakPolarHBondContact O-CE 3.33Å
519	P	62.9	Low	73.2	Confident	31 Å²	31	49.8 Å²	49.8	20%	0.201	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-67.3	148.2	-180	28.8	-35.5	0	0	0	112.2	L521 Q555	P519-L521 PolarHBondContact O-N 2.77Å; P519-Q555 HydrophobicContact CB-CG 3.99Å
520	M	63.1	Low	73.2	Confident	18 Å²	18	49.8 Å²	49.8	9%	0.089	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-74.9	122.3	175.9	-77.6	175.9	60.2	0	0	111.7	L494 V526 L550 M553 L554	L494-M520 HydrophobicContact CD2-CG 4.15Å; M520-V526 HydrophobicContact CE-CB 4.08Å; M520-V526 HydrophobicContact CE-CG1 3.69Å; M520-V526 HydrophobicContact CE-CG2 4.16Å; M520-L550 HydrophobicContact SD-CB 3.94Å; M520-L550 HydrophobicContact SD-CD2 3.62Å; M520-L550 HydrophobicContact SD-CG 4.33Å; M520-M553 HydrophobicContact CG-CB 3.83Å; M520-M553 HydrophobicContact CG-CE 4.49Å; M520-M553 PolarHBondContact N-O 3.5Å; M520-M553 HydrophobicContact SD-CB 3.97Å; M520-L554 HydrophobicContact CB-CD2 4.44Å; M520-L554 HydrophobicContact CE-CD2 4.01Å; M520-L554 HydrophobicContact SD-CD2 4.24Å
521	L	56.3	Low	73	Confident	124 Å²	124	49.3 Å²	49.3	65%	0.649	26%	0.258	S	S	*	.			trans	-102.1	-7.5	177.8	-65.9	167.9	0	0	0	113.9	N490 L494 P519	N490-L521 HydrophobicContact CB-CD1 3.75Å; L494-L521 HydrophobicContact CD1-CB 3.72Å; L494-L521 HydrophobicContact CD1-CD1 4.17Å; L494-L521 HydrophobicContact CD1-CG 4.04Å; P519-L521 PolarHBondContact O-N 2.77Å
522	S	62.3	Low	72.8	Confident	35 Å²	35	46.8 Å²	46.8	25%	0.245	25%	0.25	C	C	.	.			trans	-147.4	107.5	-172.6	154	0	0	0	0	110.8	V526	S522-V526 WeakPolarHBondContact O-CG2 3.36Å
523	V	66.6	Low	72.6	Confident	39 Å²	39	45.6 Å²	45.6	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-78.8	-47.2	176.3	-175.9	0	0	0	0	111.6	K525 V526 T527 L554 P558 F563	V523-K525 PolarHBondContact O-N 3.25Å; V523-V526 CarbonylContact O-C 2.92Å; V523-V526 WeakPolarHBondContact O-CA 3.45Å; V523-V526 WeakPolarHBondContact O-CB 3.32Å; V523-V526 PolarHBondContact O-N 2.47Å; V523-T527 PolarHBondContact O-N 2.73Å; V523-T527 PolarHBondContact O-OG1 3.1Å; V523-T527 VanDerWaalsContact O-OG1 3.12Å; V523-L554 HydrophobicContact CG2-CD2 4.24Å; V523-P558 HydrophobicContact CG1-CG 4.18Å; V523-P558 HydrophobicContact CG2-CG 4.16Å; V523-F563 HydrophobicContact CG1-CD2 3.52Å; V523-F563 HydrophobicContact CG1-CE2 3.6Å
524	G	69.6	Low	72.5	Confident	55 Å²	55	45.7 Å²	45.7	57%	0.567	25%	0.245	S	C	*	.	H	α-helix	trans	-56.9	-47.2	-168	0	0	0	0	0	115.8	T527 E528	G524-T527 PolarHBondContact O-N 2.89Å; G524-E528 PolarHBondContact O-N 2.92Å; G524-E528 VanDerWaalsContact O-N 3.13Å
525	K	69.9	Low	72	Confident	23 Å²	23	43.7 Å²	43.7	10%	0.1	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-30.5	177.1	-169.5	56.2	166.4	-173.8	0	112.3	D464 C498 V523 E528 C529	D464-K525 VanDerWaalsContact CG-NZ 3.32Å; D464-K525 WeakPolarHBondContact OD1-CE 3.48Å; D464-K525 IonicContact OD1-NZ 3.16Å; D464-K525 PolarHBondContact OD1-NZ 2.89Å; D464-K525 VanDerWaalsContact OD1-NZ 3.07Å; D464-K525 WeakPolarHBondContact OD2-CE 3.23Å; D464-K525 IonicContact OD2-NZ 2.65Å; D464-K525 PolarHBondContact OD2-NZ 3.03Å; C498-K525 HydrophobicContact CB-CG 4.46Å; V523-K525 PolarHBondContact O-N 3.25Å; K525-E528 HydrophobicContact CD-CB 4.31Å; K525-E528 WeakPolarHBondContact CD-OE2 3.48Å; K525-E528 IonicContact NZ-OE1 2.69Å; K525-E528 PolarHBondContact NZ-OE1 3.33Å; K525-E528 IonicContact NZ-OE2 3.73Å; K525-E528 PolarHBondContact NZ-OE2 3.44Å; K525-E528 PolarHBondContact O-N 2.89Å; K525-C529 PolarHBondContact O-N 2.9Å; K525-C529 PolarHBondContact O-SG 3.03Å
526	V	77	Confident	71.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.9	-41.7	173.8	170.8	0	0	0	0	110.6	M501 M520 S522 V523 E528 C529 L530 L550 F563	M501-V526 HydrophobicContact CE-CB 4.12Å; M501-V526 HydrophobicContact CE-CG1 3.72Å; M501-V526 HydrophobicContact CE-CG2 3.94Å; M501-V526 HydrophobicContact SD-CG1 4.21Å; M520-V526 HydrophobicContact CE-CB 4.08Å; M520-V526 HydrophobicContact CE-CG1 3.69Å; M520-V526 HydrophobicContact CE-CG2 4.16Å; S522-V526 WeakPolarHBondContact O-CG2 3.36Å; V523-V526 CarbonylContact O-C 2.92Å; V523-V526 WeakPolarHBondContact O-CA 3.45Å; V523-V526 WeakPolarHBondContact O-CB 3.32Å; V523-V526 PolarHBondContact O-N 2.47Å; V526-E528 PolarHBondContact O-N 2.92Å; V526-C529 PolarHBondContact O-N 3.4Å; V526-L530 HydrophobicContact CG1-CD1 4.04Å; V526-L530 HydrophobicContact CG1-CG 4.26Å; V526-L530 WeakPolarHBondContact O-CB 3.41Å; V526-L530 WeakPolarHBondContact O-CG 3.43Å; V526-L530 PolarHBondContact O-N 3.43Å; V526-L550 HydrophobicContact CG1-CD1 4.17Å; V526-F563 HydrophobicContact CG1-CZ 4.44Å
527	T	77.1	Confident	71.4	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-41.8	172.4	-49.1	0	0	0	0	111.9	V523 G524 L530 L531	V523-T527 PolarHBondContact O-N 2.73Å; V523-T527 PolarHBondContact O-OG1 3.1Å; V523-T527 VanDerWaalsContact O-OG1 3.12Å; G524-T527 PolarHBondContact O-N 2.89Å; T527-L530 PolarHBondContact O-N 2.81Å; T527-L531 HydrophobicContact CG2-CD1 4Å; T527-L531 HydrophobicContact CG2-CG 4.46Å; T527-L531 WeakPolarHBondContact O-CB 3.29Å; T527-L531 WeakPolarHBondContact O-CD1 3.4Å; T527-L531 WeakPolarHBondContact O-CG 3.3Å; T527-L531 PolarHBondContact O-N 2.73Å
528	E	76.3	Confident	71.5	Confident	86 Å²	86	38.5 Å²	38.5	40%	0.402	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-46.5	174.9	-170.4	-161.4	131.5	0	0	111.7	G524 K525 V526 T532	G524-E528 PolarHBondContact O-N 2.92Å; G524-E528 VanDerWaalsContact O-N 3.13Å; K525-E528 HydrophobicContact CD-CB 4.31Å; K525-E528 WeakPolarHBondContact CD-OE2 3.48Å; K525-E528 IonicContact NZ-OE1 2.69Å; K525-E528 PolarHBondContact NZ-OE1 3.33Å; K525-E528 IonicContact NZ-OE2 3.73Å; K525-E528 PolarHBondContact NZ-OE2 3.44Å; K525-E528 PolarHBondContact O-N 2.89Å; V526-E528 PolarHBondContact O-N 2.92Å; E528-T532 PolarHBondContact O-N 3.02Å; E528-T532 VanDerWaalsContact O-N 3.11Å; E528-T532 PolarHBondContact O-OG1 3.05Å
529	C	78.2	Confident	71.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.7	-38.9	178.3	-60.9	0	0	0	0	112.2	C498 M501 K502 K525 V526 L531 T532 L533	C498-C529 PolarHBondContact O-SG 3.11Å; M501-C529 HydrophobicContact CB-CB 3.55Å; M501-C529 HydrophobicContact CE-CB 4.14Å; K502-C529 HydrophobicContact CB-CB 4.45Å; K525-C529 PolarHBondContact O-N 2.9Å; K525-C529 PolarHBondContact O-SG 3.03Å; V526-C529 PolarHBondContact O-N 3.4Å; C529-L531 PolarHBondContact O-N 3.48Å; C529-T532 CarbonylContact O-C 3.58Å; C529-T532 WeakPolarHBondContact O-CA 3.37Å; C529-T532 WeakPolarHBondContact O-CB 3.5Å; C529-T532 PolarHBondContact O-N 3.32Å; C529-L533 WeakPolarHBondContact O-CB 3.4Å; C529-L533 PolarHBondContact O-N 2.9Å
530	L	82.1	Confident	72.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-42.2	173.8	-80.9	175.8	0	0	0	112.6	M501 V526 T527 T532 L533 F534 L546 L550 F563 L567	M501-L530 HydrophobicContact SD-CD2 3.84Å; M501-L530 HydrophobicContact SD-CG 3.95Å; V526-L530 HydrophobicContact CG1-CD1 4.04Å; V526-L530 HydrophobicContact CG1-CG 4.26Å; V526-L530 WeakPolarHBondContact O-CB 3.41Å; V526-L530 WeakPolarHBondContact O-CG 3.43Å; V526-L530 PolarHBondContact O-N 3.43Å; T527-L530 PolarHBondContact O-N 2.81Å; L530-T532 VanDerWaalsContact C-N 3.28Å; L530-T532 PolarHBondContact O-N 2.54Å; L530-L533 HydrophobicContact CD2-CD2 4.37Å; L530-L533 CarbonylContact O-C 3.13Å; L530-L533 WeakPolarHBondContact O-CA 3.45Å; L530-L533 WeakPolarHBondContact O-CB 3.29Å; L530-L533 PolarHBondContact O-N 3.46Å; L530-L533 VanDerWaalsContact O-N 3.07Å; L530-F534 WeakPolarHBondContact O-CD2 3.29Å; L530-F534 PolarHBondContact O-N 3.16Å; L530-L546 HydrophobicContact CD2-CD2 3.82Å; L530-L546 HydrophobicContact CD2-CG 4.31Å; L530-L550 HydrophobicContact CD1-CD1 3.74Å; L530-L550 HydrophobicContact CD2-CD1 3.8Å; L530-L550 HydrophobicContact CG-CD1 4.09Å; L530-F563 HydrophobicContact CD1-CE1 4.16Å; L530-F563 HydrophobicContact CD1-CE2 4.42Å; L530-F563 HydrophobicContact CD1-CZ 3.52Å; L530-L567 HydrophobicContact CB-CD1 4.49Å
531	L	80.3	Confident	73.3	Confident	19 Å²	19	44.5 Å²	44.5	10%	0.099	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-35.9	175.4	-69.4	162.9	0	0	0	111.7	T527 C529 L533 G535 L567 R570 L571 M574	T527-L531 HydrophobicContact CG2-CD1 4Å; T527-L531 HydrophobicContact CG2-CG 4.46Å; T527-L531 WeakPolarHBondContact O-CB 3.29Å; T527-L531 WeakPolarHBondContact O-CD1 3.4Å; T527-L531 WeakPolarHBondContact O-CG 3.3Å; T527-L531 PolarHBondContact O-N 2.73Å; C529-L531 PolarHBondContact O-N 3.48Å; L531-L533 VanDerWaalsContact C-N 3.26Å; L531-L533 PolarHBondContact O-N 2.89Å; L531-G535 PolarHBondContact O-N 3.24Å; L531-L567 HydrophobicContact CD2-CD1 3.83Å; L531-L567 HydrophobicContact CG-CD1 4.25Å; L531-R570 HydrophobicContact CD1-CB 3.96Å; L531-R570 VanDerWaalsContact CD1-CD 3.41Å; L531-R570 HydrophobicContact CD1-CG 4.31Å; L531-R570 HydrophobicContact CD2-CB 3.56Å; L531-R570 HydrophobicContact CG-CB 4.41Å; L531-L571 HydrophobicContact CD2-CD2 3.87Å; L531-L571 HydrophobicContact CD2-CG 4.25Å; L531-M574 HydrophobicContact CB-SD 4.3Å; L531-M574 HydrophobicContact CD2-SD 4.15Å
532	T	77.7	Confident	74.4	Confident	45 Å²	45	39.6 Å²	39.6	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-63.8	-35.2	171.5	-53.1	0	0	0	0	111	E528 C529 L530 R536	E528-T532 PolarHBondContact O-N 3.02Å; E528-T532 VanDerWaalsContact O-N 3.11Å; E528-T532 PolarHBondContact O-OG1 3.05Å; C529-T532 CarbonylContact O-C 3.58Å; C529-T532 WeakPolarHBondContact O-CA 3.37Å; C529-T532 WeakPolarHBondContact O-CB 3.5Å; C529-T532 PolarHBondContact O-N 3.32Å; L530-T532 VanDerWaalsContact C-N 3.28Å; L530-T532 PolarHBondContact O-N 2.54Å; T532-R536 WeakPolarHBondContact O-CB 3.31Å; T532-R536 VanDerWaalsContact O-CD 3.28Å; T532-R536 WeakPolarHBondContact O-CD 3.44Å; T532-R536 WeakPolarHBondContact O-CG 3.29Å; T532-R536 PolarHBondContact O-N 3.3Å
533	L	80.4	Confident	75.2	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-72.2	-52.2	177.2	-172.5	64.8	0	0	0	112.2	A506 C529 L530 L531 G535 R536 D537 T543 L546	A506-L533 HydrophobicContact CB-CD1 4.11Å; A506-L533 HydrophobicContact CB-CD2 3.91Å; A506-L533 HydrophobicContact CB-CG 4.22Å; C529-L533 WeakPolarHBondContact O-CB 3.4Å; C529-L533 PolarHBondContact O-N 2.9Å; L530-L533 HydrophobicContact CD2-CD2 4.37Å; L530-L533 CarbonylContact O-C 3.13Å; L530-L533 WeakPolarHBondContact O-CA 3.45Å; L530-L533 WeakPolarHBondContact O-CB 3.29Å; L530-L533 PolarHBondContact O-N 3.46Å; L530-L533 VanDerWaalsContact O-N 3.07Å; L531-L533 VanDerWaalsContact C-N 3.26Å; L531-L533 PolarHBondContact O-N 2.89Å; L533-G535 VanDerWaalsContact C-N 3.34Å; L533-G535 PolarHBondContact O-N 3.47Å; L533-R536 CarbonylContact O-C 3.6Å; L533-R536 WeakPolarHBondContact O-CA 3.31Å; L533-R536 WeakPolarHBondContact O-CB 3.37Å; L533-R536 PolarHBondContact O-N 3.42Å; L533-D537 WeakPolarHBondContact O-CB 3.03Å; L533-D537 PolarHBondContact O-N 3.45Å; L533-T543 HydrophobicContact CD2-CG2 4.12Å; L533-T543 HydrophobicContact CG-CG2 4.21Å; L533-L546 HydrophobicContact CD2-CD2 3.5Å
534	F	80.1	Confident	76	Confident	2 Å²	2	36 Å²	36	1%	0.009	20%	0.201	C	C	.	.	H	α-helix	trans	-55.2	-47.1	173.1	-86.5	-79.8	0	0	0	111.5	L530 R536 T543 V544 L567 L571 F575 V583	L530-F534 WeakPolarHBondContact O-CD2 3.29Å; L530-F534 PolarHBondContact O-N 3.16Å; F534-R536 PolarHBondContact O-N 2.96Å; F534-T543 HydrophobicContact CD1-CG2 3.72Å; F534-T543 HydrophobicContact CD2-CG2 3.54Å; F534-T543 HydrophobicContact CE1-CG2 3.66Å; F534-T543 HydrophobicContact CE2-CG2 3.46Å; F534-T543 VanDerWaalsContact CE2-CG2 3.46Å; F534-T543 HydrophobicContact CG-CG2 3.66Å; F534-T543 HydrophobicContact CZ-CG2 3.54Å; F534-V544 HydrophobicContact CE1-CG2 4.18Å; F534-V544 HydrophobicContact CZ-CG2 4.27Å; F534-L567 HydrophobicContact CD2-CD1 4.03Å; F534-L567 HydrophobicContact CE2-CD1 3.92Å; F534-L567 HydrophobicContact CE2-CD2 3.7Å; F534-L567 HydrophobicContact CE2-CG 4.2Å; F534-L567 HydrophobicContact CZ-CD2 4.15Å; F534-L571 HydrophobicContact CB-CD2 3.45Å; F534-L571 VanDerWaalsContact CB-CD2 3.45Å; F534-L571 HydrophobicContact CD1-CD1 3.83Å; F534-L571 HydrophobicContact CD1-CD2 4.12Å; F534-L571 HydrophobicContact CD2-CD1 4.16Å; F534-L571 HydrophobicContact CD2-CD2 4.1Å; F534-L571 HydrophobicContact CE1-CD1 3.88Å; F534-L571 HydrophobicContact CE2-CD1 4.23Å; F534-L571 HydrophobicContact CG-CD1 3.98Å; F534-L571 HydrophobicContact CG-CD2 3.65Å; F534-L571 HydrophobicContact CG-CG 4.46Å; F534-L571 HydrophobicContact CZ-CD1 4.08Å; F534-F575 HydrophobicContact CB-CE2 4.41Å; F534-F575 HydrophobicContact CB-CZ 4Å; F534-F575 HydrophobicContact CD1-CE2 4.28Å; F534-F575 HydrophobicContact CD1-CZ 4.49Å; F534-F575 WeakPolarHBondContact O-CZ 3Å; F534-V583 HydrophobicContact CD1-CG2 4.46Å; F534-V583 HydrophobicContact CE1-CG1 4.02Å; F534-V583 HydrophobicContact CE1-CG2 4.37Å
535	G	72	Confident	76.7	Confident	45 Å²	45	34 Å²	34	46%	0.464	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-4.9	176.7	0	0	0	0	0	114.8	L531 L533	L531-G535 PolarHBondContact O-N 3.24Å; L533-G535 VanDerWaalsContact C-N 3.34Å; L533-G535 PolarHBondContact O-N 3.47Å
536	R	70.8	Confident	77.4	Confident	78 Å²	78	32.9 Å²	32.9	29%	0.294	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-43	178.2	-80.9	175.2	164.6	-157.6	-3.2	113	K502 T532 L533 F534 R1260	K502-R536 PolarHBondContact O-NH1 3.41Å; T532-R536 WeakPolarHBondContact O-CB 3.31Å; T532-R536 VanDerWaalsContact O-CD 3.28Å; T532-R536 WeakPolarHBondContact O-CD 3.44Å; T532-R536 WeakPolarHBondContact O-CG 3.29Å; T532-R536 PolarHBondContact O-N 3.3Å; L533-R536 CarbonylContact O-C 3.6Å; L533-R536 WeakPolarHBondContact O-CA 3.31Å; L533-R536 WeakPolarHBondContact O-CB 3.37Å; L533-R536 PolarHBondContact O-N 3.42Å; F534-R536 PolarHBondContact O-N 2.96Å; R536-R1260 PolarHBondContact O-NH1 3.45Å
537	D	67	Low	77.7	Confident	38 Å²	38	32.9 Å²	32.9	20%	0.203	17%	0.173	C	C	.	.			trans	-82.2	123.8	-170.3	-168.3	4.2	0	0	0	111.3	A506 L533 N539 H540 T543	A506-D537 WeakPolarHBondContact CB-OD2 3.45Å; L533-D537 WeakPolarHBondContact O-CB 3.03Å; L533-D537 PolarHBondContact O-N 3.45Å; D537-N539 VanDerWaalsContact C-N 3.3Å; D537-N539 PolarHBondContact OD1-N 2.86Å; D537-N539 VanDerWaalsContact OD2-O 3.1Å; D537-H540 PolarHBondContact O-CD2 3.47Å; D537-T543 PolarHBondContact OD2-OG1 3.21Å
538	Q	65.5	Low	78	Confident	148 Å²	148	36.7 Å²	36.7	69%	0.692	19%	0.191	S	C	*	.	S	Bend	trans	-76.6	-22.1	171.4	-70.6	-176.7	-13.3	0	0	111.7	H540	Q538-H540 PolarHBondContact O-N 3.37Å
539	N	71.1	Confident	78.3	Confident	81 Å²	81	35.1 Å²	35.1	43%	0.433	18%	0.181	S	C	.	.			trans	-92.1	77.3	178.8	-167.5	-9.7	0	0	0	111	D537 E541 V542	D537-N539 VanDerWaalsContact C-N 3.3Å; D537-N539 PolarHBondContact OD1-N 2.86Å; D537-N539 VanDerWaalsContact OD2-O 3.1Å; N539-E541 PolarHBondContact O-N 2.81Å; N539-E541 VanDerWaalsContact OD1-CB 3.3Å; N539-E541 WeakPolarHBondContact OD1-CB 3.26Å; N539-E541 PolarHBondContact OD1-N 2.82Å; N539-V542 PolarHBondContact O-N 2.85Å
540	H	77.5	Confident	78.4	Confident	17 Å²	17	35.1 Å²	35.1	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-54.3	-21.5	177.1	-60.2	166.1	0	0	0	113.5	D537 Q538 V544 F575 V583	D537-H540 PolarHBondContact O-CD2 3.47Å; Q538-H540 PolarHBondContact O-N 3.37Å; H540-V544 WeakPolarHBondContact O-CB 3.47Å; H540-V544 WeakPolarHBondContact O-CG2 3.29Å; H540-V544 PolarHBondContact O-N 3.44Å; H540-F575 AromaticContact NE2-CE2 3.99Å; H540-F575 AromaticContact NE2-CZ 3.75Å; H540-V583 HydrophobicContact CB-CG2 4.19Å; H540-V583 VanDerWaalsContact ND1-CG2 3.33Å; H540-V583 WeakPolarHBondContact ND1-CG2 3.45Å
541	E	80.5	Confident	78.2	Confident	93 Å²	93	36.2 Å²	36.2	44%	0.435	19%	0.187	S	C	.	.	H	α-helix	trans	-65.4	-44.1	179.1	-156.4	-152.8	141.6	0	0	112.6	N539 V544 A545 R590	N539-E541 PolarHBondContact O-N 2.81Å; N539-E541 VanDerWaalsContact OD1-CB 3.3Å; N539-E541 WeakPolarHBondContact OD1-CB 3.26Å; N539-E541 PolarHBondContact OD1-N 2.82Å; E541-V544 PolarHBondContact O-N 3.15Å; E541-A545 PolarHBondContact O-N 2.82Å; E541-R590 IonicContact OE1-NH2 3.68Å; E541-R590 PolarHBondContact OE1-NH2 3.17Å
542	V	79.4	Confident	78	Confident	21 Å²	21	39.6 Å²	39.6	13%	0.127	21%	0.209	C	C	.	.	H	α-helix	trans	-71	-40.6	179.8	-177.3	0	0	0	0	110.6	A506 N507 L510 N539 V544 A545 L546	A506-V542 HydrophobicContact CB-CB 4.12Å; A506-V542 HydrophobicContact CB-CG1 3.6Å; N507-V542 WeakPolarHBondContact OD1-CG1 3.36Å; L510-V542 HydrophobicContact CD2-CG1 4.35Å; N539-V542 PolarHBondContact O-N 2.85Å; V542-V544 VanDerWaalsContact C-N 3.29Å; V542-V544 PolarHBondContact O-N 3.12Å; V542-A545 WeakPolarHBondContact O-CA 3.44Å; V542-A545 WeakPolarHBondContact O-CB 3.2Å; V542-A545 PolarHBondContact O-N 3.35Å; V542-A545 VanDerWaalsContact O-N 3.11Å; V542-L546 PolarHBondContact O-N 3.03Å
543	T	80.6	Confident	77.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-34.9	176.2	-64.2	0	0	0	0	111.4	A506 L533 F534 D537 L546 L547	A506-T543 WeakPolarHBondContact CB-OG1 3.17Å; L533-T543 HydrophobicContact CD2-CG2 4.12Å; L533-T543 HydrophobicContact CG-CG2 4.21Å; F534-T543 HydrophobicContact CD1-CG2 3.72Å; F534-T543 HydrophobicContact CD2-CG2 3.54Å; F534-T543 HydrophobicContact CE1-CG2 3.66Å; F534-T543 HydrophobicContact CE2-CG2 3.46Å; F534-T543 VanDerWaalsContact CE2-CG2 3.46Å; F534-T543 HydrophobicContact CG-CG2 3.66Å; F534-T543 HydrophobicContact CZ-CG2 3.54Å; D537-T543 PolarHBondContact OD2-OG1 3.21Å; T543-L546 PolarHBondContact O-N 3.13Å; T543-L547 PolarHBondContact O-N 3.17Å
544	V	82.9	Confident	77.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-72.6	-29.8	171.5	177.4	0	0	0	0	112.1	F534 H540 E541 V542 L547 E548 V583 N586 M587 L592	F534-V544 HydrophobicContact CE1-CG2 4.18Å; F534-V544 HydrophobicContact CZ-CG2 4.27Å; H540-V544 WeakPolarHBondContact O-CB 3.47Å; H540-V544 WeakPolarHBondContact O-CG2 3.29Å; H540-V544 PolarHBondContact O-N 3.44Å; E541-V544 PolarHBondContact O-N 3.15Å; V542-V544 VanDerWaalsContact C-N 3.29Å; V542-V544 PolarHBondContact O-N 3.12Å; V544-L547 WeakPolarHBondContact O-CB 3.49Å; V544-L547 PolarHBondContact O-N 3.39Å; V544-E548 PolarHBondContact O-N 2.89Å; V544-V583 HydrophobicContact CG2-CG1 4.37Å; V544-N586 HydrophobicContact CB-CB 4.38Å; V544-N586 HydrophobicContact CG1-CB 4.44Å; V544-N586 HydrophobicContact CG2-CB 4.17Å; V544-M587 HydrophobicContact CG1-CG 4.08Å; V544-M587 HydrophobicContact CG2-CG 4.22Å; V544-L592 HydrophobicContact CG1-CD1 3.48Å; V544-L592 VanDerWaalsContact CG1-CD1 3.48Å
545	A	84.5	Confident	76.2	Confident	11 Å²	11	46.2 Å²	46.2	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-38.1	170.2	0	0	0	0	0	112.8	L510 E541 V542 L547 E548 R549 R590	L510-A545 HydrophobicContact CD2-CB 3.87Å; E541-A545 PolarHBondContact O-N 2.82Å; V542-A545 WeakPolarHBondContact O-CA 3.44Å; V542-A545 WeakPolarHBondContact O-CB 3.2Å; V542-A545 PolarHBondContact O-N 3.35Å; V542-A545 VanDerWaalsContact O-N 3.11Å; A545-L547 VanDerWaalsContact C-N 3.34Å; A545-E548 WeakPolarHBondContact O-CB 3.26Å; A545-E548 PolarHBondContact O-N 3.11Å; A545-R549 PolarHBondContact O-N 3.27Å; A545-R590 VanDerWaalsContact CB-NH1 3.29Å
546	L	83.5	Confident	75.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-42.3	169.9	176.6	63.3	0	0	0	110.9	M501 A509 L510 A513 L530 L533 V542 T543 E548 R549 L550	M501-L546 HydrophobicContact CG-CD2 4.07Å; M501-L546 HydrophobicContact SD-CD2 4.1Å; A509-L546 HydrophobicContact CB-CD1 4.23Å; A509-L546 HydrophobicContact CB-CD2 3.69Å; L510-L546 HydrophobicContact CB-CB 4.42Å; L510-L546 HydrophobicContact CB-CD1 4.38Å; A513-L546 HydrophobicContact CB-CD1 4.14Å; L530-L546 HydrophobicContact CD2-CD2 3.82Å; L530-L546 HydrophobicContact CD2-CG 4.31Å; L533-L546 HydrophobicContact CD2-CD2 3.5Å; V542-L546 PolarHBondContact O-N 3.03Å; T543-L546 PolarHBondContact O-N 3.13Å; L546-E548 PolarHBondContact O-N 3.23Å; L546-R549 PolarHBondContact O-N 3.18Å; L546-R549 VanDerWaalsContact O-N 3.16Å; L546-L550 HydrophobicContact CD1-CD1 4.12Å; L546-L550 HydrophobicContact CD1-CD2 4.37Å; L546-L550 HydrophobicContact CD1-CG 3.99Å; L546-L550 HydrophobicContact CD2-CD1 4.47Å; L546-L550 HydrophobicContact CG-CD1 3.88Å; L546-L550 HydrophobicContact CG-CG 4.2Å; L546-L550 WeakPolarHBondContact O-CB 3.41Å; L546-L550 VanDerWaalsContact O-CG 3.26Å; L546-L550 WeakPolarHBondContact O-CG 3.32Å; L546-L550 PolarHBondContact O-N 3.01Å
547	L	84.3	Confident	74.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-45.1	175.9	-174.7	61.2	0	0	0	112	T543 V544 A545 R549 L550 N551 F563 N564 L567 M587 L592	T543-L547 PolarHBondContact O-N 3.17Å; V544-L547 WeakPolarHBondContact O-CB 3.49Å; V544-L547 PolarHBondContact O-N 3.39Å; A545-L547 VanDerWaalsContact C-N 3.34Å; L547-R549 PolarHBondContact O-N 2.93Å; L547-L550 PolarHBondContact O-N 3.35Å; L547-N551 WeakPolarHBondContact O-CB 3.45Å; L547-N551 VanDerWaalsContact O-CG 3.25Å; L547-N551 PolarHBondContact O-N 3.08Å; L547-N551 PolarHBondContact O-ND2 3.23Å; L547-N551 VanDerWaalsContact O-ND2 3.11Å; L547-F563 HydrophobicContact CD1-CD1 4.01Å; L547-F563 HydrophobicContact CD1-CE1 3.57Å; L547-F563 HydrophobicContact CD1-CZ 4.47Å; L547-N564 VanDerWaalsContact CD1-OD1 3.3Å; L547-N564 WeakPolarHBondContact CD1-OD1 3.41Å; L547-N564 WeakPolarHBondContact CG-OD1 3.08Å; L547-L567 HydrophobicContact CD1-CD2 3.52Å; L547-L567 HydrophobicContact CD2-CD2 3.53Å; L547-L567 HydrophobicContact CG-CD2 4.15Å; L547-M587 HydrophobicContact CD2-CE 4.34Å; L547-L592 HydrophobicContact CB-CD1 4.46Å; L547-L592 HydrophobicContact CD2-CD1 3.94Å; L547-L592 HydrophobicContact CG-CD1 4.2Å
548	E	83.2	Confident	74	Confident	82 Å²	82	51 Å²	51	38%	0.383	26%	0.261	S	S	.	.	H	α-helix	trans	-55.3	-48	171.8	-172.3	-174.3	163.5	0	0	111.4	V544 A545 L546 N551 T552 R590 L592	V544-E548 PolarHBondContact O-N 2.89Å; A545-E548 WeakPolarHBondContact O-CB 3.26Å; A545-E548 PolarHBondContact O-N 3.11Å; L546-E548 PolarHBondContact O-N 3.23Å; E548-N551 WeakPolarHBondContact O-CB 3.37Å; E548-N551 PolarHBondContact O-N 2.8Å; E548-T552 PolarHBondContact O-N 3.42Å; E548-R590 IonicContact OE2-CZ 3.56Å; E548-R590 IonicContact OE2-NH1 3.74Å; E548-R590 PolarHBondContact OE2-NH1 3Å; E548-L592 HydrophobicContact CB-CD2 4Å; E548-L592 HydrophobicContact CG-CD2 4.12Å
549	R	82.1	Confident	74	Confident	54 Å²	54	46.8 Å²	46.8	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-43.7	178.5	-178.1	58.3	-174.8	145.8	1.2	112.6	L510 A513 N514 A545 L546 L547 N551 T552 M553	L510-R549 HydrophobicContact CD1-CB 3.86Å; L510-R549 HydrophobicContact CD1-CG 4.31Å; A513-R549 HydrophobicContact CB-CG 3.75Å; A513-R549 VanDerWaalsContact O-CZ 3.32Å; A513-R549 PolarHBondContact O-NE 3.33Å; A513-R549 PolarHBondContact O-NH2 3.19Å; N514-R549 VanDerWaalsContact OD1-CD 3.24Å; N514-R549 WeakPolarHBondContact OD1-CD 3.38Å; N514-R549 WeakPolarHBondContact OD1-CG 3.12Å; N514-R549 PolarHBondContact OD1-NE 2.94Å; A545-R549 PolarHBondContact O-N 3.27Å; L546-R549 PolarHBondContact O-N 3.18Å; L546-R549 VanDerWaalsContact O-N 3.16Å; L547-R549 PolarHBondContact O-N 2.93Å; R549-N551 VanDerWaalsContact C-N 3.3Å; R549-N551 PolarHBondContact O-N 2.91Å; R549-T552 PolarHBondContact NH1-OG1 3.38Å; R549-T552 PolarHBondContact O-N 3.47Å; R549-T552 PolarHBondContact O-OG1 3.39Å; R549-M553 HydrophobicContact CG-SD 4.41Å; R549-M553 PolarHBondContact O-N 3.05Å
550	L	80	Confident	74	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-36.7	177.2	-67.4	172.8	0	0	0	111.5	L497 M501 M520 V526 L530 L546 L547 T552 M553 L554	L497-L550 HydrophobicContact CD2-CD2 3.99Å; M501-L550 HydrophobicContact SD-CD1 4.23Å; M520-L550 HydrophobicContact SD-CB 3.94Å; M520-L550 HydrophobicContact SD-CD2 3.62Å; M520-L550 HydrophobicContact SD-CG 4.33Å; V526-L550 HydrophobicContact CG1-CD1 4.17Å; L530-L550 HydrophobicContact CD1-CD1 3.74Å; L530-L550 HydrophobicContact CD2-CD1 3.8Å; L530-L550 HydrophobicContact CG-CD1 4.09Å; L546-L550 HydrophobicContact CD1-CD1 4.12Å; L546-L550 HydrophobicContact CD1-CD2 4.37Å; L546-L550 HydrophobicContact CD1-CG 3.99Å; L546-L550 HydrophobicContact CD2-CD1 4.47Å; L546-L550 HydrophobicContact CG-CD1 3.88Å; L546-L550 HydrophobicContact CG-CG 4.2Å; L546-L550 WeakPolarHBondContact O-CB 3.41Å; L546-L550 VanDerWaalsContact O-CG 3.26Å; L546-L550 WeakPolarHBondContact O-CG 3.32Å; L546-L550 PolarHBondContact O-N 3.01Å; L547-L550 PolarHBondContact O-N 3.35Å; L550-T552 PolarHBondContact O-N 3.26Å; L550-M553 HydrophobicContact CD2-SD 4.1Å; L550-M553 WeakPolarHBondContact O-CA 3.34Å; L550-M553 WeakPolarHBondContact O-CB 3.35Å; L550-M553 PolarHBondContact O-N 3.04Å; L550-L554 PolarHBondContact O-N 3.04Å; L550-L554 VanDerWaalsContact O-N 3.16Å
551	N	77.9	Confident	73.8	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.123	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-30.9	172.4	-75.6	-34.2	0	0	0	112.5	L547 E548 R549 M553 A560 F563 N564	L547-N551 WeakPolarHBondContact O-CB 3.45Å; L547-N551 VanDerWaalsContact O-CG 3.25Å; L547-N551 PolarHBondContact O-N 3.08Å; L547-N551 PolarHBondContact O-ND2 3.23Å; L547-N551 VanDerWaalsContact O-ND2 3.11Å; E548-N551 WeakPolarHBondContact O-CB 3.37Å; E548-N551 PolarHBondContact O-N 2.8Å; R549-N551 VanDerWaalsContact C-N 3.3Å; R549-N551 PolarHBondContact O-N 2.91Å; N551-M553 VanDerWaalsContact C-N 3.33Å; N551-A560 HydrophobicContact CB-CB 3.94Å; N551-A560 WeakPolarHBondContact OD1-CB 3.27Å; N551-F563 WeakPolarHBondContact OD1-CD1 3.33Å; N551-N564 PolarHBondContact ND2-ND2 3.43Å; N551-N564 VanDerWaalsContact ND2-ND2 3.16Å; N551-N564 PolarHBondContact ND2-OD1 3.39Å
552	T	76.9	Confident	73.3	Confident	90 Å²	90	43.1 Å²	43.1	55%	0.552	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.6	171	72	0	0	0	0	114.8	E548 R549 L550	E548-T552 PolarHBondContact O-N 3.42Å; R549-T552 PolarHBondContact NH1-OG1 3.38Å; R549-T552 PolarHBondContact O-N 3.47Å; R549-T552 PolarHBondContact O-OG1 3.39Å; L550-T552 PolarHBondContact O-N 3.26Å
553	M	72.9	Confident	73.1	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.039	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-10.7	178.2	-62.2	171.9	70.7	0	0	113.1	L497 A513 S518 M520 R549 L550 N551 Q555	L497-M553 HydrophobicContact CD2-CE 4.49Å; A513-M553 HydrophobicContact CB-SD 3.91Å; S518-M553 WeakPolarHBondContact O-CE 3.33Å; M520-M553 HydrophobicContact CG-CB 3.83Å; M520-M553 HydrophobicContact CG-CE 4.49Å; M520-M553 PolarHBondContact N-O 3.5Å; M520-M553 HydrophobicContact SD-CB 3.97Å; R549-M553 HydrophobicContact CG-SD 4.41Å; R549-M553 PolarHBondContact O-N 3.05Å; L550-M553 HydrophobicContact CD2-SD 4.1Å; L550-M553 WeakPolarHBondContact O-CA 3.34Å; L550-M553 WeakPolarHBondContact O-CB 3.35Å; L550-M553 PolarHBondContact O-N 3.04Å; N551-M553 VanDerWaalsContact C-N 3.33Å; M553-Q555 PolarHBondContact O-N 2.98Å
554	L	69.5	Low	73.2	Confident	29 Å²	29	42.2 Å²	42.2	15%	0.152	23%	0.229	C	C	.	.			trans	-71.5	115.9	169.9	-66.3	173.5	0	0	0	109.7	M520 V523 L550 F563	M520-L554 HydrophobicContact CB-CD2 4.44Å; M520-L554 HydrophobicContact CE-CD2 4.01Å; M520-L554 HydrophobicContact SD-CD2 4.24Å; V523-L554 HydrophobicContact CG2-CD2 4.24Å; L550-L554 PolarHBondContact O-N 3.04Å; L550-L554 VanDerWaalsContact O-N 3.16Å; L554-F563 HydrophobicContact CD1-CB 4.16Å; L554-F563 HydrophobicContact CD1-CD1 4.09Å; L554-F563 HydrophobicContact CD1-CG 4.24Å
555	Q	58.4	Low	72.9	Confident	153 Å²	153	42.2 Å²	42.2	72%	0.715	23%	0.229	S	C	*	.			trans	-106	-4.7	174.3	-69.3	-168.4	-18.8	0	0	113.5	P519 M553	P519-Q555 HydrophobicContact CB-CG 3.99Å; M553-Q555 PolarHBondContact O-N 2.98Å
556	V	55.9	Low	72.5	Confident	119 Å²	119	44.2 Å²	44.2	72%	0.721	24%	0.238	S	C	*	.	S	Bend	trans	-147.1	156.4	-172.9	-172.2	0	0	0	0	108.2
557	E	50	Low	72.4	Confident	101 Å²	101	44.3 Å²	44.3	47%	0.472	24%	0.238	S	C	.	.	S	Bend	trans	-50.1	146.9	173.7	-70.3	-173.7	162.4	0	0	113.1	I688	E557-I688 VanDerWaalsContact OE1-CG2 3.29Å; E557-I688 WeakPolarHBondContact OE1-CG2 3.04Å
558	P	56.7	Low	72.3	Confident	40 Å²	40	44.3 Å²	44.3	26%	0.26	24%	0.239	S	C	.	.	S	Bend	cis	-66.3	146.4	4.6	28.1	-36.7	0	0	0	113.5	V523 E562 F563	V523-P558 HydrophobicContact CG1-CG 4.18Å; V523-P558 HydrophobicContact CG2-CG 4.16Å; P558-E562 HydrophobicContact CB-CB 3.81Å; P558-F563 HydrophobicContact CG-CB 4.39Å
559	T	66	Low	72.1	Confident	61 Å²	61	41.5 Å²	41.5	37%	0.374	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-58.7	156.1	170.5	59.8	0	0	0	0	110.5	A561 E562 F563	T559-A561 PolarHBondContact O-N 3.39Å; T559-A561 VanDerWaalsContact O-N 3.1Å; T559-E562 PolarHBondContact N-OE2 3.14Å; T559-E562 PolarHBondContact O-N 3.41Å; T559-E562 WeakPolarHBondContact OG1-CG 3.39Å; T559-E562 PolarHBondContact OG1-N 2.89Å; T559-E562 PolarHBondContact OG1-OE2 3.29Å; T559-F563 PolarHBondContact O-N 3.47Å
560	A	71.5	Confident	71.9	Confident	27 Å²	27	43.6 Å²	43.6	22%	0.223	23%	0.234	C	C	.	.	H	α-helix	trans	-51.3	-36.7	174.2	0	0	0	0	0	112.2	N551 N564 P593	N551-A560 HydrophobicContact CB-CB 3.94Å; N551-A560 WeakPolarHBondContact OD1-CB 3.27Å; A560-N564 VanDerWaalsContact O-CB 3.23Å; A560-N564 WeakPolarHBondContact O-CB 3.46Å; A560-N564 PolarHBondContact O-N 3.44Å; A560-N564 PolarHBondContact O-ND2 2.83Å; A560-N564 VanDerWaalsContact O-ND2 3.13Å; A560-N564 PolarHBondContact O-OD1 3.3Å; A560-P593 HydrophobicContact CB-CG 4.21Å
561	A	72.8	Confident	72	Confident	24 Å²	24	43.6 Å²	43.6	20%	0.198	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-40.3	176.8	0	0	0	0	0	113.7	T559 G565 P593 S595	T559-A561 PolarHBondContact O-N 3.39Å; T559-A561 VanDerWaalsContact O-N 3.1Å; A561-G565 PolarHBondContact O-N 3.28Å; A561-P593 HydrophobicContact CB-CB 4.11Å; A561-S595 PolarHBondContact O-N 3.14Å
562	E	70.2	Confident	71.9	Confident	62 Å²	62	43.1 Å²	43.1	29%	0.29	23%	0.232	S	C	.	.	H	α-helix	trans	-74.4	-40	176.5	-70.8	167.3	121	0	0	112.2	P558 T559 G565 D566	P558-E562 HydrophobicContact CB-CB 3.81Å; T559-E562 PolarHBondContact N-OE2 3.14Å; T559-E562 PolarHBondContact O-N 3.41Å; T559-E562 WeakPolarHBondContact OG1-CG 3.39Å; T559-E562 PolarHBondContact OG1-N 2.89Å; T559-E562 PolarHBondContact OG1-OE2 3.29Å; E562-G565 WeakPolarHBondContact O-CA 2.89Å; E562-G565 PolarHBondContact O-N 3.23Å; E562-G565 VanDerWaalsContact O-N 3.16Å; E562-D566 PolarHBondContact O-N 3.08Å
563	F	76.1	Confident	71.8	Confident	3 Å²	3	44.4 Å²	44.4	1%	0.013	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-48.6	175.9	176.9	-118	0	0	0	111.3	V523 V526 L530 L547 N551 L554 P558 T559 G565 L567	V523-F563 HydrophobicContact CG1-CD2 3.52Å; V523-F563 HydrophobicContact CG1-CE2 3.6Å; V526-F563 HydrophobicContact CG1-CZ 4.44Å; L530-F563 HydrophobicContact CD1-CE1 4.16Å; L530-F563 HydrophobicContact CD1-CE2 4.42Å; L530-F563 HydrophobicContact CD1-CZ 3.52Å; L547-F563 HydrophobicContact CD1-CD1 4.01Å; L547-F563 HydrophobicContact CD1-CE1 3.57Å; L547-F563 HydrophobicContact CD1-CZ 4.47Å; N551-F563 WeakPolarHBondContact OD1-CD1 3.33Å; L554-F563 HydrophobicContact CD1-CB 4.16Å; L554-F563 HydrophobicContact CD1-CD1 4.09Å; L554-F563 HydrophobicContact CD1-CG 4.24Å; P558-F563 HydrophobicContact CG-CB 4.39Å; T559-F563 PolarHBondContact O-N 3.47Å; F563-G565 VanDerWaalsContact C-N 3.28Å; F563-G565 PolarHBondContact O-N 2.94Å; F563-L567 VanDerWaalsContact O-CB 3.29Å; F563-L567 WeakPolarHBondContact O-CB 3.21Å; F563-L567 PolarHBondContact O-N 3.3Å; F563-L567 VanDerWaalsContact O-N 3.08Å
564	N	81.1	Confident	71.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-36.5	172.3	-64	-19.1	0	0	0	110.9	L547 N551 A560 L567 V568 M587 P593 V594	L547-N564 VanDerWaalsContact CD1-OD1 3.3Å; L547-N564 WeakPolarHBondContact CD1-OD1 3.41Å; L547-N564 WeakPolarHBondContact CG-OD1 3.08Å; N551-N564 PolarHBondContact ND2-ND2 3.43Å; N551-N564 VanDerWaalsContact ND2-ND2 3.16Å; N551-N564 PolarHBondContact ND2-OD1 3.39Å; A560-N564 VanDerWaalsContact O-CB 3.23Å; A560-N564 WeakPolarHBondContact O-CB 3.46Å; A560-N564 PolarHBondContact O-N 3.44Å; A560-N564 PolarHBondContact O-ND2 2.83Å; A560-N564 VanDerWaalsContact O-ND2 3.13Å; A560-N564 PolarHBondContact O-OD1 3.3Å; N564-L567 WeakPolarHBondContact O-CB 3.42Å; N564-L567 PolarHBondContact O-N 3.18Å; N564-V568 VanDerWaalsContact O-CG2 3.28Å; N564-V568 WeakPolarHBondContact O-CG2 3.23Å; N564-V568 PolarHBondContact O-N 2.91Å; N564-M587 HydrophobicContact CB-CE 4.18Å; N564-P593 VanDerWaalsContact CB-O 3.3Å; N564-P593 WeakPolarHBondContact CB-O 3.45Å; N564-P593 PolarHBondContact ND2-O 3.29Å; N564-V594 HydrophobicContact CB-CG2 4.08Å
565	G	77.3	Confident	72.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-53.1	176.3	0	0	0	0	0	114.4	A561 E562 F563 L567 V568 I569 A598	A561-G565 PolarHBondContact O-N 3.28Å; E562-G565 WeakPolarHBondContact O-CA 2.89Å; E562-G565 PolarHBondContact O-N 3.23Å; E562-G565 VanDerWaalsContact O-N 3.16Å; F563-G565 VanDerWaalsContact C-N 3.28Å; F563-G565 PolarHBondContact O-N 2.94Å; G565-L567 VanDerWaalsContact C-N 3.28Å; G565-L567 PolarHBondContact O-N 2.91Å; G565-V568 PolarHBondContact O-N 3.29Å; G565-I569 VanDerWaalsContact O-CG1 3.28Å; G565-I569 WeakPolarHBondContact O-CG1 2.88Å; G565-I569 PolarHBondContact O-N 3.41Å; G565-A598 VanDerWaalsContact CA-CB 3.46Å
566	D	76	Confident	72.9	Confident	53 Å²	53	48.2 Å²	48.2	28%	0.283	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-35.3	176.1	177.4	54.1	0	0	0	111.6	E562 R570	E562-D566 PolarHBondContact O-N 3.08Å; D566-R570 VanDerWaalsContact CG-NE 3.31Å; D566-R570 VanDerWaalsContact CG-NH2 3.3Å; D566-R570 VanDerWaalsContact O-CG 3.25Å; D566-R570 WeakPolarHBondContact O-CG 3.04Å; D566-R570 PolarHBondContact O-N 2.86Å; D566-R570 VanDerWaalsContact O-N 3.16Å; D566-R570 IonicContact OD1-CZ 3.58Å; D566-R570 IonicContact OD1-NE 3.15Å; D566-R570 PolarHBondContact OD1-NE 3.45Å; D566-R570 IonicContact OD1-NH2 3.8Å; D566-R570 PolarHBondContact OD1-NH2 3.17Å; D566-R570 VanDerWaalsContact OD1-NH2 3.13Å; D566-R570 IonicContact OD2-CZ 2.88Å; D566-R570 IonicContact OD2-NE 2.67Å; D566-R570 PolarHBondContact OD2-NE 3.13Å; D566-R570 VanDerWaalsContact OD2-NE 3.12Å; D566-R570 IonicContact OD2-NH2 3.57Å; D566-R570 PolarHBondContact OD2-NH2 2.86Å
567	L	82.7	Confident	73.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-54	173.4	177.6	68.3	0	0	0	111.8	L530 L531 F534 L547 F563 N564 G565 I569 R570 L571	L530-L567 HydrophobicContact CB-CD1 4.49Å; L531-L567 HydrophobicContact CD2-CD1 3.83Å; L531-L567 HydrophobicContact CG-CD1 4.25Å; F534-L567 HydrophobicContact CD2-CD1 4.03Å; F534-L567 HydrophobicContact CE2-CD1 3.92Å; F534-L567 HydrophobicContact CE2-CD2 3.7Å; F534-L567 HydrophobicContact CE2-CG 4.2Å; F534-L567 HydrophobicContact CZ-CD2 4.15Å; L547-L567 HydrophobicContact CD1-CD2 3.52Å; L547-L567 HydrophobicContact CD2-CD2 3.53Å; L547-L567 HydrophobicContact CG-CD2 4.15Å; F563-L567 VanDerWaalsContact O-CB 3.29Å; F563-L567 WeakPolarHBondContact O-CB 3.21Å; F563-L567 PolarHBondContact O-N 3.3Å; F563-L567 VanDerWaalsContact O-N 3.08Å; N564-L567 WeakPolarHBondContact O-CB 3.42Å; N564-L567 PolarHBondContact O-N 3.18Å; G565-L567 VanDerWaalsContact C-N 3.28Å; G565-L567 PolarHBondContact O-N 2.91Å; L567-I569 VanDerWaalsContact C-N 3.34Å; L567-I569 PolarHBondContact O-N 2.84Å; L567-R570 PolarHBondContact O-N 3.08Å; L567-L571 HydrophobicContact CD1-CD1 4.37Å; L567-L571 HydrophobicContact CD1-CG 4.39Å; L567-L571 HydrophobicContact CG-CD1 4.12Å; L567-L571 HydrophobicContact CG-CG 4.47Å; L567-L571 WeakPolarHBondContact O-CG 3.43Å; L567-L571 PolarHBondContact O-N 3.33Å
568	V	80.9	Confident	75.1	Confident	1 Å²	1	45 Å²	45	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-36.6	-178.3	-177.2	0	0	0	0	111.5	N564 G565 R570 L571 S572 L580 L584 M587 M602 L618	N564-V568 VanDerWaalsContact O-CG2 3.28Å; N564-V568 WeakPolarHBondContact O-CG2 3.23Å; N564-V568 PolarHBondContact O-N 2.91Å; G565-V568 PolarHBondContact O-N 3.29Å; V568-R570 VanDerWaalsContact C-N 3.27Å; V568-R570 PolarHBondContact O-N 3.25Å; V568-L571 PolarHBondContact O-N 3.47Å; V568-S572 PolarHBondContact O-N 3.14Å; V568-L580 HydrophobicContact CG1-CD1 4.43Å; V568-L584 HydrophobicContact CG1-CD2 4.14Å; V568-M587 HydrophobicContact CG2-CE 3.89Å; V568-M587 HydrophobicContact CG2-SD 3.73Å; V568-M602 HydrophobicContact CB-CE 4.39Å; V568-M602 HydrophobicContact CB-SD 4.26Å; V568-M602 HydrophobicContact CG1-CE 3.86Å; V568-M602 HydrophobicContact CG1-SD 3.58Å; V568-M602 VanDerWaalsContact CG1-SD 3.58Å; V568-L618 HydrophobicContact CG1-CD2 4.46Å
569	I	78.9	Confident	76.1	Confident	22 Å²	22	47 Å²	47	11%	0.113	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-39.9	171.9	-70.8	165.8	0	0	0	111.8	G565 L567 S572 N573 A598 Y601 M602	G565-I569 VanDerWaalsContact O-CG1 3.28Å; G565-I569 WeakPolarHBondContact O-CG1 2.88Å; G565-I569 PolarHBondContact O-N 3.41Å; L567-I569 VanDerWaalsContact C-N 3.34Å; L567-I569 PolarHBondContact O-N 2.84Å; I569-S572 PolarHBondContact O-OG 2.9Å; I569-N573 PolarHBondContact O-ND2 3.28Å; I569-A598 HydrophobicContact CD1-CB 3.76Å; I569-A598 HydrophobicContact CG1-CB 4.25Å; I569-Y601 HydrophobicContact CD1-CD1 3.65Å; I569-Y601 HydrophobicContact CD1-CE1 4.35Å; I569-Y601 HydrophobicContact CD1-CG 4.15Å; I569-Y601 HydrophobicContact CG1-CD1 3.88Å; I569-Y601 HydrophobicContact CG2-CD1 3.91Å; I569-Y601 HydrophobicContact CG2-CE1 3.7Å; I569-M602 HydrophobicContact CG1-CG 3.78Å; I569-M602 HydrophobicContact CG1-SD 4.27Å
570	R	78.6	Confident	76.8	Confident	99 Å²	99	44.2 Å²	44.2	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-76.2	-37.3	179.2	-68.5	174.2	-166	-156.9	12.8	111.5	L531 D566 L567 V568 S572 N573 M574	L531-R570 HydrophobicContact CD1-CB 3.96Å; L531-R570 VanDerWaalsContact CD1-CD 3.41Å; L531-R570 HydrophobicContact CD1-CG 4.31Å; L531-R570 HydrophobicContact CD2-CB 3.56Å; L531-R570 HydrophobicContact CG-CB 4.41Å; D566-R570 VanDerWaalsContact CG-NE 3.31Å; D566-R570 VanDerWaalsContact CG-NH2 3.3Å; D566-R570 VanDerWaalsContact O-CG 3.25Å; D566-R570 WeakPolarHBondContact O-CG 3.04Å; D566-R570 PolarHBondContact O-N 2.86Å; D566-R570 VanDerWaalsContact O-N 3.16Å; D566-R570 IonicContact OD1-CZ 3.58Å; D566-R570 IonicContact OD1-NE 3.15Å; D566-R570 PolarHBondContact OD1-NE 3.45Å; D566-R570 IonicContact OD1-NH2 3.8Å; D566-R570 PolarHBondContact OD1-NH2 3.17Å; D566-R570 VanDerWaalsContact OD1-NH2 3.13Å; D566-R570 IonicContact OD2-CZ 2.88Å; D566-R570 IonicContact OD2-NE 2.67Å; D566-R570 PolarHBondContact OD2-NE 3.13Å; D566-R570 VanDerWaalsContact OD2-NE 3.12Å; D566-R570 IonicContact OD2-NH2 3.57Å; D566-R570 PolarHBondContact OD2-NH2 2.86Å; L567-R570 PolarHBondContact O-N 3.08Å; V568-R570 VanDerWaalsContact C-N 3.27Å; V568-R570 PolarHBondContact O-N 3.25Å; R570-S572 PolarHBondContact O-N 3.09Å; R570-N573 PolarHBondContact O-N 3.33Å; R570-M574 PolarHBondContact O-N 2.83Å
571	L	80.9	Confident	77.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-38.9	172.5	-65.2	178	0	0	0	112.3	L531 F534 L567 V568 N573 M574 F575 L580 V583	L531-L571 HydrophobicContact CD2-CD2 3.87Å; L531-L571 HydrophobicContact CD2-CG 4.25Å; F534-L571 HydrophobicContact CB-CD2 3.45Å; F534-L571 VanDerWaalsContact CB-CD2 3.45Å; F534-L571 HydrophobicContact CD1-CD1 3.83Å; F534-L571 HydrophobicContact CD1-CD2 4.12Å; F534-L571 HydrophobicContact CD2-CD1 4.16Å; F534-L571 HydrophobicContact CD2-CD2 4.1Å; F534-L571 HydrophobicContact CE1-CD1 3.88Å; F534-L571 HydrophobicContact CE2-CD1 4.23Å; F534-L571 HydrophobicContact CG-CD1 3.98Å; F534-L571 HydrophobicContact CG-CD2 3.65Å; F534-L571 HydrophobicContact CG-CG 4.46Å; F534-L571 HydrophobicContact CZ-CD1 4.08Å; L567-L571 HydrophobicContact CD1-CD1 4.37Å; L567-L571 HydrophobicContact CD1-CG 4.39Å; L567-L571 HydrophobicContact CG-CD1 4.12Å; L567-L571 HydrophobicContact CG-CG 4.47Å; L567-L571 WeakPolarHBondContact O-CG 3.43Å; L567-L571 PolarHBondContact O-N 3.33Å; V568-L571 PolarHBondContact O-N 3.47Å; L571-N573 PolarHBondContact O-N 3.34Å; L571-N573 VanDerWaalsContact O-N 3.09Å; L571-M574 PolarHBondContact O-N 2.9Å; L571-F575 HydrophobicContact CB-CD2 4.18Å; L571-F575 HydrophobicContact CB-CE2 4.48Å; L571-F575 HydrophobicContact CD2-CD2 4.31Å; L571-F575 HydrophobicContact CD2-CE2 3.85Å; L571-F575 HydrophobicContact CD2-CZ 4.25Å; L571-F575 PolarHBondContact O-N 3.33Å; L571-L580 HydrophobicContact CB-CD1 4.25Å; L571-V583 HydrophobicContact CD1-CG1 4.24Å
572	S	76.3	Confident	77.6	Confident	13 Å²	13	48.9 Å²	48.9	9%	0.091	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-14.9	177.1	72.4	0	0	0	0	114.1	V568 I569 R570	V568-S572 PolarHBondContact O-N 3.14Å; I569-S572 PolarHBondContact O-OG 2.9Å; R570-S572 PolarHBondContact O-N 3.09Å
573	N	75	Confident	78.2	Confident	117 Å²	117	45.9 Å²	45.9	63%	0.626	22%	0.219	S	C	*	.	H	α-helix	trans	-92.4	-18.1	171.9	-71.5	-63.3	0	0	0	113.3	I569 R570 L571	I569-N573 PolarHBondContact O-ND2 3.28Å; R570-N573 PolarHBondContact O-N 3.33Å; L571-N573 PolarHBondContact O-N 3.34Å; L571-N573 VanDerWaalsContact O-N 3.09Å
574	M	74.6	Confident	78.5	Confident	99 Å²	99	45.8 Å²	45.8	49%	0.488	22%	0.218	S	C	.	.	H	α-helix	trans	-101.4	-31.7	-176.2	-69.1	179.1	58.4	0	0	113.4	L531 R570 L571	L531-M574 HydrophobicContact CB-SD 4.3Å; L531-M574 HydrophobicContact CD2-SD 4.15Å; R570-M574 PolarHBondContact O-N 2.83Å; L571-M574 PolarHBondContact O-N 2.9Å
575	F	76.9	Confident	78.6	Confident	25 Å²	25	50.1 Å²	50.1	11%	0.11	24%	0.239	C	C	.	.	S	Bend	trans	-104	150.3	-172.8	-72.3	-20.8	0	0	0	113.5	F534 H540 L571 Q579 L580 V583	F534-F575 HydrophobicContact CB-CE2 4.41Å; F534-F575 HydrophobicContact CB-CZ 4Å; F534-F575 HydrophobicContact CD1-CE2 4.28Å; F534-F575 HydrophobicContact CD1-CZ 4.49Å; F534-F575 WeakPolarHBondContact O-CZ 3Å; H540-F575 AromaticContact NE2-CE2 3.99Å; H540-F575 AromaticContact NE2-CZ 3.75Å; L571-F575 HydrophobicContact CB-CD2 4.18Å; L571-F575 HydrophobicContact CB-CE2 4.48Å; L571-F575 HydrophobicContact CD2-CD2 4.31Å; L571-F575 HydrophobicContact CD2-CE2 3.85Å; L571-F575 HydrophobicContact CD2-CZ 4.25Å; L571-F575 PolarHBondContact O-N 3.33Å; F575-Q579 HydrophobicContact CB-CB 3.88Å; F575-Q579 HydrophobicContact CD1-CB 4.39Å; F575-Q579 HydrophobicContact CD2-CB 4.35Å; F575-Q579 HydrophobicContact CG-CB 3.99Å; F575-L580 HydrophobicContact CB-CB 4.48Å; F575-V583 HydrophobicContact CD2-CG2 4.13Å; F575-V583 HydrophobicContact CE2-CG2 3.74Å
576	E	73.1	Confident	78.8	Confident	146 Å²	146	52 Å²	52	68%	0.682	25%	0.249	S	C	*	.			trans	-74	163.7	166.3	-64.5	-170.8	168	0	0	111.2	E578 Q579 L580	E576-E578 VanDerWaalsContact C-N 3.26Å; E576-E578 PolarHBondContact O-N 3.44Å; E576-Q579 PolarHBondContact O-N 3.2Å; E576-Q579 VanDerWaalsContact O-N 3.13Å; E576-L580 PolarHBondContact O-N 3.01Å
577	A	74.8	Confident	79.2	Confident	32 Å²	32	49.5 Å²	49.5	26%	0.264	24%	0.235	S	C	.	.	H	α-helix	trans	-51.5	-42.9	-175.7	0	0	0	0	0	113.2	N581 L608 I614	A577-N581 WeakPolarHBondContact O-CB 3.42Å; A577-N581 PolarHBondContact O-N 3.29Å; A577-L608 HydrophobicContact CB-CD2 3.74Å; A577-I614 HydrophobicContact CB-CD1 3.88Å
578	E	76.4	Confident	79.1	Confident	119 Å²	119	51.7 Å²	51.7	56%	0.556	25%	0.247	S	C	*	.	H	α-helix	trans	-69.3	-40.9	-178.8	-160.8	-167.7	151.6	0	0	112.6	E576 N581 R582	E576-E578 VanDerWaalsContact C-N 3.26Å; E576-E578 PolarHBondContact O-N 3.44Å; E578-N581 WeakPolarHBondContact O-CB 3.3Å; E578-N581 PolarHBondContact O-N 3.38Å; E578-R582 WeakPolarHBondContact O-CG 3.42Å; E578-R582 PolarHBondContact O-N 2.99Å; E578-R582 VanDerWaalsContact O-N 3.17Å; E578-R582 IonicContact OE1-CZ 3.5Å; E578-R582 IonicContact OE1-NE 2.69Å; E578-R582 IonicContact OE1-NH2 3.35Å; E578-R582 PolarHBondContact OE1-NH2 3.46Å
579	Q	77.3	Confident	79.1	Confident	84 Å²	84	55.5 Å²	55.5	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-43	177	-73.2	174.1	-17.5	0	0	111.3	F575 E576 R582 V583	F575-Q579 HydrophobicContact CB-CB 3.88Å; F575-Q579 HydrophobicContact CD1-CB 4.39Å; F575-Q579 HydrophobicContact CD2-CB 4.35Å; F575-Q579 HydrophobicContact CG-CB 3.99Å; E576-Q579 PolarHBondContact O-N 3.2Å; E576-Q579 VanDerWaalsContact O-N 3.13Å; Q579-R582 PolarHBondContact O-N 3.12Å; Q579-V583 PolarHBondContact O-N 3.02Å
580	L	81.4	Confident	79.2	Confident	2 Å²	2	58 Å²	58	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-42	176	-169.7	70.3	0	0	0	111.4	V568 L571 F575 E576 R582 V583 L584 L608 I614	V568-L580 HydrophobicContact CG1-CD1 4.43Å; L571-L580 HydrophobicContact CB-CD1 4.25Å; F575-L580 HydrophobicContact CB-CB 4.48Å; E576-L580 PolarHBondContact O-N 3.01Å; L580-R582 VanDerWaalsContact C-N 3.32Å; L580-R582 PolarHBondContact O-N 3.35Å; L580-V583 PolarHBondContact O-N 3.4Å; L580-V583 VanDerWaalsContact O-N 3.11Å; L580-L584 HydrophobicContact CG-CD1 4.18Å; L580-L584 HydrophobicContact CG-CG 4.38Å; L580-L584 WeakPolarHBondContact O-CG 3.45Å; L580-L584 PolarHBondContact O-N 2.91Å; L580-L608 HydrophobicContact CD2-CD1 3.42Å; L580-L608 VanDerWaalsContact CD2-CD1 3.42Å; L580-I614 HydrophobicContact CD2-CG2 4.22Å
581	N	80.7	Confident	79.2	Confident	14 Å²	14	58.4 Å²	58.4	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-52.1	-48.7	173.7	-101.1	-18.5	0	0	0	111.6	A577 E578 V583 L584 E585 E613 I614 K617	A577-N581 WeakPolarHBondContact O-CB 3.42Å; A577-N581 PolarHBondContact O-N 3.29Å; E578-N581 WeakPolarHBondContact O-CB 3.3Å; E578-N581 PolarHBondContact O-N 3.38Å; N581-V583 VanDerWaalsContact C-N 3.35Å; N581-V583 PolarHBondContact O-N 3.11Å; N581-L584 PolarHBondContact O-N 3.23Å; N581-E585 WeakPolarHBondContact O-CG 3.5Å; N581-E585 PolarHBondContact O-N 3.1Å; N581-E613 PolarHBondContact ND2-OE2 3.3Å; N581-I614 VanDerWaalsContact OD1-CG1 3.31Å; N581-I614 WeakPolarHBondContact OD1-CG1 3.4Å; N581-K617 WeakPolarHBondContact OD1-CD 3.44Å; N581-K617 PolarHBondContact OD1-NZ 3.3Å
582	R	80.7	Confident	79.1	Confident	134 Å²	134	58.9 Å²	58.9	51%	0.506	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-32.8	178.1	-63.8	178.5	-166.6	-168.4	4.2	113.4	E578 Q579 L580 N586	E578-R582 WeakPolarHBondContact O-CG 3.42Å; E578-R582 PolarHBondContact O-N 2.99Å; E578-R582 VanDerWaalsContact O-N 3.17Å; E578-R582 IonicContact OE1-CZ 3.5Å; E578-R582 IonicContact OE1-NE 2.69Å; E578-R582 IonicContact OE1-NH2 3.35Å; E578-R582 PolarHBondContact OE1-NH2 3.46Å; Q579-R582 PolarHBondContact O-N 3.12Å; L580-R582 VanDerWaalsContact C-N 3.32Å; L580-R582 PolarHBondContact O-N 3.35Å; R582-N586 PolarHBondContact O-N 2.71Å; R582-N586 PolarHBondContact O-ND2 3.01Å
583	V	82.6	Confident	79	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.6	-47.9	172.7	178.1	0	0	0	0	110.3	F534 H540 V544 L571 F575 Q579 L580 N581 E585 N586 M587	F534-V583 HydrophobicContact CD1-CG2 4.46Å; F534-V583 HydrophobicContact CE1-CG1 4.02Å; F534-V583 HydrophobicContact CE1-CG2 4.37Å; H540-V583 HydrophobicContact CB-CG2 4.19Å; H540-V583 VanDerWaalsContact ND1-CG2 3.33Å; H540-V583 WeakPolarHBondContact ND1-CG2 3.45Å; V544-V583 HydrophobicContact CG2-CG1 4.37Å; L571-V583 HydrophobicContact CD1-CG1 4.24Å; F575-V583 HydrophobicContact CD2-CG2 4.13Å; F575-V583 HydrophobicContact CE2-CG2 3.74Å; Q579-V583 PolarHBondContact O-N 3.02Å; L580-V583 PolarHBondContact O-N 3.4Å; L580-V583 VanDerWaalsContact O-N 3.11Å; N581-V583 VanDerWaalsContact C-N 3.35Å; N581-V583 PolarHBondContact O-N 3.11Å; V583-E585 VanDerWaalsContact C-N 3.35Å; V583-E585 PolarHBondContact O-N 3.18Å; V583-N586 PolarHBondContact O-N 3.43Å; V583-M587 HydrophobicContact CG1-CG 4.31Å; V583-M587 HydrophobicContact CG1-SD 4.01Å; V583-M587 WeakPolarHBondContact O-CG 3.43Å; V583-M587 PolarHBondContact O-N 3.34Å
584	L	81.7	Confident	78.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-41.8	-178.6	-66.5	175.4	0	0	0	111.4	V568 L580 N581 N586 M587 I588 I614 K617 L618 V621	V568-L584 HydrophobicContact CG1-CD2 4.14Å; L580-L584 HydrophobicContact CG-CD1 4.18Å; L580-L584 HydrophobicContact CG-CG 4.38Å; L580-L584 WeakPolarHBondContact O-CG 3.45Å; L580-L584 PolarHBondContact O-N 2.91Å; N581-L584 PolarHBondContact O-N 3.23Å; L584-N586 VanDerWaalsContact C-N 3.35Å; L584-N586 PolarHBondContact O-N 2.65Å; L584-M587 PolarHBondContact O-N 3.25Å; L584-M587 VanDerWaalsContact O-N 3.15Å; L584-I588 VanDerWaalsContact O-CG1 3.28Å; L584-I588 WeakPolarHBondContact O-CG1 3.5Å; L584-I588 PolarHBondContact O-N 3.32Å; L584-I614 HydrophobicContact CD1-CG2 4.16Å; L584-K617 HydrophobicContact CB-CB 4.46Å; L584-K617 HydrophobicContact CD1-CB 4.43Å; L584-L618 HydrophobicContact CD1-CD2 3.87Å; L584-L618 HydrophobicContact CD1-CG 3.94Å; L584-L618 HydrophobicContact CD2-CD2 3.69Å; L584-L618 HydrophobicContact CG-CD2 4.46Å; L584-V621 HydrophobicContact CD2-CG2 4.34Å
585	E	83.3	Confident	78.7	Confident	91 Å²	91	52 Å²	52	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-56.3	-45.5	173.2	-75.8	163.9	-172	0	0	112.6	N581 V583 M587 I588 A589 K617	N581-E585 WeakPolarHBondContact O-CG 3.5Å; N581-E585 PolarHBondContact O-N 3.1Å; V583-E585 VanDerWaalsContact C-N 3.35Å; V583-E585 PolarHBondContact O-N 3.18Å; E585-M587 PolarHBondContact O-N 2.9Å; E585-I588 PolarHBondContact O-N 2.89Å; E585-A589 WeakPolarHBondContact O-CB 3.23Å; E585-A589 PolarHBondContact O-N 3.2Å; E585-K617 HydrophobicContact CG-CD 4.35Å; E585-K617 IonicContact OE1-NZ 2.7Å; E585-K617 PolarHBondContact OE1-NZ 2.91Å
586	N	82.8	Confident	78.4	Confident	39 Å²	39	55.2 Å²	55.2	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-66.8	-34.5	176.2	-76.5	-53.2	0	0	0	112.8	V544 R582 V583 L584 R590	V544-N586 HydrophobicContact CB-CB 4.38Å; V544-N586 HydrophobicContact CG1-CB 4.44Å; V544-N586 HydrophobicContact CG2-CB 4.17Å; R582-N586 PolarHBondContact O-N 2.71Å; R582-N586 PolarHBondContact O-ND2 3.01Å; V583-N586 PolarHBondContact O-N 3.43Å; L584-N586 VanDerWaalsContact C-N 3.35Å; L584-N586 PolarHBondContact O-N 2.65Å; N586-R590 PolarHBondContact O-N 3.22Å; N586-R590 VanDerWaalsContact O-N 3.15Å
587	M	83.4	Confident	78.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-39.1	174.4	-68.2	-177.1	71.1	0	0	112.3	V544 L547 N564 V568 V583 L584 E585 R590 K591 L592 V594	V544-M587 HydrophobicContact CG1-CG 4.08Å; V544-M587 HydrophobicContact CG2-CG 4.22Å; L547-M587 HydrophobicContact CD2-CE 4.34Å; N564-M587 HydrophobicContact CB-CE 4.18Å; V568-M587 HydrophobicContact CG2-CE 3.89Å; V568-M587 HydrophobicContact CG2-SD 3.73Å; V583-M587 HydrophobicContact CG1-CG 4.31Å; V583-M587 HydrophobicContact CG1-SD 4.01Å; V583-M587 WeakPolarHBondContact O-CG 3.43Å; V583-M587 PolarHBondContact O-N 3.34Å; L584-M587 PolarHBondContact O-N 3.25Å; L584-M587 VanDerWaalsContact O-N 3.15Å; E585-M587 PolarHBondContact O-N 2.9Å; M587-R590 PolarHBondContact O-N 3.13Å; M587-K591 PolarHBondContact O-N 3.32Å; M587-K591 VanDerWaalsContact O-N 3.13Å; M587-L592 HydrophobicContact CB-CB 4.46Å; M587-L592 HydrophobicContact CE-CB 4.26Å; M587-L592 HydrophobicContact CG-CD1 4.31Å; M587-L592 PolarHBondContact O-N 3.03Å; M587-V594 HydrophobicContact CE-CG2 3.48Å; M587-V594 VanDerWaalsContact CE-CG2 3.48Å
588	I	80.7	Confident	77.8	Confident	48 Å²	48	51.4 Å²	51.4	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-48.8	172.4	-65.2	167.1	0	0	0	109.7	L584 E585 R590 K591 K617 L620 V621	L584-I588 VanDerWaalsContact O-CG1 3.28Å; L584-I588 WeakPolarHBondContact O-CG1 3.5Å; L584-I588 PolarHBondContact O-N 3.32Å; E585-I588 PolarHBondContact O-N 2.89Å; I588-R590 PolarHBondContact O-N 2.74Å; I588-K591 PolarHBondContact O-N 2.93Å; I588-K617 HydrophobicContact CD1-CB 4.22Å; I588-K617 HydrophobicContact CD1-CG 4.34Å; I588-L620 HydrophobicContact CD1-CB 4.11Å; I588-V621 HydrophobicContact CD1-CG2 4.05Å; I588-V621 HydrophobicContact CG1-CB 4.42Å; I588-V621 HydrophobicContact CG1-CG2 3.39Å
589	A	81.5	Confident	77.5	Confident	81 Å²	81	46.2 Å²	46.2	67%	0.669	23%	0.233	S	C	*	.	H	α-helix	trans	-59	-34.1	-179.1	0	0	0	0	0	113.1	E585	E585-A589 WeakPolarHBondContact O-CB 3.23Å; E585-A589 PolarHBondContact O-N 3.2Å
590	R	80.1	Confident	77.1	Confident	75 Å²	75	45.4 Å²	45.4	28%	0.283	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	8	177.7	-69.9	171.9	177.8	-97.5	-0.8	114.4	E541 A545 E548 N586 M587 I588 L592	E541-R590 IonicContact OE1-NH2 3.68Å; E541-R590 PolarHBondContact OE1-NH2 3.17Å; A545-R590 VanDerWaalsContact CB-NH1 3.29Å; E548-R590 IonicContact OE2-CZ 3.56Å; E548-R590 IonicContact OE2-NH1 3.74Å; E548-R590 PolarHBondContact OE2-NH1 3Å; N586-R590 PolarHBondContact O-N 3.22Å; N586-R590 VanDerWaalsContact O-N 3.15Å; M587-R590 PolarHBondContact O-N 3.13Å; I588-R590 PolarHBondContact O-N 2.74Å; R590-L592 VanDerWaalsContact C-N 3.26Å; R590-L592 HydrophobicContact CB-CG 4.21Å; R590-L592 PolarHBondContact O-N 3.28Å
591	K	79.3	Confident	76.5	Confident	107 Å²	107	47.5 Å²	47.5	47%	0.465	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	40.7	-178.8	-60.7	-165.5	173.1	-158.7	0	114	M587 I588 E627	M587-K591 PolarHBondContact O-N 3.32Å; M587-K591 VanDerWaalsContact O-N 3.13Å; I588-K591 PolarHBondContact O-N 2.93Å; K591-E627 IonicContact NZ-OE2 3.14Å; K591-E627 PolarHBondContact NZ-OE2 3.04Å
592	L	78.4	Confident	75.8	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.047	24%	0.237	C	C	.	.			trans	-77.5	128	-179.3	-69	-177.3	0	0	0	111.6	V544 L547 E548 M587 R590	V544-L592 HydrophobicContact CG1-CD1 3.48Å; V544-L592 VanDerWaalsContact CG1-CD1 3.48Å; L547-L592 HydrophobicContact CB-CD1 4.46Å; L547-L592 HydrophobicContact CD2-CD1 3.94Å; L547-L592 HydrophobicContact CG-CD1 4.2Å; E548-L592 HydrophobicContact CB-CD2 4Å; E548-L592 HydrophobicContact CG-CD2 4.12Å; M587-L592 HydrophobicContact CB-CB 4.46Å; M587-L592 HydrophobicContact CE-CB 4.26Å; M587-L592 HydrophobicContact CG-CD1 4.31Å; M587-L592 PolarHBondContact O-N 3.03Å; R590-L592 VanDerWaalsContact C-N 3.26Å; R590-L592 HydrophobicContact CB-CG 4.21Å; R590-L592 PolarHBondContact O-N 3.28Å
593	P	75.2	Confident	75.3	Confident	48 Å²	48	43.9 Å²	43.9	31%	0.312	23%	0.227	S	C	.	.			trans	-72.7	141.7	-178.2	30.7	-35.8	0	0	0	111.1	A560 A561 N564	A560-P593 HydrophobicContact CB-CG 4.21Å; A561-P593 HydrophobicContact CB-CB 4.11Å; N564-P593 VanDerWaalsContact CB-O 3.3Å; N564-P593 WeakPolarHBondContact CB-O 3.45Å; N564-P593 PolarHBondContact ND2-O 3.29Å
594	V	72.8	Confident	74.6	Confident	12 Å²	12	48 Å²	48	7%	0.073	26%	0.256	C	S	.	.			trans	-130.6	135.7	172.1	175.2	0	0	0	0	108.3	N564 M587 I599 V621	N564-V594 HydrophobicContact CB-CG2 4.08Å; M587-V594 HydrophobicContact CE-CG2 3.48Å; M587-V594 VanDerWaalsContact CE-CG2 3.48Å; V594-I599 HydrophobicContact CB-CD1 4.47Å; V594-I599 HydrophobicContact CG1-CD1 4.1Å; V594-I599 HydrophobicContact CG1-CG1 4.03Å; V594-V621 HydrophobicContact CB-CG1 3.81Å; V594-V621 HydrophobicContact CG2-CG1 3.45Å; V594-V621 VanDerWaalsContact CG2-CG1 3.45Å
595	S	70.6	Confident	73.6	Confident	25 Å²	25	50.9 Å²	50.9	18%	0.175	27%	0.267	C	S	.	.			trans	-66.9	135.3	-178.6	72.5	0	0	0	0	112.2	A561 I597 A598 I599	A561-S595 PolarHBondContact O-N 3.14Å; S595-I597 PolarHBondContact O-N 3.38Å; S595-A598 WeakPolarHBondContact O-CB 3.17Å; S595-A598 PolarHBondContact O-N 3.23Å; S595-A598 WeakPolarHBondContact OG-CB 3.48Å; S595-A598 PolarHBondContact OG-N 2.79Å; S595-I599 PolarHBondContact O-N 2.99Å
596	E	69.4	Low	72.4	Confident	93 Å²	93	47.6 Å²	47.6	44%	0.435	26%	0.257	S	S	.	.	H	α-helix	trans	-57.5	-34.5	176.3	-166.7	-168.5	155.3	0	0	111.3	A598 I599 E600 K666	E596-A598 VanDerWaalsContact C-N 3.3Å; E596-A598 PolarHBondContact O-N 3.5Å; E596-I599 CarbonylContact O-C 3.59Å; E596-I599 WeakPolarHBondContact O-CA 3.25Å; E596-I599 WeakPolarHBondContact O-CB 3.24Å; E596-I599 PolarHBondContact O-N 3.49Å; E596-E600 PolarHBondContact O-N 2.9Å; E596-K666 IonicContact OE1-NZ 3.77Å; E596-K666 PolarHBondContact OE1-NZ 3.39Å
597	I	67.8	Low	71.1	Confident	93 Å²	93	54.8 Å²	54.8	48%	0.477	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-40.1	175.2	-57.6	174.9	0	0	0	111.3	S595 I599 Y601	S595-I597 PolarHBondContact O-N 3.38Å; I597-I599 VanDerWaalsContact C-N 3.34Å; I597-Y601 WeakPolarHBondContact O-CB 3.5Å; I597-Y601 PolarHBondContact O-N 3.47Å
598	A	67.4	Low	70	Confident	5 Å²	5	56.3 Å²	56.3	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-69.9	-33.6	176.2	0	0	0	0	0	111.9	G565 I569 S595 E596 Y601 M602	G565-A598 VanDerWaalsContact CA-CB 3.46Å; I569-A598 HydrophobicContact CD1-CB 3.76Å; I569-A598 HydrophobicContact CG1-CB 4.25Å; S595-A598 WeakPolarHBondContact O-CB 3.17Å; S595-A598 PolarHBondContact O-N 3.23Å; S595-A598 WeakPolarHBondContact OG-CB 3.48Å; S595-A598 PolarHBondContact OG-N 2.79Å; E596-A598 VanDerWaalsContact C-N 3.3Å; E596-A598 PolarHBondContact O-N 3.5Å; A598-Y601 WeakPolarHBondContact O-CB 3.19Å; A598-Y601 PolarHBondContact O-N 2.89Å; A598-M602 WeakPolarHBondContact O-CE 3.4Å; A598-M602 WeakPolarHBondContact O-CG 3.44Å; A598-M602 PolarHBondContact O-N 2.95Å
599	I	69.9	Low	68.9	Low	9 Å²	9	56.2 Å²	56.2	5%	0.046	30%	0.301	C	S	.	.	H	α-helix	trans	-70	-46.4	176.3	-64.9	163.9	0	0	0	110.9	V594 S595 E596 I597 Y601 M602 I603 L618 A622	V594-I599 HydrophobicContact CB-CD1 4.47Å; V594-I599 HydrophobicContact CG1-CD1 4.1Å; V594-I599 HydrophobicContact CG1-CG1 4.03Å; S595-I599 PolarHBondContact O-N 2.99Å; E596-I599 CarbonylContact O-C 3.59Å; E596-I599 WeakPolarHBondContact O-CA 3.25Å; E596-I599 WeakPolarHBondContact O-CB 3.24Å; E596-I599 PolarHBondContact O-N 3.49Å; I597-I599 VanDerWaalsContact C-N 3.34Å; I599-Y601 PolarHBondContact O-N 3.01Å; I599-M602 HydrophobicContact CG1-CE 4.05Å; I599-M602 PolarHBondContact O-N 2.89Å; I599-I603 HydrophobicContact CG2-CD1 3.68Å; I599-I603 HydrophobicContact CG2-CG1 4.36Å; I599-I603 WeakPolarHBondContact O-CB 3.17Å; I599-I603 VanDerWaalsContact O-CG1 3.3Å; I599-I603 WeakPolarHBondContact O-CG1 3.3Å; I599-I603 PolarHBondContact O-N 3.19Å; I599-L618 WeakPolarHBondContact CD1-O 3.34Å; I599-L618 HydrophobicContact CG2-CB 4.18Å; I599-A622 HydrophobicContact CD1-CB 3.81Å
600	E	69.8	Low	67.9	Low	67 Å²	67	60.1 Å²	60.1	31%	0.313	31%	0.311	S	S	.	.	H	α-helix	trans	-56.1	-40.3	170.7	-74.2	-166.4	159.2	0	0	111.4	E596 S604 K666 R699	E596-E600 PolarHBondContact O-N 2.9Å; E600-S604 VanDerWaalsContact O-CB 3.29Å; E600-S604 WeakPolarHBondContact O-CB 3.46Å; E600-S604 PolarHBondContact O-N 3.09Å; E600-S604 PolarHBondContact O-OG 2.93Å; E600-K666 WeakPolarHBondContact OE1-CE 3.39Å; E600-K666 IonicContact OE1-NZ 3.24Å; E600-K666 PolarHBondContact OE1-NZ 3.07Å; E600-R699 IonicContact OE2-NH1 3.43Å; E600-R699 PolarHBondContact OE2-NH1 3.2Å
601	Y	67.7	Low	67.3	Low	46 Å²	46	58.8 Å²	58.8	18%	0.18	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-43.2	177.2	-173.6	-89.4	0	0	0	112.5	I569 I597 A598 I599 S604 R605 Y762	I569-Y601 HydrophobicContact CD1-CD1 3.65Å; I569-Y601 HydrophobicContact CD1-CE1 4.35Å; I569-Y601 HydrophobicContact CD1-CG 4.15Å; I569-Y601 HydrophobicContact CG1-CD1 3.88Å; I569-Y601 HydrophobicContact CG2-CD1 3.91Å; I569-Y601 HydrophobicContact CG2-CE1 3.7Å; I597-Y601 WeakPolarHBondContact O-CB 3.5Å; I597-Y601 PolarHBondContact O-N 3.47Å; A598-Y601 WeakPolarHBondContact O-CB 3.19Å; A598-Y601 PolarHBondContact O-N 2.89Å; I599-Y601 PolarHBondContact O-N 3.01Å; Y601-S604 PolarHBondContact O-OG 3.4Å; Y601-R605 WeakPolarHBondContact O-CB 3.45Å; Y601-R605 PolarHBondContact O-N 2.79Å; Y601-R605 VanDerWaalsContact O-N 3.13Å; Y601-R605 PolarHBondContact OH-NH1 3.2Å; Y601-Y762 WeakPolarHBondContact OH-CD1 3.36Å
602	M	67.1	Low	66.8	Low	14 Å²	14	58.1 Å²	58.1	7%	0.069	32%	0.318	C	S	.	.	H	α-helix	trans	-67.3	-43.3	176.8	-72.7	-176.6	-69.7	0	0	112.4	V568 I569 A598 I599 S604 R605 G606 L618	V568-M602 HydrophobicContact CB-CE 4.39Å; V568-M602 HydrophobicContact CB-SD 4.26Å; V568-M602 HydrophobicContact CG1-CE 3.86Å; V568-M602 HydrophobicContact CG1-SD 3.58Å; V568-M602 VanDerWaalsContact CG1-SD 3.58Å; I569-M602 HydrophobicContact CG1-CG 3.78Å; I569-M602 HydrophobicContact CG1-SD 4.27Å; A598-M602 WeakPolarHBondContact O-CE 3.4Å; A598-M602 WeakPolarHBondContact O-CG 3.44Å; A598-M602 PolarHBondContact O-N 2.95Å; I599-M602 HydrophobicContact CG1-CE 4.05Å; I599-M602 PolarHBondContact O-N 2.89Å; M602-S604 VanDerWaalsContact C-N 3.31Å; M602-S604 PolarHBondContact O-N 3.34Å; M602-R605 PolarHBondContact O-N 3.31Å; M602-G606 WeakPolarHBondContact O-CA 3.44Å; M602-G606 PolarHBondContact O-N 2.84Å; M602-L618 HydrophobicContact CE-CD1 4.2Å; M602-L618 HydrophobicContact CE-CD2 3.55Å; M602-L618 HydrophobicContact SD-CD2 4.38Å
603	I	69.9	Low	66.6	Low	58 Å²	58	62 Å²	62	30%	0.297	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-37.8	178	-67	169.4	0	0	0	111	I599 V615	I599-I603 HydrophobicContact CG2-CD1 3.68Å; I599-I603 HydrophobicContact CG2-CG1 4.36Å; I599-I603 WeakPolarHBondContact O-CB 3.17Å; I599-I603 VanDerWaalsContact O-CG1 3.3Å; I599-I603 WeakPolarHBondContact O-CG1 3.3Å; I599-I603 PolarHBondContact O-N 3.19Å; I603-V615 HydrophobicContact CD1-CG1 4.21Å
604	S	67.1	Low	66.4	Low	87 Å²	87	59.8 Å²	59.8	61%	0.608	32%	0.321	S	S	*	.	H	α-helix	trans	-82.5	-18.4	-177.9	57.2	0	0	0	0	115.4	E600 Y601 M602	E600-S604 VanDerWaalsContact O-CB 3.29Å; E600-S604 WeakPolarHBondContact O-CB 3.46Å; E600-S604 PolarHBondContact O-N 3.09Å; E600-S604 PolarHBondContact O-OG 2.93Å; Y601-S604 PolarHBondContact O-OG 3.4Å; M602-S604 VanDerWaalsContact C-N 3.31Å; M602-S604 PolarHBondContact O-N 3.34Å
605	R	61.1	Low	66.4	Low	61 Å²	61	60.1 Å²	60.1	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-135.5	-6.3	-169.2	-69.2	168.9	144.7	-150.1	12.1	115.6	Y601 M602 Y762 D763	Y601-R605 WeakPolarHBondContact O-CB 3.45Å; Y601-R605 PolarHBondContact O-N 2.79Å; Y601-R605 VanDerWaalsContact O-N 3.13Å; Y601-R605 PolarHBondContact OH-NH1 3.2Å; M602-R605 PolarHBondContact O-N 3.31Å; R605-Y762 HydrophobicContact CB-CE1 4.12Å; R605-Y762 WeakPolarHBondContact CB-OH 3.27Å; R605-Y762 HydrophobicContact CG-CE1 4.03Å; R605-Y762 WeakPolarHBondContact CG-OH 3.4Å; R605-Y762 VanDerWaalsContact CZ-CE1 3.49Å; R605-Y762 VanDerWaalsContact NH1-CD1 3.29Å; R605-D763 IonicContact CZ-OD1 3.54Å; R605-D763 IonicContact NH1-OD1 3.65Å; R605-D763 PolarHBondContact NH1-OD1 2.88Å; R605-D763 IonicContact NH2-OD1 2.67Å; R605-D763 PolarHBondContact NH2-OD1 2.86Å
606	G	58.3	Low	66.6	Low	22 Å²	22	64.9 Å²	64.9	23%	0.227	34%	0.343	C	S	.	.			trans	-87	151.9	-175	0	0	0	0	0	115	M602 L608 A609	M602-G606 WeakPolarHBondContact O-CA 3.44Å; M602-G606 PolarHBondContact O-N 2.84Å; G606-L608 PolarHBondContact O-N 3.31Å; G606-A609 PolarHBondContact O-N 2.78Å
607	K	55.7	Low	66.8	Low	190 Å²	190	61.6 Å²	61.6	83%	0.826	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-7.5	168.8	-71.5	-179.4	176.4	176.2	0	114.6
608	L	59.4	Low	66.9	Low	33 Å²	33	57.5 Å²	57.5	17%	0.173	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	9.4	-167.1	-58.9	169	0	0	0	112.2	A577 L580 G606 D610 N611 I614	A577-L608 HydrophobicContact CB-CD2 3.74Å; L580-L608 HydrophobicContact CD2-CD1 3.42Å; L580-L608 VanDerWaalsContact CD2-CD1 3.42Å; G606-L608 PolarHBondContact O-N 3.31Å; L608-D610 PolarHBondContact O-N 2.63Å; L608-N611 PolarHBondContact O-N 3.44Å; L608-I614 HydrophobicContact CB-CD1 4.31Å; L608-I614 HydrophobicContact CD1-CD1 4.04Å; L608-I614 HydrophobicContact CD2-CD1 4Å; L608-I614 HydrophobicContact CG-CD1 4.34Å
609	A	58.9	Low	67	Low	46 Å²	46	65 Å²	65	38%	0.38	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.9	179.3	0	0	0	0	0	113.1	G606 N611	G606-A609 PolarHBondContact O-N 2.78Å; A609-N611 VanDerWaalsContact C-N 3.33Å
610	D	60.9	Low	67	Low	162 Å²	162	68.6 Å²	68.6	87%	0.866	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-11.2	178.2	-56.8	-38.2	0	0	0	113.6	L608 S612	L608-D610 PolarHBondContact O-N 2.63Å; D610-S612 PolarHBondContact O-N 3.08Å
611	N	66.9	Low	66.9	Low	48 Å²	48	65.4 Å²	65.4	26%	0.257	34%	0.338	S	S	.	.			trans	-90.2	92.9	-175.8	-167	-20.5	0	0	0	110.9	L608 A609 E613 I614 V615	L608-N611 PolarHBondContact O-N 3.44Å; A609-N611 VanDerWaalsContact C-N 3.33Å; N611-E613 PolarHBondContact O-N 2.94Å; N611-E613 VanDerWaalsContact O-N 3.17Å; N611-E613 PolarHBondContact OD1-N 3.45Å; N611-I614 HydrophobicContact CB-CB 4.34Å; N611-I614 HydrophobicContact CB-CD1 4.13Å; N611-I614 HydrophobicContact CB-CG1 4.36Å; N611-I614 WeakPolarHBondContact ND2-CD1 3.46Å; N611-I614 PolarHBondContact O-N 2.99Å; N611-I614 VanDerWaalsContact O-N 3.08Å; N611-V615 PolarHBondContact O-N 3.48Å; N611-V615 VanDerWaalsContact O-N 3.12Å
612	S	68.3	Low	66.6	Low	93 Å²	93	64.8 Å²	64.8	65%	0.65	34%	0.342	S	S	*	.	H	α-helix	trans	-52.8	-37.3	-176.4	57.3	0	0	0	0	113.9	D610 V615 E616	D610-S612 PolarHBondContact O-N 3.08Å; S612-V615 PolarHBondContact O-N 2.91Å; S612-E616 WeakPolarHBondContact O-CB 3.48Å; S612-E616 PolarHBondContact O-N 2.84Å
613	E	73.6	Confident	66.2	Low	89 Å²	89	67 Å²	67	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-40.1	-179.4	-166.8	-165	179.3	0	0	111.9	N581 N611 E616 K617	N581-E613 PolarHBondContact ND2-OE2 3.3Å; N611-E613 PolarHBondContact O-N 2.94Å; N611-E613 VanDerWaalsContact O-N 3.17Å; N611-E613 PolarHBondContact OD1-N 3.45Å; E613-E616 PolarHBondContact O-N 2.91Å; E613-K617 HydrophobicContact CG-CD 4.48Å; E613-K617 WeakPolarHBondContact O-CB 3.13Å; E613-K617 WeakPolarHBondContact O-CG 3.4Å; E613-K617 PolarHBondContact O-N 3.18Å; E613-K617 WeakPolarHBondContact OE1-CE 3.49Å; E613-K617 IonicContact OE1-NZ 3.17Å; E613-K617 PolarHBondContact OE1-NZ 3.04Å
614	I	72.8	Confident	65.4	Low	2 Å²	2	65.4 Å²	65.4	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-69.7	-40.8	176.5	-67.2	175.9	0	0	0	110.2	A577 L580 N581 L584 L608 N611 E616 K617 L618	A577-I614 HydrophobicContact CB-CD1 3.88Å; L580-I614 HydrophobicContact CD2-CG2 4.22Å; N581-I614 VanDerWaalsContact OD1-CG1 3.31Å; N581-I614 WeakPolarHBondContact OD1-CG1 3.4Å; L584-I614 HydrophobicContact CD1-CG2 4.16Å; L608-I614 HydrophobicContact CB-CD1 4.31Å; L608-I614 HydrophobicContact CD1-CD1 4.04Å; L608-I614 HydrophobicContact CD2-CD1 4Å; L608-I614 HydrophobicContact CG-CD1 4.34Å; N611-I614 HydrophobicContact CB-CB 4.34Å; N611-I614 HydrophobicContact CB-CD1 4.13Å; N611-I614 HydrophobicContact CB-CG1 4.36Å; N611-I614 WeakPolarHBondContact ND2-CD1 3.46Å; N611-I614 PolarHBondContact O-N 2.99Å; N611-I614 VanDerWaalsContact O-N 3.08Å; I614-E616 VanDerWaalsContact C-N 3.32Å; I614-E616 PolarHBondContact O-N 3.2Å; I614-K617 PolarHBondContact O-N 2.91Å; I614-L618 HydrophobicContact CG2-CD1 3.97Å; I614-L618 HydrophobicContact CG2-CG 4.31Å; I614-L618 VanDerWaalsContact O-CB 3.32Å; I614-L618 WeakPolarHBondContact O-CB 3.29Å; I614-L618 VanDerWaalsContact O-CG 3.22Å; I614-L618 WeakPolarHBondContact O-CG 3.4Å; I614-L618 PolarHBondContact O-N 3.25Å
615	V	71	Confident	64.6	Low	19 Å²	19	61.9 Å²	61.9	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-38.9	176.1	176.8	0	0	0	0	111.3	I603 N611 S612 R619	I603-V615 HydrophobicContact CD1-CG1 4.21Å; N611-V615 PolarHBondContact O-N 3.48Å; N611-V615 VanDerWaalsContact O-N 3.12Å; S612-V615 PolarHBondContact O-N 2.91Å; V615-R619 WeakPolarHBondContact O-CG 3.12Å; V615-R619 PolarHBondContact O-N 2.83Å; V615-R619 VanDerWaalsContact O-N 3.11Å
616	E	75	Confident	63.8	Low	125 Å²	125	65.6 Å²	65.6	58%	0.584	35%	0.35	S	S	*	.	H	α-helix	trans	-67.8	-47.7	175.5	-171.6	167.9	-161.5	0	0	111.8	S612 E613 I614 L618 R619 L620	S612-E616 WeakPolarHBondContact O-CB 3.48Å; S612-E616 PolarHBondContact O-N 2.84Å; E613-E616 PolarHBondContact O-N 2.91Å; I614-E616 VanDerWaalsContact C-N 3.32Å; I614-E616 PolarHBondContact O-N 3.2Å; E616-L618 PolarHBondContact O-N 3.41Å; E616-R619 WeakPolarHBondContact O-CB 3.35Å; E616-R619 PolarHBondContact O-N 2.94Å; E616-R619 VanDerWaalsContact O-N 3.13Å; E616-L620 HydrophobicContact CG-CD1 4.27Å; E616-L620 WeakPolarHBondContact O-CG 3.41Å; E616-L620 PolarHBondContact O-N 3.38Å
617	K	74.4	Confident	63	Low	24 Å²	24	71.6 Å²	71.6	10%	0.104	37%	0.372	C	S	.	.	H	α-helix	trans	-61.2	-40	174.8	-73.8	174	-171.3	170.5	0	112.6	N581 L584 E585 I588 E613 I614 R619 L620 V621	N581-K617 WeakPolarHBondContact OD1-CD 3.44Å; N581-K617 PolarHBondContact OD1-NZ 3.3Å; L584-K617 HydrophobicContact CB-CB 4.46Å; L584-K617 HydrophobicContact CD1-CB 4.43Å; E585-K617 HydrophobicContact CG-CD 4.35Å; E585-K617 IonicContact OE1-NZ 2.7Å; E585-K617 PolarHBondContact OE1-NZ 2.91Å; I588-K617 HydrophobicContact CD1-CB 4.22Å; I588-K617 HydrophobicContact CD1-CG 4.34Å; E613-K617 HydrophobicContact CG-CD 4.48Å; E613-K617 WeakPolarHBondContact O-CB 3.13Å; E613-K617 WeakPolarHBondContact O-CG 3.4Å; E613-K617 PolarHBondContact O-N 3.18Å; E613-K617 WeakPolarHBondContact OE1-CE 3.49Å; E613-K617 IonicContact OE1-NZ 3.17Å; E613-K617 PolarHBondContact OE1-NZ 3.04Å; I614-K617 PolarHBondContact O-N 2.91Å; K617-R619 VanDerWaalsContact C-N 3.33Å; K617-R619 PolarHBondContact O-N 3.41Å; K617-L620 PolarHBondContact O-N 3.45Å; K617-V621 WeakPolarHBondContact O-CG2 3.42Å; K617-V621 PolarHBondContact O-N 2.92Å
618	L	69.9	Low	62.2	Low	7 Å²	7	68.2 Å²	68.2	4%	0.037	37%	0.368	C	S	.	.	H	α-helix	trans	-60.6	-40.5	173.6	-76.6	172.7	0	0	0	112.1	V568 L584 I599 M602 I614 E616 V621 A622	V568-L618 HydrophobicContact CG1-CD2 4.46Å; L584-L618 HydrophobicContact CD1-CD2 3.87Å; L584-L618 HydrophobicContact CD1-CG 3.94Å; L584-L618 HydrophobicContact CD2-CD2 3.69Å; L584-L618 HydrophobicContact CG-CD2 4.46Å; I599-L618 WeakPolarHBondContact CD1-O 3.34Å; I599-L618 HydrophobicContact CG2-CB 4.18Å; M602-L618 HydrophobicContact CE-CD1 4.2Å; M602-L618 HydrophobicContact CE-CD2 3.55Å; M602-L618 HydrophobicContact SD-CD2 4.38Å; I614-L618 HydrophobicContact CG2-CD1 3.97Å; I614-L618 HydrophobicContact CG2-CG 4.31Å; I614-L618 VanDerWaalsContact O-CB 3.32Å; I614-L618 WeakPolarHBondContact O-CB 3.29Å; I614-L618 VanDerWaalsContact O-CG 3.22Å; I614-L618 WeakPolarHBondContact O-CG 3.4Å; I614-L618 PolarHBondContact O-N 3.25Å; E616-L618 PolarHBondContact O-N 3.41Å; L618-V621 PolarHBondContact O-N 3.34Å; L618-A622 PolarHBondContact O-N 3.04Å
619	R	70.2	Confident	61	Low	163 Å²	163	70 Å²	70	62%	0.615	39%	0.388	S	S	*	.	H	α-helix	trans	-67.7	-36.4	173.8	-71.6	171.8	-179.5	176.2	2.1	112.3	V615 E616 K617 A622 S623	V615-R619 WeakPolarHBondContact O-CG 3.12Å; V615-R619 PolarHBondContact O-N 2.83Å; V615-R619 VanDerWaalsContact O-N 3.11Å; E616-R619 WeakPolarHBondContact O-CB 3.35Å; E616-R619 PolarHBondContact O-N 2.94Å; E616-R619 VanDerWaalsContact O-N 3.13Å; K617-R619 VanDerWaalsContact C-N 3.33Å; K617-R619 PolarHBondContact O-N 3.41Å; R619-A622 WeakPolarHBondContact O-CB 3.36Å; R619-A622 PolarHBondContact O-N 2.98Å; R619-S623 PolarHBondContact O-N 3.01Å; R619-S623 PolarHBondContact O-OG 3.26Å
620	L	68.9	Low	59.7	Low	84 Å²	84	71.1 Å²	71.1	44%	0.44	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-34.7	175.1	-71.4	166.5	0	0	0	112.9	I588 E616 K617 A622 S623 S624	I588-L620 HydrophobicContact CD1-CB 4.11Å; E616-L620 HydrophobicContact CG-CD1 4.27Å; E616-L620 WeakPolarHBondContact O-CG 3.41Å; E616-L620 PolarHBondContact O-N 3.38Å; K617-L620 PolarHBondContact O-N 3.45Å; L620-A622 VanDerWaalsContact C-N 3.33Å; L620-S623 WeakPolarHBondContact CA-OG 3.38Å; L620-S623 PolarHBondContact O-N 3.23Å; L620-S623 PolarHBondContact O-OG 3.19Å; L620-S624 WeakPolarHBondContact O-CB 3.48Å; L620-S624 PolarHBondContact O-N 2.83Å; L620-S624 PolarHBondContact O-OG 3.35Å
621	V	67.8	Low	58.3	Low	1 Å²	1	73.6 Å²	73.6	1%	0.006	40%	0.4	C	S	.	.	H	α-helix	trans	-62.8	-39.6	170.4	178.5	0	0	0	0	110.9	L584 I588 V594 K617 L618 S624	L584-V621 HydrophobicContact CD2-CG2 4.34Å; I588-V621 HydrophobicContact CD1-CG2 4.05Å; I588-V621 HydrophobicContact CG1-CB 4.42Å; I588-V621 HydrophobicContact CG1-CG2 3.39Å; V594-V621 HydrophobicContact CB-CG1 3.81Å; V594-V621 HydrophobicContact CG2-CG1 3.45Å; V594-V621 VanDerWaalsContact CG2-CG1 3.45Å; K617-V621 WeakPolarHBondContact O-CG2 3.42Å; K617-V621 PolarHBondContact O-N 2.92Å; L618-V621 PolarHBondContact O-N 3.34Å; V621-S624 PolarHBondContact O-OG 2.86Å
622	A	61.2	Low	57.2	Low	33 Å²	33	73.8 Å²	73.8	27%	0.273	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-51.7	175.2	0	0	0	0	0	111.8	I599 L618 R619 L620 S624 G625	I599-A622 HydrophobicContact CD1-CB 3.81Å; L618-A622 PolarHBondContact O-N 3.04Å; R619-A622 WeakPolarHBondContact O-CB 3.36Å; R619-A622 PolarHBondContact O-N 2.98Å; L620-A622 VanDerWaalsContact C-N 3.33Å; A622-S624 PolarHBondContact O-N 3.01Å; A622-G625 PolarHBondContact O-N 2.81Å
623	S	58.7	Low	56.2	Low	60 Å²	60	73.7 Å²	73.7	42%	0.42	41%	0.405	S	S	.	.	H	α-helix	trans	-68.3	-30.1	-176.9	58	0	0	0	0	114	R619 L620 G625 E626	R619-S623 PolarHBondContact O-N 3.01Å; R619-S623 PolarHBondContact O-OG 3.26Å; L620-S623 WeakPolarHBondContact CA-OG 3.38Å; L620-S623 PolarHBondContact O-N 3.23Å; L620-S623 PolarHBondContact O-OG 3.19Å; S623-G625 VanDerWaalsContact C-N 3.25Å; S623-G625 PolarHBondContact O-N 3.41Å; S623-E626 PolarHBondContact O-N 3.48Å
624	S	54.4	Low	55.2	Low	24 Å²	24	76.3 Å²	76.3	17%	0.168	42%	0.422	C	S	.	.	H	α-helix	trans	-72.9	-14.3	-179.1	51.7	0	0	0	0	114.3	L620 V621 A622	L620-S624 WeakPolarHBondContact O-CB 3.48Å; L620-S624 PolarHBondContact O-N 2.83Å; L620-S624 PolarHBondContact O-OG 3.35Å; V621-S624 PolarHBondContact O-OG 2.86Å; A622-S624 PolarHBondContact O-N 3.01Å
625	G	50	Low	54.5	Low	13 Å²	13	77.8 Å²	77.8	13%	0.134	43%	0.43	C	S	.	.	H	α-helix	trans	-82.1	-25.5	172.5	0	0	0	0	0	114.7	A622 S623 E627 T628	A622-G625 PolarHBondContact O-N 2.81Å; S623-G625 VanDerWaalsContact C-N 3.25Å; S623-G625 PolarHBondContact O-N 3.41Å; G625-E627 PolarHBondContact O-N 3.36Å; G625-T628 PolarHBondContact O-N 3.31Å; G625-T628 PolarHBondContact O-OG1 3.09Å
626	E	44.1	Very low	54.3	Low	140 Å²	140	80.5 Å²	80.5	65%	0.654	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-66.7	-30.9	-167.2	-63.7	-170.7	136	0	0	114	S623 T628 A629	S623-E626 PolarHBondContact O-N 3.48Å; E626-T628 PolarHBondContact O-N 3.12Å; E626-T628 VanDerWaalsContact O-N 3.12Å; E626-A629 PolarHBondContact O-N 3.45Å; E626-A629 VanDerWaalsContact O-N 3.16Å
627	E	40.3	Very low	53.9	Low	147 Å²	147	74.8 Å²	74.8	69%	0.687	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-63.5	-18.7	179.5	-69.2	-169.7	139.4	0	0	113.9	K591 G625	K591-E627 IonicContact NZ-OE2 3.14Å; K591-E627 PolarHBondContact NZ-OE2 3.04Å; G625-E627 PolarHBondContact O-N 3.36Å
628	T	38.6	Very low	53.7	Low	120 Å²	120	78.7 Å²	78.7	74%	0.736	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-91.1	-7.7	179.3	62.3	0	0	0	0	114.2	G625 E626	G625-T628 PolarHBondContact O-N 3.31Å; G625-T628 PolarHBondContact O-OG1 3.09Å; E626-T628 PolarHBondContact O-N 3.12Å; E626-T628 VanDerWaalsContact O-N 3.12Å
629	A	34.7	Very low	53.8	Low	71 Å²	71	83.1 Å²	83.1	59%	0.587	46%	0.462	S	S	*	.	S	Bend	trans	-98.3	-3.1	176.7	0	0	0	0	0	113.7	E626 K631	E626-A629 PolarHBondContact O-N 3.45Å; E626-A629 VanDerWaalsContact O-N 3.16Å; A629-K631 PolarHBondContact O-N 3.39Å
630	A	31.6	Very low	53.7	Low	69 Å²	69	75.3 Å²	75.3	57%	0.57	43%	0.432	S	S	*	.			trans	-93	73.9	-168	0	0	0	0	0	114.5
631	K	32.8	Very low	53.7	Low	214 Å²	214	74.4 Å²	74.4	93%	0.93	43%	0.427	S	S	*	.			trans	-167.1	53.4	153.6	-111.1	172.8	-166.7	179.1	0	113	A629	A629-K631 PolarHBondContact O-N 3.39Å
632	A	42.2	Very low	53.7	Low	52 Å²	52	77.7 Å²	77.7	43%	0.43	45%	0.45	S	S	.	.			trans	-102	143.4	163.3	0	0	0	0	0	109.2
633	P	47.8	Very low	54.1	Low	91 Å²	91	78.4 Å²	78.4	59%	0.591	45%	0.45	S	S	*	.			trans	-64.2	162.8	-175.6	26.9	-34.9	0	0	0	113	D635	P633-D635 PolarHBondContact O-N 2.94Å
634	D	52.6	Low	54.3	Low	143 Å²	143	79.7 Å²	79.7	77%	0.765	45%	0.448	S	S	*	.			trans	-68.3	66.6	173.9	-71.3	-40.3	0	0	0	111.7	T636 K639	D634-T636 PolarHBondContact O-N 2.67Å; D634-K639 WeakPolarHBondContact O-CD 3.37Å; D634-K639 PolarHBondContact O-NZ 3.16Å
635	D	59.5	Low	54.5	Low	33 Å²	33	84.3 Å²	84.3	18%	0.176	48%	0.475	C	S	.	.			trans	-81.7	107.5	169.5	-72.7	-42.1	0	0	0	109.1	P633 I640 R654 L658	P633-D635 PolarHBondContact O-N 2.94Å; D635-I640 HydrophobicContact CB-CD1 4.07Å; D635-I640 HydrophobicContact CB-CG1 4.03Å; D635-R654 IonicContact OD1-NH1 3.32Å; D635-R654 PolarHBondContact OD1-NH1 3.35Å; D635-R654 VanDerWaalsContact OD2-CD 3.25Å; D635-R654 WeakPolarHBondContact OD2-CD 3.42Å; D635-R654 IonicContact OD2-NH1 3.22Å; D635-L658 WeakPolarHBondContact O-CD1 3.47Å; D635-L658 WeakPolarHBondContact O-CD2 3.38Å
636	T	66.1	Low	54.9	Low	76 Å²	76	89.5 Å²	89.5	47%	0.466	51%	0.505	S	S	.	.			trans	-82.8	158.8	165.4	55.3	0	0	0	0	109.8	D634 D638 K639 I640	D634-T636 PolarHBondContact O-N 2.67Å; T636-D638 PolarHBondContact O-N 3.2Å; T636-K639 WeakPolarHBondContact O-CB 3.34Å; T636-K639 PolarHBondContact O-N 3Å; T636-K639 PolarHBondContact OG1-N 3.18Å; T636-I640 PolarHBondContact O-N 2.98Å; T636-I640 VanDerWaalsContact O-N 3.13Å
637	A	65.8	Low	55.4	Low	5 Å²	5	84 Å²	84	4%	0.041	49%	0.485	C	S	.	.	H	α-helix	trans	-54.7	-41	176.4	0	0	0	0	0	111.5	K639 I640 L641 L658 L674	A637-K639 PolarHBondContact O-N 3.38Å; A637-I640 PolarHBondContact O-N 2.78Å; A637-L641 WeakPolarHBondContact O-CB 3.45Å; A637-L641 VanDerWaalsContact O-CG 3.23Å; A637-L641 WeakPolarHBondContact O-CG 3.41Å; A637-L641 PolarHBondContact O-N 2.89Å; A637-L658 HydrophobicContact CB-CD2 4.34Å; A637-L674 HydrophobicContact CB-CD1 4.4Å; A637-L674 HydrophobicContact CB-CD2 4.25Å; A637-L674 HydrophobicContact CB-CG 4.22Å
638	D	71.2	Confident	56.2	Low	107 Å²	107	79 Å²	79	57%	0.572	47%	0.473	S	S	*	.	H	α-helix	trans	-65.3	-32.8	177.8	-57.3	-38	0	0	0	113.2	T636 S642	T636-D638 PolarHBondContact O-N 3.2Å; D638-S642 PolarHBondContact O-N 3.19Å; D638-S642 PolarHBondContact O-OG 3.32Å
639	K	71.7	Confident	57.2	Low	99 Å²	99	83.7 Å²	83.7	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-66.2	-47.6	172.2	-89.8	-177.8	178.5	177.2	0	111.9	D634 T636 A637 L641 S642 D643	D634-K639 WeakPolarHBondContact O-CD 3.37Å; D634-K639 PolarHBondContact O-NZ 3.16Å; T636-K639 WeakPolarHBondContact O-CB 3.34Å; T636-K639 PolarHBondContact O-N 3Å; T636-K639 PolarHBondContact OG1-N 3.18Å; A637-K639 PolarHBondContact O-N 3.38Å; K639-L641 VanDerWaalsContact C-N 3.26Å; K639-L641 PolarHBondContact O-N 3.17Å; K639-S642 WeakPolarHBondContact CA-OG 3.43Å; K639-S642 PolarHBondContact O-N 3.4Å; K639-S642 VanDerWaalsContact O-N 3.12Å; K639-S642 PolarHBondContact O-OG 3.28Å; K639-D643 WeakPolarHBondContact O-CB 3.19Å; K639-D643 VanDerWaalsContact O-CG 3.29Å; K639-D643 PolarHBondContact O-N 2.7Å
640	I	68.8	Low	58.7	Low	0 Å²	0	85.6 Å²	85.6	0%	0	48%	0.478	C	S	.	.	H	α-helix	trans	-61.7	-40	179.2	-62.4	-173.1	0	0	0	110.2	D635 T636 A637 D643 F644 V651 R654 A655 L658 L674 F677	D635-I640 HydrophobicContact CB-CD1 4.07Å; D635-I640 HydrophobicContact CB-CG1 4.03Å; T636-I640 PolarHBondContact O-N 2.98Å; T636-I640 VanDerWaalsContact O-N 3.13Å; A637-I640 PolarHBondContact O-N 2.78Å; I640-D643 PolarHBondContact O-N 2.88Å; I640-F644 PolarHBondContact O-N 3.39Å; I640-V651 HydrophobicContact CG2-CG1 3.88Å; I640-R654 HydrophobicContact CD1-CB 3.99Å; I640-A655 HydrophobicContact CG2-CB 3.94Å; I640-L658 HydrophobicContact CD1-CB 3.78Å; I640-L658 HydrophobicContact CD1-CD2 3.56Å; I640-L658 HydrophobicContact CD1-CG 4.31Å; I640-L658 HydrophobicContact CG1-CD2 4.36Å; I640-L674 HydrophobicContact CD1-CD2 4.45Å; I640-L674 HydrophobicContact CG2-CD2 4.5Å; I640-F677 HydrophobicContact CG2-CE1 4.37Å
641	L	68.5	Low	60.5	Low	64 Å²	64	82.4 Å²	82.4	34%	0.335	45%	0.451	S	S	.	.	H	α-helix	trans	-65.1	-37	174	-69.3	169.2	0	0	0	112.6	A637 K639 F644 F677	A637-L641 WeakPolarHBondContact O-CB 3.45Å; A637-L641 VanDerWaalsContact O-CG 3.23Å; A637-L641 WeakPolarHBondContact O-CG 3.41Å; A637-L641 PolarHBondContact O-N 2.89Å; K639-L641 VanDerWaalsContact C-N 3.26Å; K639-L641 PolarHBondContact O-N 3.17Å; L641-F644 WeakPolarHBondContact O-CB 3.4Å; L641-F677 HydrophobicContact CD2-CB 3.96Å; L641-F677 HydrophobicContact CD2-CD2 3.51Å; L641-F677 HydrophobicContact CD2-CE2 4.17Å; L641-F677 HydrophobicContact CD2-CG 3.8Å
642	S	68.2	Low	62.3	Low	70 Å²	70	72.8 Å²	72.8	49%	0.49	41%	0.411	S	S	.	.	H	α-helix	trans	-72	-37.4	175.5	62.9	0	0	0	0	113.4	D638 K639 F644 T645	D638-S642 PolarHBondContact O-N 3.19Å; D638-S642 PolarHBondContact O-OG 3.32Å; K639-S642 WeakPolarHBondContact CA-OG 3.43Å; K639-S642 PolarHBondContact O-N 3.4Å; K639-S642 VanDerWaalsContact O-N 3.12Å; K639-S642 PolarHBondContact O-OG 3.28Å; S642-F644 PolarHBondContact O-N 3.21Å; S642-T645 PolarHBondContact O-OG1 3.44Å
643	D	67.8	Low	63.6	Low	49 Å²	49	73.5 Å²	73.5	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-69.4	-18.1	-178.1	-74.5	-1.6	0	0	0	113.2	K639 I640 T645 T646 V651 R654	K639-D643 WeakPolarHBondContact O-CB 3.19Å; K639-D643 VanDerWaalsContact O-CG 3.29Å; K639-D643 PolarHBondContact O-N 2.7Å; I640-D643 PolarHBondContact O-N 2.88Å; D643-T645 PolarHBondContact O-N 3.18Å; D643-T646 PolarHBondContact O-N 2.96Å; D643-T646 PolarHBondContact O-OG1 3.38Å; D643-V651 HydrophobicContact CB-CG2 4.12Å; D643-R654 IonicContact OD2-CZ 2.7Å; D643-R654 IonicContact OD2-NH1 2.76Å; D643-R654 PolarHBondContact OD2-NH1 3.38Å; D643-R654 IonicContact OD2-NH2 2.73Å; D643-R654 PolarHBondContact OD2-NH2 3.42Å
644	F	63.3	Low	64.7	Low	86 Å²	86	71.4 Å²	71.4	38%	0.377	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-30.9	178.3	176.6	-115.7	0	0	0	113.7	I640 L641 S642 T646 F677 N681	I640-F644 PolarHBondContact O-N 3.39Å; L641-F644 WeakPolarHBondContact O-CB 3.4Å; S642-F644 PolarHBondContact O-N 3.21Å; F644-T646 PolarHBondContact O-N 3.13Å; F644-F677 HydrophobicContact CB-CE2 3.96Å; F644-F677 HydrophobicContact CB-CZ 4.12Å; F644-F677 HydrophobicContact CD1-CE2 4.46Å; F644-F677 AromaticContact CD2-CE2 3.55Å; F644-F677 HydrophobicContact CD2-CE2 3.55Å; F644-F677 AromaticContact CD2-CZ 3.58Å; F644-F677 HydrophobicContact CD2-CZ 3.58Å; F644-F677 HydrophobicContact CE2-CE2 4.13Å; F644-F677 HydrophobicContact CE2-CZ 4.3Å; F644-F677 AromaticContact CG-CE2 3.73Å; F644-F677 HydrophobicContact CG-CE2 3.73Å; F644-F677 HydrophobicContact CG-CZ 4.07Å; F644-N681 HydrophobicContact CE2-CB 3.98Å; F644-N681 WeakPolarHBondContact CE2-OD1 3.19Å; F644-N681 HydrophobicContact CZ-CB 4.42Å; F644-N681 WeakPolarHBondContact CZ-OD1 3.27Å
645	T	59.5	Low	65.7	Low	122 Å²	122	64.6 Å²	64.6	75%	0.748	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-10.3	177.4	56.7	0	0	0	0	114.8	S642 D643	S642-T645 PolarHBondContact O-OG1 3.44Å; D643-T645 PolarHBondContact O-N 3.18Å
646	T	58	Low	66.2	Low	122 Å²	122	65.3 Å²	65.3	75%	0.748	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	-13.3	-169.2	62.6	0	0	0	0	116.5	D643 F644	D643-T646 PolarHBondContact O-N 2.96Å; D643-T646 PolarHBondContact O-OG1 3.38Å; F644-T646 PolarHBondContact O-N 3.13Å
647	G	54.4	Low	66.4	Low	24 Å²	24	69.3 Å²	69.3	25%	0.247	36%	0.359	C	S	.	.			trans	-149	127.3	-176.7	0	0	0	0	0	114.4	V651	G647-V651 VanDerWaalsContact O-CB 3.3Å; G647-V651 WeakPolarHBondContact O-CB 3.48Å; G647-V651 WeakPolarHBondContact O-CG2 3.22Å
648	G	57.4	Low	66.9	Low	42 Å²	42	70.1 Å²	70.1	43%	0.433	36%	0.363	S	S	.	.	S	Bend	trans	-77	-88.5	179	0	0	0	0	0	113.5	D650 V651 S652 Y682	G648-D650 VanDerWaalsContact C-N 3.28Å; G648-D650 PolarHBondContact O-N 3.15Å; G648-V651 PolarHBondContact O-N 2.9Å; G648-S652 PolarHBondContact O-N 2.89Å; G648-Y682 WeakPolarHBondContact CA-OH 3.31Å; G648-Y682 PolarHBondContact O-OH 2.93Å
649	R	60	Low	67.2	Low	219 Å²	219	65 Å²	65	83%	0.826	34%	0.335	S	S	*	.	H	α-helix	trans	-61.2	-30.3	-173.7	-71.8	-176.5	175.3	176.1	-2.1	114.9	V651 S652 I653	R649-V651 VanDerWaalsContact C-N 3.33Å; R649-S652 PolarHBondContact O-N 3.39Å; R649-S652 PolarHBondContact O-OG 2.98Å; R649-S652 VanDerWaalsContact O-OG 3.13Å; R649-I653 WeakPolarHBondContact O-CG1 3.47Å; R649-I653 PolarHBondContact O-N 3.33Å
650	D	65.7	Low	67.1	Low	111 Å²	111	64.7 Å²	64.7	59%	0.594	34%	0.335	S	S	*	.	H	α-helix	trans	-74.1	-28.9	-177.4	-147.3	19.1	0	0	0	111.6	G648 R654	G648-D650 VanDerWaalsContact C-N 3.28Å; G648-D650 PolarHBondContact O-N 3.15Å; D650-R654 WeakPolarHBondContact O-CB 3.49Å; D650-R654 VanDerWaalsContact O-CG 3.29Å; D650-R654 WeakPolarHBondContact O-CG 3.35Å; D650-R654 PolarHBondContact O-N 3.47Å; D650-R654 VanDerWaalsContact O-N 3.16Å; D650-R654 PolarHBondContact O-NE 3.12Å
651	V	70.3	Confident	67.2	Low	1 Å²	1	70.1 Å²	70.1	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-75.1	-35.5	173.8	174.1	0	0	0	0	111	I640 D643 G647 G648 R649 A655 F677	I640-V651 HydrophobicContact CG2-CG1 3.88Å; D643-V651 HydrophobicContact CB-CG2 4.12Å; G647-V651 VanDerWaalsContact O-CB 3.3Å; G647-V651 WeakPolarHBondContact O-CB 3.48Å; G647-V651 WeakPolarHBondContact O-CG2 3.22Å; G648-V651 PolarHBondContact O-N 2.9Å; R649-V651 VanDerWaalsContact C-N 3.33Å; V651-A655 VanDerWaalsContact O-CB 3.23Å; V651-A655 WeakPolarHBondContact O-CB 3.31Å; V651-A655 PolarHBondContact O-N 2.95Å; V651-F677 HydrophobicContact CG1-CE1 3.75Å; V651-F677 HydrophobicContact CG1-CZ 3.56Å
652	S	70.8	Confident	67.4	Low	13 Å²	13	67.1 Å²	67.1	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-47.4	174.7	83.6	0	0	0	0	111.6	G648 R649 R654 A655 E656	G648-S652 PolarHBondContact O-N 2.89Å; R649-S652 PolarHBondContact O-N 3.39Å; R649-S652 PolarHBondContact O-OG 2.98Å; R649-S652 VanDerWaalsContact O-OG 3.13Å; S652-R654 VanDerWaalsContact C-N 3.33Å; S652-R654 PolarHBondContact O-N 2.96Å; S652-A655 CarbonylContact O-C 3.35Å; S652-A655 PolarHBondContact O-N 2.95Å; S652-A655 VanDerWaalsContact O-N 3.16Å; S652-E656 WeakPolarHBondContact O-CB 3.3Å; S652-E656 WeakPolarHBondContact O-CG 3.42Å; S652-E656 PolarHBondContact O-N 3.46Å
653	I	69.5	Low	67.5	Low	66 Å²	66	65 Å²	65	34%	0.338	32%	0.324	S	S	.	.	H	α-helix	trans	-64	-37.3	179.4	-63.7	166.9	0	0	0	111.6	R649 R657	R649-I653 WeakPolarHBondContact O-CG1 3.47Å; R649-I653 PolarHBondContact O-N 3.33Å; I653-R657 VanDerWaalsContact O-CG 3.3Å; I653-R657 WeakPolarHBondContact O-CG 3.27Å; I653-R657 PolarHBondContact O-N 2.82Å; I653-R657 VanDerWaalsContact O-N 3.1Å
654	R	70.4	Confident	67.5	Low	48 Å²	48	65.3 Å²	65.3	18%	0.181	33%	0.333	C	S	.	.	H	α-helix	trans	-67.8	-42	173.1	-73.2	-170.1	-66.1	148.2	-4.9	112	D635 I640 D643 D650 S652 R657 L658	D635-R654 IonicContact OD1-NH1 3.32Å; D635-R654 PolarHBondContact OD1-NH1 3.35Å; D635-R654 VanDerWaalsContact OD2-CD 3.25Å; D635-R654 WeakPolarHBondContact OD2-CD 3.42Å; D635-R654 IonicContact OD2-NH1 3.22Å; I640-R654 HydrophobicContact CD1-CB 3.99Å; D643-R654 IonicContact OD2-CZ 2.7Å; D643-R654 IonicContact OD2-NH1 2.76Å; D643-R654 PolarHBondContact OD2-NH1 3.38Å; D643-R654 IonicContact OD2-NH2 2.73Å; D643-R654 PolarHBondContact OD2-NH2 3.42Å; D650-R654 WeakPolarHBondContact O-CB 3.49Å; D650-R654 VanDerWaalsContact O-CG 3.29Å; D650-R654 WeakPolarHBondContact O-CG 3.35Å; D650-R654 PolarHBondContact O-N 3.47Å; D650-R654 VanDerWaalsContact O-N 3.16Å; D650-R654 PolarHBondContact O-NE 3.12Å; S652-R654 VanDerWaalsContact C-N 3.33Å; S652-R654 PolarHBondContact O-N 2.96Å; R654-R657 PolarHBondContact O-N 2.8Å; R654-L658 WeakPolarHBondContact O-CB 3.37Å; R654-L658 PolarHBondContact O-N 2.7Å
655	A	73.1	Confident	67.9	Low	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-39.7	175.7	0	0	0	0	0	112.3	I640 V651 S652 L658 L659 L674 F677 L678	I640-A655 HydrophobicContact CG2-CB 3.94Å; V651-A655 VanDerWaalsContact O-CB 3.23Å; V651-A655 WeakPolarHBondContact O-CB 3.31Å; V651-A655 PolarHBondContact O-N 2.95Å; S652-A655 CarbonylContact O-C 3.35Å; S652-A655 PolarHBondContact O-N 2.95Å; S652-A655 VanDerWaalsContact O-N 3.16Å; A655-L658 PolarHBondContact O-N 3.02Å; A655-L659 WeakPolarHBondContact O-CB 3.34Å; A655-L659 PolarHBondContact O-N 3.36Å; A655-L674 HydrophobicContact CB-CD2 4.44Å; A655-F677 HydrophobicContact CB-CD1 4.13Å; A655-F677 HydrophobicContact CB-CE1 4.1Å; A655-L678 HydrophobicContact CB-CD1 4.36Å; A655-L678 HydrophobicContact CB-CD2 3.79Å; A655-L678 HydrophobicContact CB-CG 4.02Å
656	E	69.8	Low	68.3	Low	47 Å²	47	65.1 Å²	65.1	22%	0.22	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-48.9	173.3	-72.7	160.3	-155.6	0	0	111.4	S652 L659 Q660 L678 S685 F689	S652-E656 WeakPolarHBondContact O-CB 3.3Å; S652-E656 WeakPolarHBondContact O-CG 3.42Å; S652-E656 PolarHBondContact O-N 3.46Å; E656-L659 PolarHBondContact O-N 3.23Å; E656-Q660 WeakPolarHBondContact O-CG 3.45Å; E656-Q660 PolarHBondContact O-N 3.3Å; E656-L678 HydrophobicContact CG-CD1 4.29Å; E656-L678 HydrophobicContact CG-CD2 4.46Å; E656-S685 WeakPolarHBondContact CG-OG 3.45Å; E656-S685 VanDerWaalsContact OE1-CB 3.3Å; E656-S685 WeakPolarHBondContact OE1-CB 3.32Å; E656-S685 PolarHBondContact OE1-OG 2.88Å; E656-F689 HydrophobicContact CB-CE2 4.21Å; E656-F689 HydrophobicContact CB-CZ 4.24Å; E656-F689 HydrophobicContact CG-CE2 4.01Å
657	R	70.3	Confident	69.1	Low	161 Å²	161	63.6 Å²	63.6	61%	0.608	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-43	178.6	-73.2	172.5	178.8	177.3	1.1	112.3	I653 R654 L659 Q660 R661	I653-R657 VanDerWaalsContact O-CG 3.3Å; I653-R657 WeakPolarHBondContact O-CG 3.27Å; I653-R657 PolarHBondContact O-N 2.82Å; I653-R657 VanDerWaalsContact O-N 3.1Å; R654-R657 PolarHBondContact O-N 2.8Å; R657-L659 VanDerWaalsContact C-N 3.34Å; R657-Q660 PolarHBondContact O-N 3.05Å; R657-R661 PolarHBondContact O-N 2.82Å
658	L	76.3	Confident	70	Confident	21 Å²	21	64.3 Å²	64.3	11%	0.11	30%	0.301	C	S	.	.	H	α-helix	trans	-70.8	-32	177	-168.6	64.7	0	0	0	111.4	D635 A637 I640 R654 A655 R661 T662 L674	D635-L658 WeakPolarHBondContact O-CD1 3.47Å; D635-L658 WeakPolarHBondContact O-CD2 3.38Å; A637-L658 HydrophobicContact CB-CD2 4.34Å; I640-L658 HydrophobicContact CD1-CB 3.78Å; I640-L658 HydrophobicContact CD1-CD2 3.56Å; I640-L658 HydrophobicContact CD1-CG 4.31Å; I640-L658 HydrophobicContact CG1-CD2 4.36Å; R654-L658 WeakPolarHBondContact O-CB 3.37Å; R654-L658 PolarHBondContact O-N 2.7Å; A655-L658 PolarHBondContact O-N 3.02Å; L658-R661 PolarHBondContact O-N 3.42Å; L658-T662 HydrophobicContact CD1-CG2 4.41Å; L658-T662 HydrophobicContact CG-CG2 4.27Å; L658-T662 WeakPolarHBondContact O-CB 3.46Å; L658-T662 VanDerWaalsContact O-CG2 3.29Å; L658-T662 WeakPolarHBondContact O-CG2 3.43Å; L658-T662 PolarHBondContact O-N 2.69Å; L658-T662 PolarHBondContact O-OG1 2.76Å; L658-L674 HydrophobicContact CB-CD1 3.97Å; L658-L674 HydrophobicContact CD2-CD1 3.73Å; L658-L674 HydrophobicContact CD2-CD2 4.14Å; L658-L674 HydrophobicContact CG-CD1 3.62Å
659	L	76.8	Confident	71	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-52.6	171	-175.5	56.2	0	0	0	109.8	A655 E656 R657 R661 T662 L663 A671 L674 Y675 L678 F689	A655-L659 WeakPolarHBondContact O-CB 3.34Å; A655-L659 PolarHBondContact O-N 3.36Å; E656-L659 PolarHBondContact O-N 3.23Å; R657-L659 VanDerWaalsContact C-N 3.34Å; L659-R661 PolarHBondContact O-N 3.13Å; L659-R661 VanDerWaalsContact O-N 3.16Å; L659-T662 WeakPolarHBondContact CA-OG1 3.37Å; L659-T662 PolarHBondContact O-N 3.35Å; L659-T662 VanDerWaalsContact O-N 3.16Å; L659-T662 PolarHBondContact O-OG1 3.27Å; L659-T662 VanDerWaalsContact O-OG1 3.05Å; L659-L663 HydrophobicContact CD1-CD1 4.37Å; L659-L663 HydrophobicContact CD1-CD2 3.81Å; L659-L663 HydrophobicContact CD1-CG 3.86Å; L659-L663 HydrophobicContact CG-CD1 4.3Å; L659-L663 HydrophobicContact CG-CG 4.13Å; L659-L663 WeakPolarHBondContact O-CB 3.37Å; L659-L663 WeakPolarHBondContact O-CG 3.25Å; L659-L663 PolarHBondContact O-N 2.7Å; L659-A671 HydrophobicContact CD1-CB 3.9Å; L659-A671 WeakPolarHBondContact CD1-O 3.34Å; L659-L674 HydrophobicContact CB-CB 4.34Å; L659-L674 HydrophobicContact CD1-CB 4.24Å; L659-Y675 HydrophobicContact CD2-CD2 4.27Å; L659-L678 HydrophobicContact CD2-CD1 3.79Å; L659-F689 HydrophobicContact CB-CE1 4.29Å; L659-F689 HydrophobicContact CD2-CB 3.82Å; L659-F689 HydrophobicContact CD2-CD1 3.53Å; L659-F689 HydrophobicContact CD2-CD2 3.87Å; L659-F689 HydrophobicContact CD2-CE1 4.05Å; L659-F689 HydrophobicContact CD2-CE2 4.37Å; L659-F689 HydrophobicContact CD2-CG 3.42Å; L659-F689 VanDerWaalsContact CD2-CG 3.42Å; L659-F689 HydrophobicContact CD2-CZ 4.44Å; L659-F689 HydrophobicContact CG-CD1 3.78Å; L659-F689 HydrophobicContact CG-CE1 4Å; L659-F689 HydrophobicContact CG-CG 4.21Å
660	Q	69.9	Low	71.9	Confident	92 Å²	92	60.7 Å²	60.7	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-50.1	-43.9	173.4	-73.7	179.2	-17.5	0	0	112.5	E656 R657 A664 F689	E656-Q660 WeakPolarHBondContact O-CG 3.45Å; E656-Q660 PolarHBondContact O-N 3.3Å; R657-Q660 PolarHBondContact O-N 3.05Å; Q660-A664 PolarHBondContact O-N 2.91Å; Q660-A664 VanDerWaalsContact O-N 3.08Å; Q660-F689 HydrophobicContact CG-CE1 3.57Å; Q660-F689 HydrophobicContact CG-CZ 3.78Å
661	R	70.8	Confident	72.6	Confident	115 Å²	115	55.5 Å²	55.5	43%	0.434	26%	0.259	S	S	.	.	H	α-helix	trans	-66.6	-48.5	178	-132.3	-176.1	-165.9	165.7	1.9	113.1	R657 L658 L659 L663 A664 E665	R657-R661 PolarHBondContact O-N 2.82Å; L658-R661 PolarHBondContact O-N 3.42Å; L659-R661 PolarHBondContact O-N 3.13Å; L659-R661 VanDerWaalsContact O-N 3.16Å; R661-L663 VanDerWaalsContact C-N 3.3Å; R661-L663 PolarHBondContact O-N 3Å; R661-A664 PolarHBondContact O-N 2.92Å; R661-E665 WeakPolarHBondContact CG-OE1 3.4Å; R661-E665 WeakPolarHBondContact O-CB 3.39Å; R661-E665 VanDerWaalsContact O-CG 3.3Å; R661-E665 WeakPolarHBondContact O-CG 3.25Å; R661-E665 PolarHBondContact O-N 3.11Å
662	T	73	Confident	73.1	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-29.6	179.5	51.7	0	0	0	0	112.5	L658 L659 K666 K667 E670 L674	L658-T662 HydrophobicContact CD1-CG2 4.41Å; L658-T662 HydrophobicContact CG-CG2 4.27Å; L658-T662 WeakPolarHBondContact O-CB 3.46Å; L658-T662 VanDerWaalsContact O-CG2 3.29Å; L658-T662 WeakPolarHBondContact O-CG2 3.43Å; L658-T662 PolarHBondContact O-N 2.69Å; L658-T662 PolarHBondContact O-OG1 2.76Å; L659-T662 WeakPolarHBondContact CA-OG1 3.37Å; L659-T662 PolarHBondContact O-N 3.35Å; L659-T662 VanDerWaalsContact O-N 3.16Å; L659-T662 PolarHBondContact O-OG1 3.27Å; L659-T662 VanDerWaalsContact O-OG1 3.05Å; T662-K666 PolarHBondContact O-N 3.1Å; T662-K666 VanDerWaalsContact O-N 3.1Å; T662-K667 HydrophobicContact CG2-CB 4.4Å; T662-K667 HydrophobicContact CG2-CD 4.45Å; T662-K667 PolarHBondContact O-N 2.91Å; T662-E670 HydrophobicContact CG2-CB 3.78Å; T662-E670 WeakPolarHBondContact CG2-OE2 3.47Å; T662-L674 HydrophobicContact CG2-CD1 4.14Å
663	L	70.4	Confident	73.6	Confident	26 Å²	26	61.4 Å²	61.4	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-67	-43.4	170.6	-67.6	-159.7	0	0	0	112.2	L659 R661 K666 A671 F689 H692 M693 L696	L659-L663 HydrophobicContact CD1-CD1 4.37Å; L659-L663 HydrophobicContact CD1-CD2 3.81Å; L659-L663 HydrophobicContact CD1-CG 3.86Å; L659-L663 HydrophobicContact CG-CD1 4.3Å; L659-L663 HydrophobicContact CG-CG 4.13Å; L659-L663 WeakPolarHBondContact O-CB 3.37Å; L659-L663 WeakPolarHBondContact O-CG 3.25Å; L659-L663 PolarHBondContact O-N 2.7Å; R661-L663 VanDerWaalsContact C-N 3.3Å; R661-L663 PolarHBondContact O-N 3Å; L663-K666 PolarHBondContact O-N 3.03Å; L663-A671 HydrophobicContact CD2-CB 3.47Å; L663-A671 VanDerWaalsContact CD2-CB 3.47Å; L663-F689 HydrophobicContact CD1-CD1 4.06Å; L663-H692 HydrophobicContact CD1-CB 3.73Å; L663-M693 HydrophobicContact CD2-SD 4.05Å; L663-L696 HydrophobicContact CD1-CD1 4.08Å; L663-L696 HydrophobicContact CD2-CD1 3.4Å; L663-L696 HydrophobicContact CG-CD1 4.2Å
664	A	68	Low	74.2	Confident	55 Å²	55	58.2 Å²	58.2	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-65.4	-48.2	173.4	0	0	0	0	0	111.6	Q660 R661 K666	Q660-A664 PolarHBondContact O-N 2.91Å; Q660-A664 VanDerWaalsContact O-N 3.08Å; R661-A664 PolarHBondContact O-N 2.92Å; A664-K666 PolarHBondContact O-N 3.43Å
665	E	72.4	Confident	74.8	Confident	92 Å²	92	56.1 Å²	56.1	43%	0.43	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	1	177.7	-66.9	172.8	-157.4	0	0	113.8	R661 K667	R661-E665 WeakPolarHBondContact CG-OE1 3.4Å; R661-E665 WeakPolarHBondContact O-CB 3.39Å; R661-E665 VanDerWaalsContact O-CG 3.3Å; R661-E665 WeakPolarHBondContact O-CG 3.25Å; R661-E665 PolarHBondContact O-N 3.11Å; E665-K667 HydrophobicContact CB-CD 4.27Å; E665-K667 HydrophobicContact CB-CG 4.09Å; E665-K667 PolarHBondContact O-N 2.9Å; E665-K667 VanDerWaalsContact O-N 3.11Å; E665-K667 WeakPolarHBondContact OE2-CD 3.44Å; E665-K667 WeakPolarHBondContact OE2-CE 3.32Å; E665-K667 IonicContact OE2-NZ 2.73Å; E665-K667 PolarHBondContact OE2-NZ 3.41Å
666	K	67.5	Low	75.3	Confident	112 Å²	112	59.4 Å²	59.4	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	23.5	179.7	-65.6	158.8	-179.2	156	0	113.9	E596 E600 T662 L663 A664 Y668	E596-K666 IonicContact OE1-NZ 3.77Å; E596-K666 PolarHBondContact OE1-NZ 3.39Å; E600-K666 WeakPolarHBondContact OE1-CE 3.39Å; E600-K666 IonicContact OE1-NZ 3.24Å; E600-K666 PolarHBondContact OE1-NZ 3.07Å; T662-K666 PolarHBondContact O-N 3.1Å; T662-K666 VanDerWaalsContact O-N 3.1Å; L663-K666 PolarHBondContact O-N 3.03Å; A664-K666 PolarHBondContact O-N 3.43Å; K666-Y668 PolarHBondContact O-N 3.14Å
667	K	74	Confident	75.9	Confident	90 Å²	90	57.8 Å²	57.8	39%	0.391	27%	0.271	S	S	.	.			trans	-80	79.8	178.8	-70.5	-178.6	179.4	164.3	0	111.6	T662 E665 D669 E670 A671	T662-K667 HydrophobicContact CG2-CB 4.4Å; T662-K667 HydrophobicContact CG2-CD 4.45Å; T662-K667 PolarHBondContact O-N 2.91Å; E665-K667 HydrophobicContact CB-CD 4.27Å; E665-K667 HydrophobicContact CB-CG 4.09Å; E665-K667 PolarHBondContact O-N 2.9Å; E665-K667 VanDerWaalsContact O-N 3.11Å; E665-K667 WeakPolarHBondContact OE2-CD 3.44Å; E665-K667 WeakPolarHBondContact OE2-CE 3.32Å; E665-K667 IonicContact OE2-NZ 2.73Å; E665-K667 PolarHBondContact OE2-NZ 3.41Å; K667-D669 PolarHBondContact O-N 3.49Å; K667-E670 HydrophobicContact CB-CB 4.37Å; K667-E670 VanDerWaalsContact CD-OE2 3.27Å; K667-E670 WeakPolarHBondContact CD-OE2 3.43Å; K667-E670 IonicContact NZ-OE2 3.6Å; K667-E670 PolarHBondContact O-N 3.06Å; K667-A671 WeakPolarHBondContact O-CB 3.49Å; K667-A671 PolarHBondContact O-N 2.7Å
668	Y	73.3	Confident	76.4	Confident	38 Å²	38	50.1 Å²	50.1	15%	0.149	24%	0.242	C	C	.	.	H	α-helix	trans	-53.5	-49.3	-174	177	-97.7	0	0	0	114.2	K666 E670 A671 V672 K700 Y702	K666-Y668 PolarHBondContact O-N 3.14Å; Y668-E670 PolarHBondContact O-N 2.71Å; Y668-A671 WeakPolarHBondContact O-CB 3.17Å; Y668-A671 PolarHBondContact O-N 3.47Å; Y668-V672 HydrophobicContact CD1-CG2 4.39Å; Y668-V672 HydrophobicContact CD2-CG2 4.01Å; Y668-V672 HydrophobicContact CE1-CG2 3.96Å; Y668-V672 HydrophobicContact CE2-CG2 3.54Å; Y668-V672 HydrophobicContact CG-CG2 4.41Å; Y668-V672 VanDerWaalsContact CZ-CG2 3.5Å; Y668-V672 WeakPolarHBondContact O-CG2 3.46Å; Y668-V672 PolarHBondContact O-N 3.44Å; Y668-K700 HydrophobicContact CD2-CG 4.18Å; Y668-K700 HydrophobicContact CE2-CG 4.48Å; Y668-Y702 HydrophobicContact CD1-CE2 4.42Å; Y668-Y702 HydrophobicContact CE1-CD2 4.38Å; Y668-Y702 AromaticContact CE1-CE2 3.61Å; Y668-Y702 HydrophobicContact CE1-CE2 3.61Å; Y668-Y702 AromaticContact CE1-CZ 3.99Å; Y668-Y702 AromaticContact CE2-CD2 3.81Å; Y668-Y702 HydrophobicContact CE2-CD2 3.81Å; Y668-Y702 AromaticContact CE2-CE2 3.73Å; Y668-Y702 HydrophobicContact CE2-CE2 3.73Å; Y668-Y702 AromaticContact CZ-CD2 3.53Å; Y668-Y702 AromaticContact CZ-CE2 3.21Å; Y668-Y702 AromaticContact CZ-CZ 3.93Å; Y668-Y702 WeakPolarHBondContact OH-CD2 3.39Å; Y668-Y702 WeakPolarHBondContact OH-CE2 3.38Å
669	D	78.9	Confident	76.5	Confident	115 Å²	115	52 Å²	52	62%	0.615	25%	0.249	S	C	*	.	H	α-helix	trans	-68	-35.2	-174	-56.7	-53.8	0	0	0	113	K667 K673	K667-D669 PolarHBondContact O-N 3.49Å; D669-K673 WeakPolarHBondContact O-CB 3.47Å; D669-K673 WeakPolarHBondContact O-CD 3.44Å; D669-K673 WeakPolarHBondContact O-CG 3.47Å; D669-K673 PolarHBondContact O-N 2.98Å
670	E	79	Confident	76.7	Confident	70 Å²	70	59.4 Å²	59.4	33%	0.327	28%	0.284	S	S	.	.	H	α-helix	trans	-71.3	-42.6	174.1	-67.2	179.4	-173.1	0	0	110.9	T662 K667 Y668 K673 L674	T662-E670 HydrophobicContact CG2-CB 3.78Å; T662-E670 WeakPolarHBondContact CG2-OE2 3.47Å; K667-E670 HydrophobicContact CB-CB 4.37Å; K667-E670 VanDerWaalsContact CD-OE2 3.27Å; K667-E670 WeakPolarHBondContact CD-OE2 3.43Å; K667-E670 IonicContact NZ-OE2 3.6Å; K667-E670 PolarHBondContact O-N 3.06Å; Y668-E670 PolarHBondContact O-N 2.71Å; E670-K673 PolarHBondContact O-N 3.38Å; E670-L674 WeakPolarHBondContact O-CB 3.31Å; E670-L674 VanDerWaalsContact O-CG 3.3Å; E670-L674 WeakPolarHBondContact O-CG 3.3Å; E670-L674 PolarHBondContact O-N 3.46Å
671	A	79.9	Confident	77.2	Confident	3 Å²	3	57.7 Å²	57.7	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-45.6	176.9	0	0	0	0	0	112.9	L659 L663 K667 Y668 L674 Y675	L659-A671 HydrophobicContact CD1-CB 3.9Å; L659-A671 WeakPolarHBondContact CD1-O 3.34Å; L663-A671 HydrophobicContact CD2-CB 3.47Å; L663-A671 VanDerWaalsContact CD2-CB 3.47Å; K667-A671 WeakPolarHBondContact O-CB 3.49Å; K667-A671 PolarHBondContact O-N 2.7Å; Y668-A671 WeakPolarHBondContact O-CB 3.17Å; Y668-A671 PolarHBondContact O-N 3.47Å; A671-L674 PolarHBondContact O-N 2.95Å; A671-Y675 VanDerWaalsContact O-CB 3.26Å; A671-Y675 WeakPolarHBondContact O-CB 3.3Å; A671-Y675 PolarHBondContact O-N 3.45Å
672	V	80.7	Confident	77.4	Confident	28 Å²	28	54.5 Å²	54.5	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-40.6	177.7	171.8	0	0	0	0	111.1	Y668 N676 M693	Y668-V672 HydrophobicContact CD1-CG2 4.39Å; Y668-V672 HydrophobicContact CD2-CG2 4.01Å; Y668-V672 HydrophobicContact CE1-CG2 3.96Å; Y668-V672 HydrophobicContact CE2-CG2 3.54Å; Y668-V672 HydrophobicContact CG-CG2 4.41Å; Y668-V672 VanDerWaalsContact CZ-CG2 3.5Å; Y668-V672 WeakPolarHBondContact O-CG2 3.46Å; Y668-V672 PolarHBondContact O-N 3.44Å; V672-N676 VanDerWaalsContact O-CB 3.28Å; V672-N676 WeakPolarHBondContact O-CB 3.35Å; V672-N676 VanDerWaalsContact O-CG 3.23Å; V672-N676 PolarHBondContact O-N 3.45Å; V672-N676 PolarHBondContact O-ND2 2.65Å; V672-M693 HydrophobicContact CG2-CE 3.96Å
673	K	82.8	Confident	77.3	Confident	109 Å²	109	57.5 Å²	57.5	47%	0.474	29%	0.285	S	S	.	.	H	α-helix	trans	-59.7	-48.7	173.7	-75	170.6	-178.9	-177.1	0	111.8	D669 E670 F677	D669-K673 WeakPolarHBondContact O-CB 3.47Å; D669-K673 WeakPolarHBondContact O-CD 3.44Å; D669-K673 WeakPolarHBondContact O-CG 3.47Å; D669-K673 PolarHBondContact O-N 2.98Å; E670-K673 PolarHBondContact O-N 3.38Å; K673-F677 VanDerWaalsContact O-CB 3.29Å; K673-F677 WeakPolarHBondContact O-CB 3.18Å; K673-F677 PolarHBondContact O-N 3.34Å
674	L	80.8	Confident	77.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-40.8	-179.8	-71.5	165.1	0	0	0	112.3	A637 I640 A655 L658 L659 T662 E670 A671 F677 L678	A637-L674 HydrophobicContact CB-CD1 4.4Å; A637-L674 HydrophobicContact CB-CD2 4.25Å; A637-L674 HydrophobicContact CB-CG 4.22Å; I640-L674 HydrophobicContact CD1-CD2 4.45Å; I640-L674 HydrophobicContact CG2-CD2 4.5Å; A655-L674 HydrophobicContact CB-CD2 4.44Å; L658-L674 HydrophobicContact CB-CD1 3.97Å; L658-L674 HydrophobicContact CD2-CD1 3.73Å; L658-L674 HydrophobicContact CD2-CD2 4.14Å; L658-L674 HydrophobicContact CG-CD1 3.62Å; L659-L674 HydrophobicContact CB-CB 4.34Å; L659-L674 HydrophobicContact CD1-CB 4.24Å; T662-L674 HydrophobicContact CG2-CD1 4.14Å; E670-L674 WeakPolarHBondContact O-CB 3.31Å; E670-L674 VanDerWaalsContact O-CG 3.3Å; E670-L674 WeakPolarHBondContact O-CG 3.3Å; E670-L674 PolarHBondContact O-N 3.46Å; A671-L674 PolarHBondContact O-N 2.95Å; L674-F677 PolarHBondContact O-N 3.15Å; L674-L678 WeakPolarHBondContact O-CB 3.08Å; L674-L678 WeakPolarHBondContact O-CG 3.04Å; L674-L678 PolarHBondContact O-N 3.09Å
675	Y	83.7	Confident	77.4	Confident	3 Å²	3	59.1 Å²	59.1	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-42.8	176	174.4	-100	0	0	0	112	L659 A671 F677 L678 K679 A686 F689 D690 M693 L709	L659-Y675 HydrophobicContact CD2-CD2 4.27Å; A671-Y675 VanDerWaalsContact O-CB 3.26Å; A671-Y675 WeakPolarHBondContact O-CB 3.3Å; A671-Y675 PolarHBondContact O-N 3.45Å; Y675-F677 VanDerWaalsContact C-N 3.32Å; Y675-F677 PolarHBondContact O-N 3.47Å; Y675-L678 CarbonylContact O-C 3.59Å; Y675-L678 PolarHBondContact O-N 3.27Å; Y675-K679 HydrophobicContact CE1-CB 4.4Å; Y675-K679 HydrophobicContact CE1-CD 3.96Å; Y675-K679 WeakPolarHBondContact O-CB 3.36Å; Y675-K679 PolarHBondContact O-N 3.46Å; Y675-A686 HydrophobicContact CE2-CB 3.98Å; Y675-F689 HydrophobicContact CD2-CB 4Å; Y675-F689 HydrophobicContact CE2-CB 4.22Å; Y675-D690 WeakPolarHBondContact CE2-OD1 3.43Å; Y675-D690 PolarHBondContact OH-OD1 3.38Å; Y675-M693 HydrophobicContact CD1-CE 3.92Å; Y675-M693 HydrophobicContact CD1-CG 3.99Å; Y675-M693 HydrophobicContact CD2-CG 3.49Å; Y675-M693 VanDerWaalsContact CD2-CG 3.49Å; Y675-M693 HydrophobicContact CD2-SD 4.4Å; Y675-M693 HydrophobicContact CE1-CG 4.29Å; Y675-M693 HydrophobicContact CE2-CB 4.41Å; Y675-M693 HydrophobicContact CE2-CG 3.81Å; Y675-M693 HydrophobicContact CG-CE 3.93Å; Y675-M693 HydrophobicContact CG-CG 3.58Å; Y675-M693 HydrophobicContact CG-SD 4.05Å; Y675-L709 HydrophobicContact CE1-CD1 4.08Å; Y675-L709 HydrophobicContact CE1-CD2 3.94Å; Y675-L709 WeakPolarHBondContact OH-CD2 3.36Å
676	N	83.1	Confident	77.3	Confident	70 Å²	70	54.7 Å²	54.7	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-41.4	175.2	-73.6	-17.8	0	0	0	111	V672 L678 K679 E680	V672-N676 VanDerWaalsContact O-CB 3.28Å; V672-N676 WeakPolarHBondContact O-CB 3.35Å; V672-N676 VanDerWaalsContact O-CG 3.23Å; V672-N676 PolarHBondContact O-N 3.45Å; V672-N676 PolarHBondContact O-ND2 2.65Å; N676-L678 PolarHBondContact O-N 2.83Å; N676-K679 WeakPolarHBondContact O-CB 3.34Å; N676-K679 PolarHBondContact O-N 3.46Å; N676-K679 VanDerWaalsContact O-N 3.16Å; N676-E680 WeakPolarHBondContact O-CB 3.05Å; N676-E680 WeakPolarHBondContact O-CG 3.3Å; N676-E680 PolarHBondContact O-N 3.16Å
677	F	82.9	Confident	77.5	Confident	13 Å²	13	52 Å²	52	6%	0.057	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-44.4	172.5	172.2	-97.8	0	0	0	112.9	I640 L641 F644 V651 A655 K673 L674 Y675 N681 Y682	I640-F677 HydrophobicContact CG2-CE1 4.37Å; L641-F677 HydrophobicContact CD2-CB 3.96Å; L641-F677 HydrophobicContact CD2-CD2 3.51Å; L641-F677 HydrophobicContact CD2-CE2 4.17Å; L641-F677 HydrophobicContact CD2-CG 3.8Å; F644-F677 HydrophobicContact CB-CE2 3.96Å; F644-F677 HydrophobicContact CB-CZ 4.12Å; F644-F677 HydrophobicContact CD1-CE2 4.46Å; F644-F677 AromaticContact CD2-CE2 3.55Å; F644-F677 HydrophobicContact CD2-CE2 3.55Å; F644-F677 AromaticContact CD2-CZ 3.58Å; F644-F677 HydrophobicContact CD2-CZ 3.58Å; F644-F677 HydrophobicContact CE2-CE2 4.13Å; F644-F677 HydrophobicContact CE2-CZ 4.3Å; F644-F677 AromaticContact CG-CE2 3.73Å; F644-F677 HydrophobicContact CG-CE2 3.73Å; F644-F677 HydrophobicContact CG-CZ 4.07Å; V651-F677 HydrophobicContact CG1-CE1 3.75Å; V651-F677 HydrophobicContact CG1-CZ 3.56Å; A655-F677 HydrophobicContact CB-CD1 4.13Å; A655-F677 HydrophobicContact CB-CE1 4.1Å; K673-F677 VanDerWaalsContact O-CB 3.29Å; K673-F677 WeakPolarHBondContact O-CB 3.18Å; K673-F677 PolarHBondContact O-N 3.34Å; L674-F677 PolarHBondContact O-N 3.15Å; Y675-F677 VanDerWaalsContact C-N 3.32Å; Y675-F677 PolarHBondContact O-N 3.47Å; F677-N681 VanDerWaalsContact CD2-ND2 3.34Å; F677-N681 WeakPolarHBondContact CD2-ND2 3.04Å; F677-N681 WeakPolarHBondContact O-CB 3.23Å; F677-N681 PolarHBondContact O-N 3.03Å; F677-N681 PolarHBondContact O-ND2 2.8Å; F677-Y682 HydrophobicContact CE1-CD2 4.43Å; F677-Y682 HydrophobicContact CE1-CE2 4.2Å; F677-Y682 HydrophobicContact CZ-CE2 4.21Å
678	L	80.5	Confident	77.4	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-38.1	172.6	-75.4	175.5	0	0	0	111.9	A655 E656 L659 L674 Y675 N676 Y682 A686 F689	A655-L678 HydrophobicContact CB-CD1 4.36Å; A655-L678 HydrophobicContact CB-CD2 3.79Å; A655-L678 HydrophobicContact CB-CG 4.02Å; E656-L678 HydrophobicContact CG-CD1 4.29Å; E656-L678 HydrophobicContact CG-CD2 4.46Å; L659-L678 HydrophobicContact CD2-CD1 3.79Å; L674-L678 WeakPolarHBondContact O-CB 3.08Å; L674-L678 WeakPolarHBondContact O-CG 3.04Å; L674-L678 PolarHBondContact O-N 3.09Å; Y675-L678 CarbonylContact O-C 3.59Å; Y675-L678 PolarHBondContact O-N 3.27Å; N676-L678 PolarHBondContact O-N 2.83Å; L678-Y682 HydrophobicContact CD2-CD2 4.13Å; L678-Y682 CarbonylContact O-C 3.54Å; L678-Y682 WeakPolarHBondContact O-CA 3.46Å; L678-Y682 PolarHBondContact O-N 2.8Å; L678-Y682 VanDerWaalsContact O-O 3.07Å; L678-A686 HydrophobicContact CB-CB 4.34Å; L678-F689 HydrophobicContact CD1-CD2 4.4Å; L678-F689 HydrophobicContact CD1-CE2 4.49Å
679	K	78.4	Confident	77.6	Confident	61 Å²	61	49.5 Å²	49.5	27%	0.265	26%	0.26	S	S	.	.	H	α-helix	trans	-65.5	-40.1	-179.4	-172.6	179.8	179.4	178	0	112	Y675 N676 A686 L709	Y675-K679 HydrophobicContact CE1-CB 4.4Å; Y675-K679 HydrophobicContact CE1-CD 3.96Å; Y675-K679 WeakPolarHBondContact O-CB 3.36Å; Y675-K679 PolarHBondContact O-N 3.46Å; N676-K679 WeakPolarHBondContact O-CB 3.34Å; N676-K679 PolarHBondContact O-N 3.46Å; N676-K679 VanDerWaalsContact O-N 3.16Å; K679-A686 HydrophobicContact CB-CB 4.4Å; K679-L709 HydrophobicContact CD-CD2 4.46Å
680	E	82	Confident	77.5	Confident	155 Å²	155	44.1 Å²	44.1	72%	0.724	23%	0.232	S	C	*	.	H	α-helix	trans	-78	-42.4	179.3	-71.1	177.3	176.3	0	0	112.5	N676	N676-E680 WeakPolarHBondContact O-CB 3.05Å; N676-E680 WeakPolarHBondContact O-CG 3.3Å; N676-E680 PolarHBondContact O-N 3.16Å
681	N	79.3	Confident	77.6	Confident	56 Å²	56	44.8 Å²	44.8	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-102.5	-27	-169.7	-59.1	-72.4	0	0	0	114.3	F644 F677	F644-N681 HydrophobicContact CE2-CB 3.98Å; F644-N681 WeakPolarHBondContact CE2-OD1 3.19Å; F644-N681 HydrophobicContact CZ-CB 4.42Å; F644-N681 WeakPolarHBondContact CZ-OD1 3.27Å; F677-N681 VanDerWaalsContact CD2-ND2 3.34Å; F677-N681 WeakPolarHBondContact CD2-ND2 3.04Å; F677-N681 WeakPolarHBondContact O-CB 3.23Å; F677-N681 PolarHBondContact O-N 3.03Å; F677-N681 PolarHBondContact O-ND2 2.8Å
682	Y	75.3	Confident	77.5	Confident	47 Å²	47	47.4 Å²	47.4	18%	0.184	25%	0.245	C	C	.	.			trans	-139.8	57.6	-174	-57.8	-72	0	0	0	111.8	G648 F677 L678 S684 S685 A686	G648-Y682 WeakPolarHBondContact CA-OH 3.31Å; G648-Y682 PolarHBondContact O-OH 2.93Å; F677-Y682 HydrophobicContact CE1-CD2 4.43Å; F677-Y682 HydrophobicContact CE1-CE2 4.2Å; F677-Y682 HydrophobicContact CZ-CE2 4.21Å; L678-Y682 HydrophobicContact CD2-CD2 4.13Å; L678-Y682 CarbonylContact O-C 3.54Å; L678-Y682 WeakPolarHBondContact O-CA 3.46Å; L678-Y682 PolarHBondContact O-N 2.8Å; L678-Y682 VanDerWaalsContact O-O 3.07Å; Y682-S684 PolarHBondContact O-N 3.22Å; Y682-S685 WeakPolarHBondContact O-CA 3.29Å; Y682-S685 VanDerWaalsContact O-CB 3.27Å; Y682-S685 WeakPolarHBondContact O-CB 3.33Å; Y682-S685 PolarHBondContact O-N 3.24Å; Y682-A686 PolarHBondContact O-N 3.33Å
683	P	71.7	Confident	77.5	Confident	64 Å²	64	46.3 Å²	46.3	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-56.5	-29.8	-170.3	20.3	-33.3	0	0	0	114.1	S685 A686 V687	P683-S685 VanDerWaalsContact C-N 3.29Å; P683-S685 PolarHBondContact O-N 3.3Å; P683-A686 PolarHBondContact O-N 2.96Å; P683-V687 WeakPolarHBondContact O-CG2 3.43Å; P683-V687 PolarHBondContact O-N 2.87Å
684	S	69.8	Low	77.5	Confident	105 Å²	105	41.1 Å²	41.1	73%	0.734	22%	0.216	S	C	*	.	H	α-helix	trans	-62.3	-32.6	174	-42.6	0	0	0	0	113.9	Y682	Y682-S684 PolarHBondContact O-N 3.22Å
685	S	69.2	Low	77.4	Confident	10 Å²	10	42.4 Å²	42.4	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-77.8	-40.5	175.9	173.1	0	0	0	0	110.7	E656 Y682 P683 V687 I688	E656-S685 WeakPolarHBondContact CG-OG 3.45Å; E656-S685 VanDerWaalsContact OE1-CB 3.3Å; E656-S685 WeakPolarHBondContact OE1-CB 3.32Å; E656-S685 PolarHBondContact OE1-OG 2.88Å; Y682-S685 WeakPolarHBondContact O-CA 3.29Å; Y682-S685 VanDerWaalsContact O-CB 3.27Å; Y682-S685 WeakPolarHBondContact O-CB 3.33Å; Y682-S685 PolarHBondContact O-N 3.24Å; P683-S685 VanDerWaalsContact C-N 3.29Å; P683-S685 PolarHBondContact O-N 3.3Å; S685-V687 PolarHBondContact O-N 2.74Å; S685-V687 VanDerWaalsContact O-N 3.16Å; S685-I688 WeakPolarHBondContact O-CB 3.13Å; S685-I688 PolarHBondContact O-N 3.16Å
686	A	71.9	Confident	77.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.1	-31.4	177.6	0	0	0	0	0	113.6	Y675 L678 K679 Y682 P683 I688 F689 D690	Y675-A686 HydrophobicContact CE2-CB 3.98Å; L678-A686 HydrophobicContact CB-CB 4.34Å; K679-A686 HydrophobicContact CB-CB 4.4Å; Y682-A686 PolarHBondContact O-N 3.33Å; P683-A686 PolarHBondContact O-N 2.96Å; A686-I688 PolarHBondContact O-N 3.05Å; A686-I688 VanDerWaalsContact O-N 3.17Å; A686-F689 CarbonylContact O-C 3.49Å; A686-F689 WeakPolarHBondContact O-CA 3.44Å; A686-F689 PolarHBondContact O-N 3.43Å; A686-D690 PolarHBondContact O-N 2.83Å; A686-D690 VanDerWaalsContact O-OD1 3.11Å
687	V	71.6	Confident	77	Confident	56 Å²	56	41 Å²	41	34%	0.339	22%	0.216	S	C	.	.	H	α-helix	trans	-53.1	-37.5	178.1	-172	0	0	0	0	113.1	P683 S685 F689 D690 R717	P683-V687 WeakPolarHBondContact O-CG2 3.43Å; P683-V687 PolarHBondContact O-N 2.87Å; S685-V687 PolarHBondContact O-N 2.74Å; S685-V687 VanDerWaalsContact O-N 3.16Å; V687-F689 PolarHBondContact O-N 3.45Å; V687-D690 WeakPolarHBondContact CA-OD2 3.42Å; V687-D690 PolarHBondContact O-N 2.84Å; V687-R717 HydrophobicContact CG1-CB 4.1Å; V687-R717 WeakPolarHBondContact CG1-O 3.41Å; V687-R717 HydrophobicContact CG2-CB 4.01Å; V687-R717 HydrophobicContact CG2-CG 4.35Å
688	I	71.9	Confident	76.9	Confident	68 Å²	68	41 Å²	41	35%	0.349	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-33.7	179	-56.8	170.1	0	0	0	110.5	E557 S685 A686	E557-I688 VanDerWaalsContact OE1-CG2 3.29Å; E557-I688 WeakPolarHBondContact OE1-CG2 3.04Å; S685-I688 WeakPolarHBondContact O-CB 3.13Å; S685-I688 PolarHBondContact O-N 3.16Å; A686-I688 PolarHBondContact O-N 3.05Å; A686-I688 VanDerWaalsContact O-N 3.17Å
689	F	75.6	Confident	76.6	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-95.5	-15.7	-176.6	-62.8	-81.8	0	0	0	114	E656 L659 Q660 L663 Y675 L678 A686 V687 K691 H692 M693	E656-F689 HydrophobicContact CB-CE2 4.21Å; E656-F689 HydrophobicContact CB-CZ 4.24Å; E656-F689 HydrophobicContact CG-CE2 4.01Å; L659-F689 HydrophobicContact CB-CE1 4.29Å; L659-F689 HydrophobicContact CD2-CB 3.82Å; L659-F689 HydrophobicContact CD2-CD1 3.53Å; L659-F689 HydrophobicContact CD2-CD2 3.87Å; L659-F689 HydrophobicContact CD2-CE1 4.05Å; L659-F689 HydrophobicContact CD2-CE2 4.37Å; L659-F689 HydrophobicContact CD2-CG 3.42Å; L659-F689 VanDerWaalsContact CD2-CG 3.42Å; L659-F689 HydrophobicContact CD2-CZ 4.44Å; L659-F689 HydrophobicContact CG-CD1 3.78Å; L659-F689 HydrophobicContact CG-CE1 4Å; L659-F689 HydrophobicContact CG-CG 4.21Å; Q660-F689 HydrophobicContact CG-CE1 3.57Å; Q660-F689 HydrophobicContact CG-CZ 3.78Å; L663-F689 HydrophobicContact CD1-CD1 4.06Å; Y675-F689 HydrophobicContact CD2-CB 4Å; Y675-F689 HydrophobicContact CE2-CB 4.22Å; L678-F689 HydrophobicContact CD1-CD2 4.4Å; L678-F689 HydrophobicContact CD1-CE2 4.49Å; A686-F689 CarbonylContact O-C 3.49Å; A686-F689 WeakPolarHBondContact O-CA 3.44Å; A686-F689 PolarHBondContact O-N 3.43Å; V687-F689 PolarHBondContact O-N 3.45Å; F689-K691 VanDerWaalsContact C-N 3.28Å; F689-K691 PolarHBondContact O-N 3.33Å; F689-H692 WeakPolarHBondContact O-CA 3.45Å; F689-H692 PolarHBondContact O-N 3.19Å; F689-M693 HydrophobicContact CB-CG 4.43Å; F689-M693 WeakPolarHBondContact O-CG 3.29Å; F689-M693 PolarHBondContact O-N 2.82Å
690	D	78.6	Confident	76.5	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-51.4	-46.6	-178.8	-71.7	-15.7	0	0	0	111.8	Y675 A686 V687 H692 M693 I694 R717	Y675-D690 WeakPolarHBondContact CE2-OD1 3.43Å; Y675-D690 PolarHBondContact OH-OD1 3.38Å; A686-D690 PolarHBondContact O-N 2.83Å; A686-D690 VanDerWaalsContact O-OD1 3.11Å; V687-D690 WeakPolarHBondContact CA-OD2 3.42Å; V687-D690 PolarHBondContact O-N 2.84Å; D690-H692 PolarHBondContact O-N 3.49Å; D690-M693 PolarHBondContact O-N 3.35Å; D690-I694 WeakPolarHBondContact O-CB 3.33Å; D690-I694 VanDerWaalsContact O-CD1 3.29Å; D690-I694 WeakPolarHBondContact O-CD1 3.48Å; D690-I694 WeakPolarHBondContact O-CG1 3.4Å; D690-I694 PolarHBondContact O-N 2.84Å; D690-R717 IonicContact OD1-NH1 3.21Å; D690-R717 PolarHBondContact OD1-NH1 3.2Å; D690-R717 WeakPolarHBondContact OD2-CD 3.25Å; D690-R717 IonicContact OD2-CZ 3.7Å; D690-R717 IonicContact OD2-NE 2.8Å; D690-R717 IonicContact OD2-NH1 2.97Å; D690-R717 PolarHBondContact OD2-NH1 3.13Å
691	K	79.9	Confident	76.2	Confident	84 Å²	84	48.3 Å²	48.3	37%	0.365	26%	0.255	S	S	.	.	H	α-helix	trans	-55.9	-49.4	174.5	159.5	160.6	178.1	175.6	0	112.3	F689 T695 L719 D721 T724	F689-K691 VanDerWaalsContact C-N 3.28Å; F689-K691 PolarHBondContact O-N 3.33Å; K691-T695 PolarHBondContact O-N 2.83Å; K691-T695 VanDerWaalsContact O-N 3.12Å; K691-T695 PolarHBondContact O-OG1 3.3Å; K691-L719 HydrophobicContact CB-CD1 4.24Å; K691-D721 WeakPolarHBondContact CE-OD2 3.39Å; K691-D721 IonicContact NZ-OD2 2.76Å; K691-D721 PolarHBondContact NZ-OD2 3.09Å; K691-T724 HydrophobicContact CB-CG2 4Å; K691-T724 HydrophobicContact CD-CG2 3.82Å; K691-T724 HydrophobicContact CG-CG2 3.52Å
692	H	78.2	Confident	76.4	Confident	57 Å²	57	50.7 Å²	50.7	26%	0.264	26%	0.261	S	S	.	.	H	α-helix	trans	-65.9	-43.6	-178.5	-73.2	101.6	0	0	0	111.3	L663 F689 D690 T695 L696	L663-H692 HydrophobicContact CD1-CB 3.73Å; F689-H692 WeakPolarHBondContact O-CA 3.45Å; F689-H692 PolarHBondContact O-N 3.19Å; D690-H692 PolarHBondContact O-N 3.49Å; H692-T695 PolarHBondContact O-N 3.32Å; H692-L696 WeakPolarHBondContact O-CB 3.34Å; H692-L696 WeakPolarHBondContact O-CD1 3.44Å; H692-L696 VanDerWaalsContact O-CG 3.29Å; H692-L696 WeakPolarHBondContact O-CG 3.16Å; H692-L696 PolarHBondContact O-N 3.32Å
693	M	81.2	Confident	76.8	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-42	177.9	-67.3	-56.9	-63.6	0	0	112.5	L663 V672 Y675 F689 D690 T695 L696 C697 L709	L663-M693 HydrophobicContact CD2-SD 4.05Å; V672-M693 HydrophobicContact CG2-CE 3.96Å; Y675-M693 HydrophobicContact CD1-CE 3.92Å; Y675-M693 HydrophobicContact CD1-CG 3.99Å; Y675-M693 HydrophobicContact CD2-CG 3.49Å; Y675-M693 VanDerWaalsContact CD2-CG 3.49Å; Y675-M693 HydrophobicContact CD2-SD 4.4Å; Y675-M693 HydrophobicContact CE1-CG 4.29Å; Y675-M693 HydrophobicContact CE2-CB 4.41Å; Y675-M693 HydrophobicContact CE2-CG 3.81Å; Y675-M693 HydrophobicContact CG-CE 3.93Å; Y675-M693 HydrophobicContact CG-CG 3.58Å; Y675-M693 HydrophobicContact CG-SD 4.05Å; F689-M693 HydrophobicContact CB-CG 4.43Å; F689-M693 WeakPolarHBondContact O-CG 3.29Å; F689-M693 PolarHBondContact O-N 2.82Å; D690-M693 PolarHBondContact O-N 3.35Å; M693-T695 PolarHBondContact O-N 2.67Å; M693-L696 PolarHBondContact O-N 3.01Å; M693-L696 HydrophobicContact SD-CD1 4.41Å; M693-C697 WeakPolarHBondContact O-CB 3.04Å; M693-C697 PolarHBondContact O-N 2.75Å; M693-C697 PolarHBondContact O-SG 3.35Å; M693-C697 VanDerWaalsContact O-SG 3.33Å; M693-L709 HydrophobicContact CB-CD1 4.06Å
694	I	82.9	Confident	77.5	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-48.2	173.9	-68.9	158.8	0	0	0	110.1	D690 L696 A698 L709 F710 L719 L728	D690-I694 WeakPolarHBondContact O-CB 3.33Å; D690-I694 VanDerWaalsContact O-CD1 3.29Å; D690-I694 WeakPolarHBondContact O-CD1 3.48Å; D690-I694 WeakPolarHBondContact O-CG1 3.4Å; D690-I694 PolarHBondContact O-N 2.84Å; I694-L696 VanDerWaalsContact C-N 3.29Å; I694-L696 PolarHBondContact O-N 3.35Å; I694-A698 WeakPolarHBondContact O-CB 3.5Å; I694-A698 PolarHBondContact O-N 3.49Å; I694-L709 HydrophobicContact CD1-CB 4.24Å; I694-L709 HydrophobicContact CG1-CB 3.64Å; I694-F710 HydrophobicContact CD1-CB 4.03Å; I694-F710 HydrophobicContact CD1-CD2 4.27Å; I694-F710 HydrophobicContact CG1-CB 4.44Å; I694-F710 HydrophobicContact CG2-CB 4.47Å; I694-F710 HydrophobicContact CG2-CD2 4.47Å; I694-L719 HydrophobicContact CD1-CD2 3.43Å; I694-L719 VanDerWaalsContact CD1-CD2 3.43Å; I694-L728 HydrophobicContact CG2-CB 4.46Å; I694-L728 HydrophobicContact CG2-CD2 4.38Å
695	T	77.7	Confident	78.2	Confident	26 Å²	26	50.4 Å²	50.4	16%	0.16	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-34.3	177.2	-61.6	0	0	0	0	112.5	K691 H692 M693 R699	K691-T695 PolarHBondContact O-N 2.83Å; K691-T695 VanDerWaalsContact O-N 3.12Å; K691-T695 PolarHBondContact O-OG1 3.3Å; H692-T695 PolarHBondContact O-N 3.32Å; M693-T695 PolarHBondContact O-N 2.67Å; T695-R699 WeakPolarHBondContact O-CB 3.08Å; T695-R699 VanDerWaalsContact O-CG 3.23Å; T695-R699 WeakPolarHBondContact O-CG 3.3Å; T695-R699 PolarHBondContact O-N 2.97Å
696	L	78.7	Confident	79	Confident	42 Å²	42	49.9 Å²	49.9	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-75.7	-46.2	178.3	-77.2	158.9	0	0	0	113.2	L663 H692 M693 I694 A698 R699 K700	L663-L696 HydrophobicContact CD1-CD1 4.08Å; L663-L696 HydrophobicContact CD2-CD1 3.4Å; L663-L696 HydrophobicContact CG-CD1 4.2Å; H692-L696 WeakPolarHBondContact O-CB 3.34Å; H692-L696 WeakPolarHBondContact O-CD1 3.44Å; H692-L696 VanDerWaalsContact O-CG 3.29Å; H692-L696 WeakPolarHBondContact O-CG 3.16Å; H692-L696 PolarHBondContact O-N 3.32Å; M693-L696 PolarHBondContact O-N 3.01Å; M693-L696 HydrophobicContact SD-CD1 4.41Å; I694-L696 VanDerWaalsContact C-N 3.29Å; I694-L696 PolarHBondContact O-N 3.35Å; L696-A698 VanDerWaalsContact C-N 3.27Å; L696-A698 PolarHBondContact O-N 2.98Å; L696-R699 PolarHBondContact O-N 3.32Å; L696-K700 WeakPolarHBondContact O-CB 3.3Å; L696-K700 PolarHBondContact O-N 2.84Å
697	C	80.9	Confident	79.7	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.02	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-42.6	172.7	-68.4	0	0	0	0	110.2	M693 K700 S701 Y702 A706	M693-C697 WeakPolarHBondContact O-CB 3.04Å; M693-C697 PolarHBondContact O-N 2.75Å; M693-C697 PolarHBondContact O-SG 3.35Å; M693-C697 VanDerWaalsContact O-SG 3.33Å; C697-K700 CarbonylContact O-C 3.6Å; C697-K700 PolarHBondContact O-N 3.23Å; C697-S701 PolarHBondContact O-N 2.95Å; C697-S701 VanDerWaalsContact O-N 3.07Å; C697-Y702 PolarHBondContact O-N 2.94Å; C697-A706 HydrophobicContact CB-CB 3.73Å
698	A	78.9	Confident	80.4	Confident	11 Å²	11	50.5 Å²	50.5	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-48.3	172.4	0	0	0	0	0	112.7	I694 L696 K700 S701 A731	I694-A698 WeakPolarHBondContact O-CB 3.5Å; I694-A698 PolarHBondContact O-N 3.49Å; L696-A698 VanDerWaalsContact C-N 3.27Å; L696-A698 PolarHBondContact O-N 2.98Å; A698-K700 VanDerWaalsContact C-N 3.3Å; A698-K700 PolarHBondContact O-N 3.06Å; A698-S701 PolarHBondContact O-N 3.41Å; A698-A731 HydrophobicContact CB-CB 3.63Å
699	R	74.8	Confident	81	Confident	155 Å²	155	47.8 Å²	47.8	59%	0.585	24%	0.237	S	C	*	.	H	α-helix	trans	-63.6	-30.8	176.4	-78.8	175.4	-178.7	-153	0.2	113.6	E600 T695 L696	E600-R699 IonicContact OE2-NH1 3.43Å; E600-R699 PolarHBondContact OE2-NH1 3.2Å; T695-R699 WeakPolarHBondContact O-CB 3.08Å; T695-R699 VanDerWaalsContact O-CG 3.23Å; T695-R699 WeakPolarHBondContact O-CG 3.3Å; T695-R699 PolarHBondContact O-N 2.97Å; L696-R699 PolarHBondContact O-N 3.32Å
700	K	76.9	Confident	81.5	Confident	120 Å²	120	47.6 Å²	47.6	52%	0.522	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	3.7	178.8	-71.9	-73.8	-172.6	171.9	0	113.9	Y668 L696 C697 A698 Y702	Y668-K700 HydrophobicContact CD2-CG 4.18Å; Y668-K700 HydrophobicContact CE2-CG 4.48Å; L696-K700 WeakPolarHBondContact O-CB 3.3Å; L696-K700 PolarHBondContact O-N 2.84Å; C697-K700 CarbonylContact O-C 3.6Å; C697-K700 PolarHBondContact O-N 3.23Å; A698-K700 VanDerWaalsContact C-N 3.3Å; A698-K700 PolarHBondContact O-N 3.06Å; K700-Y702 VanDerWaalsContact C-N 3.26Å; K700-Y702 HydrophobicContact CB-CD2 3.46Å; K700-Y702 VanDerWaalsContact CB-CD2 3.46Å; K700-Y702 HydrophobicContact CB-CE2 3.6Å; K700-Y702 HydrophobicContact CG-CE2 4.41Å; K700-Y702 PolarHBondContact O-N 3Å
701	S	75.3	Confident	81.8	Confident	95 Å²	95	52.5 Å²	52.5	66%	0.664	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	19.3	-177.2	-52	0	0	0	0	115.7	C697 A698 L703	C697-S701 PolarHBondContact O-N 2.95Å; C697-S701 VanDerWaalsContact O-N 3.07Å; A698-S701 PolarHBondContact O-N 3.41Å; S701-L703 PolarHBondContact O-N 3.03Å
702	Y	82.5	Confident	82	Confident	106 Å²	106	50.4 Å²	50.4	42%	0.416	25%	0.247	S	C	.	.			trans	-80.5	65.7	167.9	-61.2	-69.4	0	0	0	109.9	Y668 C697 K700 D704 E705 A706	Y668-Y702 HydrophobicContact CD1-CE2 4.42Å; Y668-Y702 HydrophobicContact CE1-CD2 4.38Å; Y668-Y702 AromaticContact CE1-CE2 3.61Å; Y668-Y702 HydrophobicContact CE1-CE2 3.61Å; Y668-Y702 AromaticContact CE1-CZ 3.99Å; Y668-Y702 AromaticContact CE2-CD2 3.81Å; Y668-Y702 HydrophobicContact CE2-CD2 3.81Å; Y668-Y702 AromaticContact CE2-CE2 3.73Å; Y668-Y702 HydrophobicContact CE2-CE2 3.73Å; Y668-Y702 AromaticContact CZ-CD2 3.53Å; Y668-Y702 AromaticContact CZ-CE2 3.21Å; Y668-Y702 AromaticContact CZ-CZ 3.93Å; Y668-Y702 WeakPolarHBondContact OH-CD2 3.39Å; Y668-Y702 WeakPolarHBondContact OH-CE2 3.38Å; C697-Y702 PolarHBondContact O-N 2.94Å; K700-Y702 VanDerWaalsContact C-N 3.26Å; K700-Y702 HydrophobicContact CB-CD2 3.46Å; K700-Y702 VanDerWaalsContact CB-CD2 3.46Å; K700-Y702 HydrophobicContact CB-CE2 3.6Å; K700-Y702 HydrophobicContact CG-CE2 4.41Å; K700-Y702 PolarHBondContact O-N 3Å; Y702-D704 PolarHBondContact O-N 3.44Å; Y702-E705 PolarHBondContact O-N 3.44Å; Y702-A706 WeakPolarHBondContact O-CB 3.5Å; Y702-A706 PolarHBondContact O-N 2.65Å
703	L	84.8	Confident	82.1	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-68	-35.8	-167.1	-63	176.3	0	0	0	113.3	S701 A706 L707 A731 L732	S701-L703 PolarHBondContact O-N 3.03Å; L703-A706 PolarHBondContact O-N 3.25Å; L703-L707 WeakPolarHBondContact O-CB 3.36Å; L703-L707 WeakPolarHBondContact O-CG 3.49Å; L703-L707 PolarHBondContact O-N 3.25Å; L703-A731 HydrophobicContact CD2-CB 3.96Å; L703-L732 HydrophobicContact CB-CD2 4.15Å; L703-L732 HydrophobicContact CD1-CD2 4.42Å; L703-L732 HydrophobicContact CD2-CD2 4.29Å
704	D	87.1	Confident	82.1	Confident	105 Å²	105	48 Å²	48	56%	0.561	24%	0.236	S	C	*	.	H	α-helix	trans	-70.3	-38.2	178.1	-63.3	-62.7	0	0	0	112.3	Y702 L707 S708 R737	Y702-D704 PolarHBondContact O-N 3.44Å; D704-L707 PolarHBondContact O-N 3.48Å; D704-S708 WeakPolarHBondContact O-CB 3.33Å; D704-S708 PolarHBondContact O-N 3.31Å; D704-S708 PolarHBondContact O-OG 3.37Å; D704-R737 IonicContact OD1-CZ 2.8Å; D704-R737 VanDerWaalsContact OD1-CZ 3.24Å; D704-R737 IonicContact OD1-NH1 2.98Å; D704-R737 PolarHBondContact OD1-NH1 2.67Å; D704-R737 IonicContact OD1-NH2 2.94Å; D704-R737 PolarHBondContact OD1-NH2 3.09Å; D704-R737 IonicContact OD2-NH1 3.45Å; D704-R737 PolarHBondContact OD2-NH1 3.2Å
705	E	83.3	Confident	81.9	Confident	88 Å²	88	54.2 Å²	54.2	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-49.7	171.1	-66.3	-179.7	176.5	0	0	110.2	Y702 L707 S708 L709	Y702-E705 PolarHBondContact O-N 3.44Å; E705-L707 VanDerWaalsContact C-N 3.33Å; E705-L707 PolarHBondContact O-N 3.45Å; E705-S708 PolarHBondContact O-N 2.92Å; E705-S708 VanDerWaalsContact O-N 3.11Å; E705-S708 PolarHBondContact O-OG 3.36Å; E705-L709 WeakPolarHBondContact O-CG 3.49Å; E705-L709 PolarHBondContact O-N 3.19Å
706	A	85.6	Confident	81.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-42.1	178.3	0	0	0	0	0	112.7	C697 Y702 L703 F710 L728	C697-A706 HydrophobicContact CB-CB 3.73Å; Y702-A706 WeakPolarHBondContact O-CB 3.5Å; Y702-A706 PolarHBondContact O-N 2.65Å; L703-A706 PolarHBondContact O-N 3.25Å; A706-F710 VanDerWaalsContact O-CB 3.26Å; A706-F710 WeakPolarHBondContact O-CB 3.1Å; A706-F710 PolarHBondContact O-N 2.97Å; A706-L728 HydrophobicContact CB-CD1 3.76Å
707	L	87	Confident	81	Confident	6 Å²	6	58.9 Å²	58.9	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-43.8	173.8	-83	167.6	0	0	0	112.4	L703 D704 E705 F710 R711 L728 L732 R737 D740 V744	L703-L707 WeakPolarHBondContact O-CB 3.36Å; L703-L707 WeakPolarHBondContact O-CG 3.49Å; L703-L707 PolarHBondContact O-N 3.25Å; D704-L707 PolarHBondContact O-N 3.48Å; E705-L707 VanDerWaalsContact C-N 3.33Å; E705-L707 PolarHBondContact O-N 3.45Å; L707-F710 PolarHBondContact O-N 2.92Å; L707-R711 WeakPolarHBondContact O-CG 3.46Å; L707-R711 PolarHBondContact O-N 2.96Å; L707-L728 HydrophobicContact CD2-CD2 4.42Å; L707-L732 HydrophobicContact CD1-CD2 3.78Å; L707-L732 HydrophobicContact CD2-CD1 3.82Å; L707-L732 HydrophobicContact CD2-CD2 4.42Å; L707-L732 HydrophobicContact CG-CD1 4.3Å; L707-L732 HydrophobicContact CG-CD2 4.06Å; L707-R737 VanDerWaalsContact CD1-NH2 3.28Å; L707-D740 HydrophobicContact CD1-CB 4.14Å; L707-D740 HydrophobicContact CD2-CB 4.42Å; L707-V744 HydrophobicContact CD2-CG2 3.67Å
708	S	86.2	Confident	80.4	Confident	63 Å²	63	60.9 Å²	60.9	44%	0.441	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-42.2	179	76.5	0	0	0	0	112.1	D704 E705 D712	D704-S708 WeakPolarHBondContact O-CB 3.33Å; D704-S708 PolarHBondContact O-N 3.31Å; D704-S708 PolarHBondContact O-OG 3.37Å; E705-S708 PolarHBondContact O-N 2.92Å; E705-S708 VanDerWaalsContact O-N 3.11Å; E705-S708 PolarHBondContact O-OG 3.36Å; S708-D712 WeakPolarHBondContact O-CB 3.49Å; S708-D712 PolarHBondContact O-N 3.49Å
709	L	84.2	Confident	80.1	Confident	11 Å²	11	61.4 Å²	61.4	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-37.7	176.1	-65.6	-176.9	0	0	0	111.5	Y675 K679 M693 I694 E705 G713	Y675-L709 HydrophobicContact CE1-CD1 4.08Å; Y675-L709 HydrophobicContact CE1-CD2 3.94Å; Y675-L709 WeakPolarHBondContact OH-CD2 3.36Å; K679-L709 HydrophobicContact CD-CD2 4.46Å; M693-L709 HydrophobicContact CB-CD1 4.06Å; I694-L709 HydrophobicContact CD1-CB 4.24Å; I694-L709 HydrophobicContact CG1-CB 3.64Å; E705-L709 WeakPolarHBondContact O-CG 3.49Å; E705-L709 PolarHBondContact O-N 3.19Å; L709-G713 WeakPolarHBondContact O-CA 3.41Å; L709-G713 PolarHBondContact O-N 3.22Å
710	F	86.3	Confident	80	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.009	31%	0.307	C	S	.	.	H	α-helix	trans	-67.4	-44.2	175.9	-175.1	-92.4	0	0	0	112	I694 A706 L707 G713 L714 L719 A725 L728 V744 H748	I694-F710 HydrophobicContact CD1-CB 4.03Å; I694-F710 HydrophobicContact CD1-CD2 4.27Å; I694-F710 HydrophobicContact CG1-CB 4.44Å; I694-F710 HydrophobicContact CG2-CB 4.47Å; I694-F710 HydrophobicContact CG2-CD2 4.47Å; A706-F710 VanDerWaalsContact O-CB 3.26Å; A706-F710 WeakPolarHBondContact O-CB 3.1Å; A706-F710 PolarHBondContact O-N 2.97Å; L707-F710 PolarHBondContact O-N 2.92Å; F710-G713 PolarHBondContact O-N 3.36Å; F710-L714 HydrophobicContact CE1-CD1 3.97Å; F710-L714 HydrophobicContact CZ-CD1 3.9Å; F710-L714 VanDerWaalsContact O-CB 3.26Å; F710-L714 WeakPolarHBondContact O-CB 3.43Å; F710-L714 PolarHBondContact O-N 3.24Å; F710-L719 HydrophobicContact CD2-CD2 3.56Å; F710-L719 HydrophobicContact CE2-CD2 3.92Å; F710-L719 HydrophobicContact CG-CD2 4.31Å; F710-A725 HydrophobicContact CE2-CB 4.03Å; F710-A725 HydrophobicContact CZ-CB 3.81Å; F710-L728 HydrophobicContact CB-CD2 3.44Å; F710-L728 VanDerWaalsContact CB-CD2 3.44Å; F710-L728 HydrophobicContact CD1-CD2 3.88Å; F710-L728 HydrophobicContact CD2-CD2 3.71Å; F710-L728 HydrophobicContact CE2-CD2 4.44Å; F710-L728 HydrophobicContact CG-CD2 3.39Å; F710-V744 HydrophobicContact CD1-CG1 4.41Å; F710-V744 HydrophobicContact CD1-CG2 4.33Å; F710-V744 HydrophobicContact CE1-CB 4.48Å; F710-V744 HydrophobicContact CE1-CG1 3.83Å; F710-V744 HydrophobicContact CE1-CG2 4.38Å; F710-V744 HydrophobicContact CZ-CG1 3.96Å; F710-H748 HydrophobicContact CZ-CB 4.46Å
711	R	86.2	Confident	80.1	Confident	105 Å²	105	58.1 Å²	58.1	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-49.1	177.5	-73.1	-178.1	177.8	151.5	-0.1	112.1	L707 G713 L714 E715 D743	L707-R711 WeakPolarHBondContact O-CG 3.46Å; L707-R711 PolarHBondContact O-N 2.96Å; R711-G713 VanDerWaalsContact C-N 3.27Å; R711-G713 PolarHBondContact O-N 3.21Å; R711-L714 PolarHBondContact O-N 3.29Å; R711-E715 WeakPolarHBondContact O-CB 3.3Å; R711-E715 WeakPolarHBondContact O-CG 3.3Å; R711-E715 PolarHBondContact O-N 2.99Å; R711-D743 IonicContact CZ-OD2 2.66Å; R711-D743 IonicContact NE-OD2 3.72Å; R711-D743 IonicContact NH2-OD2 3.41Å; R711-D743 PolarHBondContact NH2-OD2 2.65Å
712	D	83	Confident	80.4	Confident	41 Å²	41	54.2 Å²	54.2	22%	0.219	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-39.2	173.8	-175.2	41.8	0	0	0	111.5	S708 N716 R717	S708-D712 WeakPolarHBondContact O-CB 3.49Å; S708-D712 PolarHBondContact O-N 3.49Å; D712-N716 WeakPolarHBondContact O-CB 3.49Å; D712-N716 PolarHBondContact O-N 3.11Å; D712-N716 PolarHBondContact OD1-ND2 2.99Å; D712-R717 PolarHBondContact O-N 2.74Å; D712-R717 IonicContact OD2-CZ 3.18Å; D712-R717 IonicContact OD2-NE 3.18Å; D712-R717 PolarHBondContact OD2-NE 3.36Å; D712-R717 IonicContact OD2-NH2 3.88Å; D712-R717 PolarHBondContact OD2-NH2 3.09Å
713	G	80.2	Confident	80.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.265	C	S	.	.	I	π-helix	trans	-60.5	-46.5	174.2	0	0	0	0	0	113.3	L709 F710 R711 R717 G718 L719	L709-G713 WeakPolarHBondContact O-CA 3.41Å; L709-G713 PolarHBondContact O-N 3.22Å; F710-G713 PolarHBondContact O-N 3.36Å; R711-G713 VanDerWaalsContact C-N 3.27Å; R711-G713 PolarHBondContact O-N 3.21Å; G713-R717 CarbonylContact O-C 3.54Å; G713-R717 PolarHBondContact O-N 2.89Å; G713-G718 PolarHBondContact O-N 3.43Å; G713-L719 VanDerWaalsContact C-CB 3.44Å; G713-L719 WeakPolarHBondContact O-CB 3.34Å; G713-L719 PolarHBondContact O-N 2.88Å
714	L	81.8	Confident	80.4	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.052	26%	0.26	C	S	.	.	I	π-helix	trans	-68.3	-45.2	-177.7	-157.8	89.6	0	0	0	111.4	F710 R711 L719 F751	F710-L714 HydrophobicContact CE1-CD1 3.97Å; F710-L714 HydrophobicContact CZ-CD1 3.9Å; F710-L714 VanDerWaalsContact O-CB 3.26Å; F710-L714 WeakPolarHBondContact O-CB 3.43Å; F710-L714 PolarHBondContact O-N 3.24Å; R711-L714 PolarHBondContact O-N 3.29Å; L714-L719 WeakPolarHBondContact CD1-O 3.49Å; L714-F751 HydrophobicContact CD1-CD2 4.48Å; L714-F751 HydrophobicContact CD2-CD2 3.5Å; L714-F751 VanDerWaalsContact CD2-CD2 3.5Å; L714-F751 HydrophobicContact CD2-CE2 3.41Å; L714-F751 VanDerWaalsContact CD2-CE2 3.41Å; L714-F751 HydrophobicContact CD2-CG 4.48Å; L714-F751 HydrophobicContact CD2-CZ 4.31Å; L714-F751 HydrophobicContact CG-CD2 3.76Å; L714-F751 HydrophobicContact CG-CE2 3.89Å; L714-F751 HydrophobicContact CG-CG 4.3Å; L714-F751 HydrophobicContact CG-CZ 4.49Å
715	E	78.8	Confident	80.4	Confident	133 Å²	133	47.3 Å²	47.3	62%	0.621	23%	0.234	S	C	*	.	I	π-helix	trans	-78.3	-51.6	-176.1	-68.8	177.4	-175.5	0	0	112.8	R711	R711-E715 WeakPolarHBondContact O-CB 3.3Å; R711-E715 WeakPolarHBondContact O-CG 3.3Å; R711-E715 PolarHBondContact O-N 2.99Å
716	N	73.4	Confident	80.6	Confident	121 Å²	121	43.2 Å²	43.2	65%	0.647	21%	0.214	S	C	*	.	I	π-helix	trans	-105.5	-24.3	-165.8	-61.6	-48	0	0	0	114.1	D712	D712-N716 WeakPolarHBondContact O-CB 3.49Å; D712-N716 PolarHBondContact O-N 3.11Å; D712-N716 PolarHBondContact OD1-ND2 2.99Å
717	R	63.8	Low	80.6	Confident	45 Å²	45	45.3 Å²	45.3	17%	0.17	23%	0.225	C	C	.	.	I	π-helix	trans	-118.1	-2.5	-167.5	-48.6	177.1	178.8	-143.2	-11.2	115	V687 D690 D712 G713	V687-R717 HydrophobicContact CG1-CB 4.1Å; V687-R717 WeakPolarHBondContact CG1-O 3.41Å; V687-R717 HydrophobicContact CG2-CB 4.01Å; V687-R717 HydrophobicContact CG2-CG 4.35Å; D690-R717 IonicContact OD1-NH1 3.21Å; D690-R717 PolarHBondContact OD1-NH1 3.2Å; D690-R717 WeakPolarHBondContact OD2-CD 3.25Å; D690-R717 IonicContact OD2-CZ 3.7Å; D690-R717 IonicContact OD2-NE 2.8Å; D690-R717 IonicContact OD2-NH1 2.97Å; D690-R717 PolarHBondContact OD2-NH1 3.13Å; D712-R717 PolarHBondContact O-N 2.74Å; D712-R717 IonicContact OD2-CZ 3.18Å; D712-R717 IonicContact OD2-NE 3.18Å; D712-R717 PolarHBondContact OD2-NE 3.36Å; D712-R717 IonicContact OD2-NH2 3.88Å; D712-R717 PolarHBondContact OD2-NH2 3.09Å; G713-R717 CarbonylContact O-C 3.54Å; G713-R717 PolarHBondContact O-N 2.89Å
718	G	67.9	Low	80.7	Confident	45 Å²	45	45 Å²	45	46%	0.464	22%	0.224	S	C	.	.			trans	80.4	21.7	172.7	0	0	0	0	0	115.5	G713 R720	G713-G718 PolarHBondContact O-N 3.43Å; G718-R720 PolarHBondContact O-N 2.61Å
719	L	72.6	Confident	80.9	Confident	22 Å²	22	42 Å²	42	12%	0.115	20%	0.203	C	C	.	.			trans	-62.6	103.8	174.3	-172.5	75.9	0	0	0	110.2	K691 I694 F710 G713 L714	K691-L719 HydrophobicContact CB-CD1 4.24Å; I694-L719 HydrophobicContact CD1-CD2 3.43Å; I694-L719 VanDerWaalsContact CD1-CD2 3.43Å; F710-L719 HydrophobicContact CD2-CD2 3.56Å; F710-L719 HydrophobicContact CE2-CD2 3.92Å; F710-L719 HydrophobicContact CG-CD2 4.31Å; G713-L719 VanDerWaalsContact C-CB 3.44Å; G713-L719 WeakPolarHBondContact O-CB 3.34Å; G713-L719 PolarHBondContact O-N 2.88Å; L714-L719 WeakPolarHBondContact CD1-O 3.49Å
720	R	73.8	Confident	81.1	Confident	151 Å²	151	43.4 Å²	43.4	57%	0.57	21%	0.21	S	C	*	.			trans	-119.9	5.3	-178.2	-66.5	-178.5	-171.1	-170.4	2.8	114.5	G718 S722 H748	G718-R720 PolarHBondContact O-N 2.61Å; R720-S722 PolarHBondContact O-N 2.8Å; R720-H748 PolarHBondContact O-NE2 3.16Å
721	D	77.9	Confident	81.1	Confident	54 Å²	54	44.1 Å²	44.1	29%	0.289	22%	0.216	S	C	.	.			trans	-66.8	125.5	-178.7	-177.8	7.7	0	0	0	111.4	K691 R723 T724 H748	K691-D721 WeakPolarHBondContact CE-OD2 3.39Å; K691-D721 IonicContact NZ-OD2 2.76Å; K691-D721 PolarHBondContact NZ-OD2 3.09Å; D721-R723 VanDerWaalsContact C-N 3.26Å; D721-R723 PolarHBondContact O-N 3.39Å; D721-R723 WeakPolarHBondContact OD1-CB 3.3Å; D721-R723 PolarHBondContact OD1-N 3.36Å; D721-T724 WeakPolarHBondContact CB-OG1 3.39Å; D721-T724 PolarHBondContact O-OG1 3.29Å; D721-H748 PolarHBondContact O-NE2 3.49Å
722	S	83	Confident	81.3	Confident	14 Å²	14	39.1 Å²	39.1	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-67.9	-27.1	177.3	-61.2	0	0	0	0	112.4	R720 I726 H748 I760	R720-S722 PolarHBondContact O-N 2.8Å; S722-I726 PolarHBondContact O-N 2.9Å; S722-H748 PolarHBondContact OG-CE1 3.22Å; S722-I760 VanDerWaalsContact CB-CD1 3.5Å
723	R	81.7	Confident	81.6	Confident	83 Å²	83	37.1 Å²	37.1	31%	0.313	19%	0.187	S	C	.	.	H	α-helix	trans	-73.8	-43.6	-177	-168.8	169.9	178.4	171.9	-0.4	111.6	D721 A725 I726 D727	D721-R723 VanDerWaalsContact C-N 3.26Å; D721-R723 PolarHBondContact O-N 3.39Å; D721-R723 WeakPolarHBondContact OD1-CB 3.3Å; D721-R723 PolarHBondContact OD1-N 3.36Å; R723-A725 VanDerWaalsContact C-N 3.28Å; R723-A725 PolarHBondContact O-N 3.39Å; R723-I726 PolarHBondContact O-N 3.27Å; R723-I726 VanDerWaalsContact O-N 3.14Å; R723-D727 WeakPolarHBondContact O-CB 3.38Å; R723-D727 PolarHBondContact O-N 3.24Å
724	T	83.9	Confident	81.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-36.9	172.2	36.1	0	0	0	0	113.1	K691 D721 I726 L728	K691-T724 HydrophobicContact CB-CG2 4Å; K691-T724 HydrophobicContact CD-CG2 3.82Å; K691-T724 HydrophobicContact CG-CG2 3.52Å; D721-T724 WeakPolarHBondContact CB-OG1 3.39Å; D721-T724 PolarHBondContact O-OG1 3.29Å; T724-I726 VanDerWaalsContact C-N 3.34Å; T724-L728 VanDerWaalsContact O-CB 3.24Å; T724-L728 WeakPolarHBondContact O-CB 3.5Å; T724-L728 PolarHBondContact O-N 2.69Å
725	A	88	Confident	82	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-39.8	176.1	0	0	0	0	0	111.7	F710 R723 A729 V744 H748	F710-A725 HydrophobicContact CE2-CB 4.03Å; F710-A725 HydrophobicContact CZ-CB 3.81Å; R723-A725 VanDerWaalsContact C-N 3.28Å; R723-A725 PolarHBondContact O-N 3.39Å; A725-A729 VanDerWaalsContact O-CB 3.29Å; A725-A729 WeakPolarHBondContact O-CB 3.28Å; A725-A729 PolarHBondContact O-N 3.04Å; A725-V744 HydrophobicContact CB-CG1 4.29Å; A725-V744 WeakPolarHBondContact O-CG1 3.47Å; A725-H748 HydrophobicContact CB-CB 4.12Å
726	I	87.1	Confident	82.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-76.2	-40.7	177.8	-68.2	166.8	0	0	0	112.1	S722 R723 T724 L728 A729 M730 L745 I760 D763 V764 L767 Y792	S722-I726 PolarHBondContact O-N 2.9Å; R723-I726 PolarHBondContact O-N 3.27Å; R723-I726 VanDerWaalsContact O-N 3.14Å; T724-I726 VanDerWaalsContact C-N 3.34Å; I726-L728 VanDerWaalsContact C-N 3.29Å; I726-L728 PolarHBondContact O-N 3.26Å; I726-A729 PolarHBondContact O-N 2.73Å; I726-M730 HydrophobicContact CG2-CG 4.28Å; I726-M730 HydrophobicContact CG2-SD 4.11Å; I726-M730 WeakPolarHBondContact O-CB 3.43Å; I726-M730 VanDerWaalsContact O-CG 3.32Å; I726-M730 WeakPolarHBondContact O-CG 3.27Å; I726-M730 PolarHBondContact O-N 2.75Å; I726-L745 HydrophobicContact CG1-CD2 4.24Å; I726-I760 HydrophobicContact CD1-CG2 3.16Å; I726-D763 HydrophobicContact CG2-CB 3.95Å; I726-V764 HydrophobicContact CD1-CG2 3.93Å; I726-L767 HydrophobicContact CG2-CB 4.38Å; I726-L767 HydrophobicContact CG2-CD2 4.4Å; I726-Y792 HydrophobicContact CD1-CD1 3.8Å; I726-Y792 HydrophobicContact CD1-CE1 3.85Å; I726-Y792 HydrophobicContact CG1-CD1 4.49Å; I726-Y792 HydrophobicContact CG1-CE1 4.18Å
727	D	85.1	Confident	83	Confident	44 Å²	44	42 Å²	42	24%	0.235	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-40.4	175.6	-73.3	-29.8	0	0	0	110.7	R723 M730 A731	R723-D727 WeakPolarHBondContact O-CB 3.38Å; R723-D727 PolarHBondContact O-N 3.24Å; D727-M730 PolarHBondContact O-N 2.84Å; D727-A731 PolarHBondContact O-N 3.35Å
728	L	89.4	Confident	84.2	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-46.7	172.4	-179.4	59.3	0	0	0	111.8	I694 A706 L707 F710 T724 I726 M730 A731 L732 V744	I694-L728 HydrophobicContact CG2-CB 4.46Å; I694-L728 HydrophobicContact CG2-CD2 4.38Å; A706-L728 HydrophobicContact CB-CD1 3.76Å; L707-L728 HydrophobicContact CD2-CD2 4.42Å; F710-L728 HydrophobicContact CB-CD2 3.44Å; F710-L728 VanDerWaalsContact CB-CD2 3.44Å; F710-L728 HydrophobicContact CD1-CD2 3.88Å; F710-L728 HydrophobicContact CD2-CD2 3.71Å; F710-L728 HydrophobicContact CE2-CD2 4.44Å; F710-L728 HydrophobicContact CG-CD2 3.39Å; T724-L728 VanDerWaalsContact O-CB 3.24Å; T724-L728 WeakPolarHBondContact O-CB 3.5Å; T724-L728 PolarHBondContact O-N 2.69Å; I726-L728 VanDerWaalsContact C-N 3.29Å; I726-L728 PolarHBondContact O-N 3.26Å; L728-M730 VanDerWaalsContact C-N 3.29Å; L728-M730 PolarHBondContact O-N 2.89Å; L728-A731 PolarHBondContact O-N 2.88Å; L728-A731 VanDerWaalsContact O-N 3.17Å; L728-L732 HydrophobicContact CD1-CD1 4.1Å; L728-L732 HydrophobicContact CD1-CG 4.23Å; L728-L732 HydrophobicContact CG-CD1 3.86Å; L728-L732 HydrophobicContact CG-CG 4.44Å; L728-L732 WeakPolarHBondContact O-CB 3.44Å; L728-L732 VanDerWaalsContact O-CG 3.29Å; L728-L732 WeakPolarHBondContact O-CG 3.34Å; L728-L732 PolarHBondContact O-N 2.77Å; L728-V744 HydrophobicContact CD2-CG1 4.16Å; L728-V744 HydrophobicContact CD2-CG2 3.84Å; L728-V744 HydrophobicContact CG-CG1 4.46Å; L728-V744 HydrophobicContact CG-CG2 4.31Å
729	A	90.2	Very high	85.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-38.2	175.5	0	0	0	0	0	112.2	A725 I726 L732 V733 A741 L745 L767	A725-A729 VanDerWaalsContact O-CB 3.29Å; A725-A729 WeakPolarHBondContact O-CB 3.28Å; A725-A729 PolarHBondContact O-N 3.04Å; I726-A729 PolarHBondContact O-N 2.73Å; A729-L732 PolarHBondContact O-N 2.65Å; A729-V733 WeakPolarHBondContact O-CB 3.1Å; A729-V733 VanDerWaalsContact O-CG2 3.28Å; A729-V733 WeakPolarHBondContact O-CG2 3.48Å; A729-V733 PolarHBondContact O-N 3.49Å; A729-A741 HydrophobicContact CB-CB 4.12Å; A729-L745 HydrophobicContact CB-CD1 4.49Å; A729-L745 HydrophobicContact CB-CD2 4.35Å; A729-L745 HydrophobicContact CB-CG 4.28Å; A729-L767 HydrophobicContact CB-CD1 4.29Å; A729-L767 HydrophobicContact CB-CD2 4.43Å
730	M	88.4	Confident	86	Confident	39 Å²	39	46.5 Å²	46.5	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-40.7	174.7	-79.6	178.8	47.8	0	0	112.3	I726 D727 L728 S734 Q766 L767	I726-M730 HydrophobicContact CG2-CG 4.28Å; I726-M730 HydrophobicContact CG2-SD 4.11Å; I726-M730 WeakPolarHBondContact O-CB 3.43Å; I726-M730 VanDerWaalsContact O-CG 3.32Å; I726-M730 WeakPolarHBondContact O-CG 3.27Å; I726-M730 PolarHBondContact O-N 2.75Å; D727-M730 PolarHBondContact O-N 2.84Å; L728-M730 VanDerWaalsContact C-N 3.29Å; L728-M730 PolarHBondContact O-N 2.89Å; M730-S734 WeakPolarHBondContact O-CB 3.48Å; M730-S734 PolarHBondContact O-N 3.38Å; M730-S734 PolarHBondContact O-OG 3.1Å; M730-Q766 HydrophobicContact CE-CB 4.47Å; M730-Q766 HydrophobicContact SD-CB 4.38Å; M730-L767 HydrophobicContact CB-CD1 4.38Å; M730-L767 HydrophobicContact CG-CB 3.76Å; M730-L767 HydrophobicContact CG-CD1 3.69Å; M730-L767 HydrophobicContact CG-CG 4.3Å; M730-L767 HydrophobicContact SD-CB 4.37Å
731	A	87.6	Confident	86.8	Confident	17 Å²	17	39.3 Å²	39.3	14%	0.14	19%	0.193	C	C	.	.	H	α-helix	trans	-68.9	-40.2	175.6	0	0	0	0	0	112	A698 L703 D727 L728 S734 G735	A698-A731 HydrophobicContact CB-CB 3.63Å; L703-A731 HydrophobicContact CD2-CB 3.96Å; D727-A731 PolarHBondContact O-N 3.35Å; L728-A731 PolarHBondContact O-N 2.88Å; L728-A731 VanDerWaalsContact O-N 3.17Å; A731-S734 PolarHBondContact O-N 2.78Å; A731-G735 PolarHBondContact O-N 3.49Å
732	L	89.8	Confident	87.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-44.4	175.2	-69.4	166	0	0	0	111.8	L703 L707 L728 A729 S734 G735 R736 R737 D740 A741 V744	L703-L732 HydrophobicContact CB-CD2 4.15Å; L703-L732 HydrophobicContact CD1-CD2 4.42Å; L703-L732 HydrophobicContact CD2-CD2 4.29Å; L707-L732 HydrophobicContact CD1-CD2 3.78Å; L707-L732 HydrophobicContact CD2-CD1 3.82Å; L707-L732 HydrophobicContact CD2-CD2 4.42Å; L707-L732 HydrophobicContact CG-CD1 4.3Å; L707-L732 HydrophobicContact CG-CD2 4.06Å; L728-L732 HydrophobicContact CD1-CD1 4.1Å; L728-L732 HydrophobicContact CD1-CG 4.23Å; L728-L732 HydrophobicContact CG-CD1 3.86Å; L728-L732 HydrophobicContact CG-CG 4.44Å; L728-L732 WeakPolarHBondContact O-CB 3.44Å; L728-L732 VanDerWaalsContact O-CG 3.29Å; L728-L732 WeakPolarHBondContact O-CG 3.34Å; L728-L732 PolarHBondContact O-N 2.77Å; A729-L732 PolarHBondContact O-N 2.65Å; L732-S734 VanDerWaalsContact C-N 3.33Å; L732-S734 PolarHBondContact O-N 3.4Å; L732-G735 CarbonylContact O-C 3.58Å; L732-G735 WeakPolarHBondContact O-CA 3.36Å; L732-G735 PolarHBondContact O-N 2.79Å; L732-G735 VanDerWaalsContact O-N 3.13Å; L732-R736 PolarHBondContact O-N 3.13Å; L732-R736 VanDerWaalsContact O-N 3.11Å; L732-R737 HydrophobicContact CB-CB 4.32Å; L732-R737 HydrophobicContact CD2-CB 4.08Å; L732-R737 PolarHBondContact O-N 3.45Å; L732-D740 HydrophobicContact CD1-CB 4.04Å; L732-D740 HydrophobicContact CD2-CB 4.07Å; L732-A741 HydrophobicContact CB-CB 3.9Å; L732-V744 HydrophobicContact CD1-CG2 3.91Å
733	V	88.9	Confident	87.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-44	171.1	162.8	0	0	0	0	111.3	A729 G735 R736 F738 A741 L767 K770 A771 C774 L783	A729-V733 WeakPolarHBondContact O-CB 3.1Å; A729-V733 VanDerWaalsContact O-CG2 3.28Å; A729-V733 WeakPolarHBondContact O-CG2 3.48Å; A729-V733 PolarHBondContact O-N 3.49Å; V733-G735 VanDerWaalsContact C-N 3.28Å; V733-G735 PolarHBondContact O-N 2.82Å; V733-R736 PolarHBondContact O-N 3.37Å; V733-F738 HydrophobicContact CB-CE1 4.21Å; V733-F738 HydrophobicContact CB-CZ 4.44Å; V733-F738 HydrophobicContact CG1-CE1 3.76Å; V733-F738 HydrophobicContact CG1-CZ 3.8Å; V733-F738 HydrophobicContact CG2-CD1 3.89Å; V733-F738 HydrophobicContact CG2-CE1 3.76Å; V733-F738 HydrophobicContact CG2-CZ 4.45Å; V733-A741 HydrophobicContact CG2-CB 3.96Å; V733-L767 HydrophobicContact CB-CD1 4.42Å; V733-L767 HydrophobicContact CG2-CD1 3.93Å; V733-K770 HydrophobicContact CG1-CB 4.44Å; V733-K770 HydrophobicContact CG1-CG 4.24Å; V733-A771 HydrophobicContact CG1-CB 4.17Å; V733-C774 HydrophobicContact CG1-CB 4.45Å; V733-L783 HydrophobicContact CG2-CD2 4.12Å
734	S	86.4	Confident	88	Confident	62 Å²	62	35.5 Å²	35.5	43%	0.434	18%	0.178	S	C	.	.	H	α-helix	trans	-65.1	-32.7	176.4	-58.1	0	0	0	0	112.5	M730 A731 L732 R736	M730-S734 WeakPolarHBondContact O-CB 3.48Å; M730-S734 PolarHBondContact O-N 3.38Å; M730-S734 PolarHBondContact O-OG 3.1Å; A731-S734 PolarHBondContact O-N 2.78Å; L732-S734 VanDerWaalsContact C-N 3.33Å; L732-S734 PolarHBondContact O-N 3.4Å; S734-R736 VanDerWaalsContact C-N 3.28Å; S734-R736 PolarHBondContact O-N 3Å
735	G	85	Confident	88.3	Confident	38 Å²	38	35.5 Å²	35.5	39%	0.392	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	7.8	171.8	0	0	0	0	0	115.3	A731 L732 V733 R737	A731-G735 PolarHBondContact O-N 3.49Å; L732-G735 CarbonylContact O-C 3.58Å; L732-G735 WeakPolarHBondContact O-CA 3.36Å; L732-G735 PolarHBondContact O-N 2.79Å; L732-G735 VanDerWaalsContact O-N 3.13Å; V733-G735 VanDerWaalsContact C-N 3.28Å; V733-G735 PolarHBondContact O-N 2.82Å; G735-R737 VanDerWaalsContact C-N 3.27Å; G735-R737 PolarHBondContact O-N 3.16Å
736	R	85.5	Confident	88.2	Confident	199 Å²	199	39.7 Å²	39.7	75%	0.751	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	28.7	-176	-55.8	-175.5	176.9	-167.7	-2.1	115.1	L732 V733 S734	L732-R736 PolarHBondContact O-N 3.13Å; L732-R736 VanDerWaalsContact O-N 3.11Å; V733-R736 PolarHBondContact O-N 3.37Å; S734-R736 VanDerWaalsContact C-N 3.28Å; S734-R736 PolarHBondContact O-N 3Å
737	R	87.9	Confident	88.2	Confident	66 Å²	66	41.3 Å²	41.3	25%	0.249	21%	0.208	C	C	.	.			trans	-104.9	60.6	177.1	-65.9	173.6	67.6	156.6	2.1	110.6	D704 L707 L732 G735 F739 D740 A741	D704-R737 IonicContact OD1-CZ 2.8Å; D704-R737 VanDerWaalsContact OD1-CZ 3.24Å; D704-R737 IonicContact OD1-NH1 2.98Å; D704-R737 PolarHBondContact OD1-NH1 2.67Å; D704-R737 IonicContact OD1-NH2 2.94Å; D704-R737 PolarHBondContact OD1-NH2 3.09Å; D704-R737 IonicContact OD2-NH1 3.45Å; D704-R737 PolarHBondContact OD2-NH1 3.2Å; L707-R737 VanDerWaalsContact CD1-NH2 3.28Å; L732-R737 HydrophobicContact CB-CB 4.32Å; L732-R737 HydrophobicContact CD2-CB 4.08Å; L732-R737 PolarHBondContact O-N 3.45Å; G735-R737 VanDerWaalsContact C-N 3.27Å; G735-R737 PolarHBondContact O-N 3.16Å; R737-F739 VanDerWaalsContact C-N 3.34Å; R737-F739 PolarHBondContact O-N 3.25Å; R737-D740 HydrophobicContact CB-CB 4.27Å; R737-D740 IonicContact CZ-OD2 2.78Å; R737-D740 IonicContact NE-OD2 3.07Å; R737-D740 PolarHBondContact NE-OD2 3.37Å; R737-D740 IonicContact NH2-OD2 2.7Å; R737-D740 PolarHBondContact NH2-OD2 2.99Å; R737-D740 PolarHBondContact O-N 3.21Å; R737-A741 PolarHBondContact O-N 3.22Å; R737-A741 VanDerWaalsContact O-N 3.11Å
738	F	87.8	Confident	88.2	Confident	8 Å²	8	39.3 Å²	39.3	4%	0.035	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-38.9	-176	-76.5	-89.4	0	0	0	113.4	V733 A741 V742 A771 C774 E779	V733-F738 HydrophobicContact CB-CE1 4.21Å; V733-F738 HydrophobicContact CB-CZ 4.44Å; V733-F738 HydrophobicContact CG1-CE1 3.76Å; V733-F738 HydrophobicContact CG1-CZ 3.8Å; V733-F738 HydrophobicContact CG2-CD1 3.89Å; V733-F738 HydrophobicContact CG2-CE1 3.76Å; V733-F738 HydrophobicContact CG2-CZ 4.45Å; F738-A741 WeakPolarHBondContact O-CB 3.03Å; F738-A741 PolarHBondContact O-N 3.08Å; F738-V742 WeakPolarHBondContact O-CG2 3.15Å; F738-V742 PolarHBondContact O-N 3.16Å; F738-A771 HydrophobicContact CE1-CB 4.12Å; F738-C774 HydrophobicContact CZ-CB 4.1Å; F738-E779 HydrophobicContact CB-CB 3.95Å; F738-E779 HydrophobicContact CB-CG 4.17Å; F738-E779 HydrophobicContact CD1-CB 3.87Å; F738-E779 HydrophobicContact CD2-CB 4.12Å; F738-E779 VanDerWaalsContact CD2-CD 3.49Å; F738-E779 HydrophobicContact CD2-CG 4.26Å; F738-E779 WeakPolarHBondContact CD2-OE1 3.41Å; F738-E779 HydrophobicContact CE1-CB 4.43Å; F738-E779 HydrophobicContact CG-CB 3.71Å; F738-E779 HydrophobicContact CG-CG 4.17Å
739	F	89.3	Confident	87.8	Confident	169 Å²	169	43.6 Å²	43.6	74%	0.741	21%	0.213	S	C	*	.	H	α-helix	trans	-60.6	-46	177.2	-173.9	-92.3	0	0	0	112.2	R737 A741 V742 D743	R737-F739 VanDerWaalsContact C-N 3.34Å; R737-F739 PolarHBondContact O-N 3.25Å; F739-A741 VanDerWaalsContact C-N 3.31Å; F739-A741 PolarHBondContact O-N 2.66Å; F739-V742 PolarHBondContact O-N 2.83Å; F739-D743 PolarHBondContact O-N 2.84Å
740	D	90.2	Very high	87.3	Confident	31 Å²	31	48 Å²	48	17%	0.166	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-35.4	176.5	-65.1	-30.4	0	0	0	111.6	L707 L732 R737 D743 V744	L707-D740 HydrophobicContact CD1-CB 4.14Å; L707-D740 HydrophobicContact CD2-CB 4.42Å; L732-D740 HydrophobicContact CD1-CB 4.04Å; L732-D740 HydrophobicContact CD2-CB 4.07Å; R737-D740 HydrophobicContact CB-CB 4.27Å; R737-D740 IonicContact CZ-OD2 2.78Å; R737-D740 IonicContact NE-OD2 3.07Å; R737-D740 PolarHBondContact NE-OD2 3.37Å; R737-D740 IonicContact NH2-OD2 2.7Å; R737-D740 PolarHBondContact NH2-OD2 2.99Å; R737-D740 PolarHBondContact O-N 3.21Å; D740-D743 PolarHBondContact O-N 3.06Å; D740-V744 WeakPolarHBondContact O-CB 3.45Å; D740-V744 VanDerWaalsContact O-CG2 3.31Å; D740-V744 WeakPolarHBondContact O-CG2 3.45Å; D740-V744 PolarHBondContact O-N 3.37Å
741	A	89.7	Confident	86.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-40.4	174.6	0	0	0	0	0	112.1	A729 L732 V733 R737 F738 F739 L745	A729-A741 HydrophobicContact CB-CB 4.12Å; L732-A741 HydrophobicContact CB-CB 3.9Å; V733-A741 HydrophobicContact CG2-CB 3.96Å; R737-A741 PolarHBondContact O-N 3.22Å; R737-A741 VanDerWaalsContact O-N 3.11Å; F738-A741 WeakPolarHBondContact O-CB 3.03Å; F738-A741 PolarHBondContact O-N 3.08Å; F739-A741 VanDerWaalsContact C-N 3.31Å; F739-A741 PolarHBondContact O-N 2.66Å; A741-L745 WeakPolarHBondContact O-CG 3.18Å; A741-L745 PolarHBondContact O-N 3.02Å
742	V	89.5	Confident	85.9	Confident	20 Å²	20	51 Å²	51	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-65.2	-43.9	173.7	166.8	0	0	0	0	111	F738 F739 L745 K746 D782 L783 A786	F738-V742 WeakPolarHBondContact O-CG2 3.15Å; F738-V742 PolarHBondContact O-N 3.16Å; F739-V742 PolarHBondContact O-N 2.83Å; V742-L745 PolarHBondContact O-N 3.32Å; V742-K746 HydrophobicContact CG1-CD 4.17Å; V742-K746 HydrophobicContact CG1-CG 4.42Å; V742-K746 WeakPolarHBondContact O-CG 3.17Å; V742-K746 PolarHBondContact O-N 3.24Å; V742-D782 HydrophobicContact CG2-CB 4.29Å; V742-L783 HydrophobicContact CG2-CD1 4.29Å; V742-A786 HydrophobicContact CB-CB 4.45Å; V742-A786 HydrophobicContact CG1-CB 3.94Å; V742-A786 HydrophobicContact CG2-CB 4.17Å
743	D	90.3	Very high	84.7	Confident	48 Å²	48	55.5 Å²	55.5	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-42.4	177	-177.8	50	0	0	0	112.2	R711 F739 D740 L745 K746 S747	R711-D743 IonicContact CZ-OD2 2.66Å; R711-D743 IonicContact NE-OD2 3.72Å; R711-D743 IonicContact NH2-OD2 3.41Å; R711-D743 PolarHBondContact NH2-OD2 2.65Å; F739-D743 PolarHBondContact O-N 2.84Å; D740-D743 PolarHBondContact O-N 3.06Å; D743-L745 PolarHBondContact O-N 2.92Å; D743-K746 PolarHBondContact O-N 3.19Å; D743-S747 WeakPolarHBondContact O-CB 3.46Å; D743-S747 PolarHBondContact O-N 2.88Å; D743-S747 PolarHBondContact O-OG 2.91Å; D743-S747 PolarHBondContact OD1-OG 2.82Å
744	V	88.8	Confident	83.7	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-45.8	174.5	162.8	0	0	0	0	111.8	L707 F710 A725 L728 L732 D740 H748	L707-V744 HydrophobicContact CD2-CG2 3.67Å; F710-V744 HydrophobicContact CD1-CG1 4.41Å; F710-V744 HydrophobicContact CD1-CG2 4.33Å; F710-V744 HydrophobicContact CE1-CB 4.48Å; F710-V744 HydrophobicContact CE1-CG1 3.83Å; F710-V744 HydrophobicContact CE1-CG2 4.38Å; F710-V744 HydrophobicContact CZ-CG1 3.96Å; A725-V744 HydrophobicContact CB-CG1 4.29Å; A725-V744 WeakPolarHBondContact O-CG1 3.47Å; L728-V744 HydrophobicContact CD2-CG1 4.16Å; L728-V744 HydrophobicContact CD2-CG2 3.84Å; L728-V744 HydrophobicContact CG-CG1 4.46Å; L728-V744 HydrophobicContact CG-CG2 4.31Å; L732-V744 HydrophobicContact CD1-CG2 3.91Å; D740-V744 WeakPolarHBondContact O-CB 3.45Å; D740-V744 VanDerWaalsContact O-CG2 3.31Å; D740-V744 WeakPolarHBondContact O-CG2 3.45Å; D740-V744 PolarHBondContact O-N 3.37Å; V744-H748 VanDerWaalsContact O-CB 3.3Å; V744-H748 WeakPolarHBondContact O-CB 3.11Å; V744-H748 PolarHBondContact O-N 3.23Å
745	L	88.6	Confident	82.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-40.5	179.5	-66	170.7	0	0	0	112.4	I726 A729 A741 V742 D743 R749 L767 L783 L787 Y792	I726-L745 HydrophobicContact CG1-CD2 4.24Å; A729-L745 HydrophobicContact CB-CD1 4.49Å; A729-L745 HydrophobicContact CB-CD2 4.35Å; A729-L745 HydrophobicContact CB-CG 4.28Å; A741-L745 WeakPolarHBondContact O-CG 3.18Å; A741-L745 PolarHBondContact O-N 3.02Å; V742-L745 PolarHBondContact O-N 3.32Å; D743-L745 PolarHBondContact O-N 2.92Å; L745-R749 PolarHBondContact O-N 3.09Å; L745-L767 HydrophobicContact CD1-CD2 4.39Å; L745-L783 HydrophobicContact CD1-CD1 3.74Å; L745-L787 HydrophobicContact CD1-CD2 3.97Å; L745-L787 HydrophobicContact CD1-CG 4.2Å; L745-L787 HydrophobicContact CD2-CD2 4.5Å; L745-Y792 HydrophobicContact CB-CE2 4.27Å; L745-Y792 HydrophobicContact CD2-CD2 4.29Å; L745-Y792 HydrophobicContact CD2-CE2 3.59Å; L745-Y792 HydrophobicContact CG-CE2 4.49Å
746	K	86.9	Confident	82.4	Confident	89 Å²	89	61.7 Å²	61.7	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-70.7	-41.3	177.4	-68.3	-167	-173.3	-152.4	0	111.8	V742 D743 R749 S750 A786 E789	V742-K746 HydrophobicContact CG1-CD 4.17Å; V742-K746 HydrophobicContact CG1-CG 4.42Å; V742-K746 WeakPolarHBondContact O-CG 3.17Å; V742-K746 PolarHBondContact O-N 3.24Å; D743-K746 PolarHBondContact O-N 3.19Å; K746-R749 PolarHBondContact O-N 3.13Å; K746-S750 PolarHBondContact O-N 3.2Å; K746-A786 HydrophobicContact CG-CB 4.48Å; K746-E789 VanDerWaalsContact CE-OE2 3.27Å; K746-E789 WeakPolarHBondContact CE-OE2 3.37Å; K746-E789 IonicContact NZ-OE2 2.69Å; K746-E789 PolarHBondContact NZ-OE2 3Å
747	S	86.3	Confident	81.7	Confident	35 Å²	35	53.6 Å²	53.6	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-48.6	174.9	-69.7	0	0	0	0	111.4	D743 R749 S750 F751	D743-S747 WeakPolarHBondContact O-CB 3.46Å; D743-S747 PolarHBondContact O-N 2.88Å; D743-S747 PolarHBondContact O-OG 2.91Å; D743-S747 PolarHBondContact OD1-OG 2.82Å; S747-R749 VanDerWaalsContact C-N 3.31Å; S747-R749 PolarHBondContact O-N 2.65Å; S747-S750 WeakPolarHBondContact O-CB 3.46Å; S747-S750 PolarHBondContact O-N 3.04Å; S747-S750 VanDerWaalsContact O-N 3.08Å; S747-S750 PolarHBondContact O-OG 3.11Å; S747-F751 WeakPolarHBondContact O-CD2 3.4Å
748	H	85.8	Confident	80.8	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-41.7	178.2	-178	-94.5	0	0	0	112.7	F710 R720 D721 S722 A725 V744 S750 F751 M752 Y792	F710-H748 HydrophobicContact CZ-CB 4.46Å; R720-H748 PolarHBondContact O-NE2 3.16Å; D721-H748 PolarHBondContact O-NE2 3.49Å; S722-H748 PolarHBondContact OG-CE1 3.22Å; A725-H748 HydrophobicContact CB-CB 4.12Å; V744-H748 VanDerWaalsContact O-CB 3.3Å; V744-H748 WeakPolarHBondContact O-CB 3.11Å; V744-H748 PolarHBondContact O-N 3.23Å; H748-S750 VanDerWaalsContact C-N 3.25Å; H748-S750 PolarHBondContact O-N 2.73Å; H748-F751 PolarHBondContact O-N 2.91Å; H748-F751 VanDerWaalsContact O-N 3.11Å; H748-M752 VanDerWaalsContact CE1-CG 3.42Å; H748-M752 WeakPolarHBondContact CE1-CG 3.19Å; H748-M752 PolarHBondContact CE1-SD 3.28Å; H748-M752 PolarHBondContact O-N 2.95Å; H748-Y792 AromaticContact ND1-CZ 3.99Å; H748-Y792 PolarHBondContact ND1-OH 2.79Å
749	R	81.6	Confident	80.1	Confident	92 Å²	92	62 Å²	62	35%	0.347	33%	0.327	S	S	.	.	H	α-helix	trans	-56.5	-36.6	176.3	178.7	55.2	162.1	159.4	-6.9	113.1	L745 K746 S747 F751 M752 S753 S790	L745-R749 PolarHBondContact O-N 3.09Å; K746-R749 PolarHBondContact O-N 3.13Å; S747-R749 VanDerWaalsContact C-N 3.31Å; S747-R749 PolarHBondContact O-N 2.65Å; R749-F751 PolarHBondContact O-N 2.89Å; R749-F751 VanDerWaalsContact O-N 3.15Å; R749-M752 PolarHBondContact NH1-O 3.38Å; R749-M752 PolarHBondContact O-N 2.84Å; R749-M752 VanDerWaalsContact O-N 3.08Å; R749-S753 PolarHBondContact NH1-O 3.03Å; R749-S790 WeakPolarHBondContact CD-O 3.47Å; R749-S790 PolarHBondContact NE-O 3.33Å; R749-S790 VanDerWaalsContact NE-O 3.16Å
750	S	79	Confident	79.6	Confident	91 Å²	91	54.7 Å²	54.7	64%	0.636	30%	0.296	S	S	*	.	H	α-helix	trans	-62.1	-22.9	-179.1	73.2	0	0	0	0	113.4	K746 S747 H748	K746-S750 PolarHBondContact O-N 3.2Å; S747-S750 WeakPolarHBondContact O-CB 3.46Å; S747-S750 PolarHBondContact O-N 3.04Å; S747-S750 VanDerWaalsContact O-N 3.08Å; S747-S750 PolarHBondContact O-OG 3.11Å; H748-S750 VanDerWaalsContact C-N 3.25Å; H748-S750 PolarHBondContact O-N 2.73Å
751	F	73.8	Confident	78.9	Confident	80 Å²	80	55.8 Å²	55.8	35%	0.351	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-2.1	177.3	-64.4	-96.2	0	0	0	114	L714 S747 H748 R749	L714-F751 HydrophobicContact CD1-CD2 4.48Å; L714-F751 HydrophobicContact CD2-CD2 3.5Å; L714-F751 VanDerWaalsContact CD2-CD2 3.5Å; L714-F751 HydrophobicContact CD2-CE2 3.41Å; L714-F751 VanDerWaalsContact CD2-CE2 3.41Å; L714-F751 HydrophobicContact CD2-CG 4.48Å; L714-F751 HydrophobicContact CD2-CZ 4.31Å; L714-F751 HydrophobicContact CG-CD2 3.76Å; L714-F751 HydrophobicContact CG-CE2 3.89Å; L714-F751 HydrophobicContact CG-CG 4.3Å; L714-F751 HydrophobicContact CG-CZ 4.49Å; S747-F751 WeakPolarHBondContact O-CD2 3.4Å; H748-F751 PolarHBondContact O-N 2.91Å; H748-F751 VanDerWaalsContact O-N 3.11Å; R749-F751 PolarHBondContact O-N 2.89Å; R749-F751 VanDerWaalsContact O-N 3.15Å
752	M	72.8	Confident	78.5	Confident	40 Å²	40	60.1 Å²	60.1	20%	0.197	32%	0.323	C	S	.	.			trans	-128.1	115.8	-170.6	-79.5	-118.2	67.1	0	0	113.6	H748 R749	H748-M752 VanDerWaalsContact CE1-CG 3.42Å; H748-M752 WeakPolarHBondContact CE1-CG 3.19Å; H748-M752 PolarHBondContact CE1-SD 3.28Å; H748-M752 PolarHBondContact O-N 2.95Å; R749-M752 PolarHBondContact NH1-O 3.38Å; R749-M752 PolarHBondContact O-N 2.84Å; R749-M752 VanDerWaalsContact O-N 3.08Å
753	S	64.9	Low	78.2	Confident	94 Å²	94	59.6 Å²	59.6	66%	0.657	32%	0.32	S	S	*	.	S	Bend	trans	-76.3	-46.8	176.9	54.6	0	0	0	0	113.7	R749	R749-S753 PolarHBondContact NH1-O 3.03Å
754	N	67.5	Low	77.9	Confident	105 Å²	105	57.6 Å²	57.6	56%	0.561	31%	0.309	S	S	*	.			trans	-127.9	122	-174	-76.4	-29.5	0	0	0	111.9
755	I	70.9	Confident	77.7	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.128	32%	0.323	C	S	.	.			trans	-108	130.1	177.9	-62.6	176	0	0	0	109.1	T757 I760 S790 Y792	I755-T757 PolarHBondContact O-N 3.45Å; I755-T757 VanDerWaalsContact O-N 3.09Å; I755-I760 HydrophobicContact CG2-CD1 3.54Å; I755-S790 WeakPolarHBondContact CD1-O 3.39Å; I755-Y792 HydrophobicContact CD1-CD1 4.11Å; I755-Y792 HydrophobicContact CD1-CD2 4.37Å; I755-Y792 HydrophobicContact CD1-CE1 3.96Å; I755-Y792 HydrophobicContact CD1-CE2 4.22Å; I755-Y792 HydrophobicContact CD1-CG 4.31Å; I755-Y792 HydrophobicContact CG2-CD1 3.78Å; I755-Y792 HydrophobicContact CG2-CE1 4.22Å; I755-Y792 HydrophobicContact CG2-CG 4.46Å
756	N	73	Confident	77.5	Confident	100 Å²	100	63 Å²	63	54%	0.535	34%	0.336	S	S	.	.			trans	-82.6	85.9	179	-175.2	-8.3	0	0	0	111.2	K758 A759 I760	N756-K758 PolarHBondContact O-N 3.25Å; N756-K758 PolarHBondContact OD1-N 2.94Å; N756-A759 HydrophobicContact CB-CB 4.18Å; N756-A759 PolarHBondContact O-N 2.92Å; N756-A759 VanDerWaalsContact O-N 3.13Å; N756-A759 PolarHBondContact OD1-N 2.96Å; N756-I760 WeakPolarHBondContact O-CD1 3.48Å; N756-I760 PolarHBondContact O-N 3.45Å
757	T	70.8	Confident	77.5	Confident	30 Å²	30	58.8 Å²	58.8	18%	0.184	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-26.1	-175.2	59.9	0	0	0	0	114.5	I755 S761 G791 Y792 V794	I755-T757 PolarHBondContact O-N 3.45Å; I755-T757 VanDerWaalsContact O-N 3.09Å; T757-S761 WeakPolarHBondContact O-CA 3.45Å; T757-S761 VanDerWaalsContact O-CB 3.25Å; T757-S761 WeakPolarHBondContact O-CB 3.28Å; T757-S761 PolarHBondContact O-N 2.89Å; T757-G791 VanDerWaalsContact CG2-O 3.24Å; T757-G791 WeakPolarHBondContact CG2-O 3.21Å; T757-Y792 VanDerWaalsContact CG2-O 3.26Å; T757-Y792 WeakPolarHBondContact CG2-O 3.42Å; T757-V794 HydrophobicContact CG2-CB 4.47Å; T757-V794 HydrophobicContact CG2-CG2 3.84Å
758	K	69.9	Low	77.5	Confident	182 Å²	182	57.2 Å²	57.2	79%	0.791	31%	0.307	S	S	*	.	H	α-helix	trans	-67.1	-49.3	173.2	-73.5	-172	177.4	-176.3	0	111.4	N756 I760 S761	N756-K758 PolarHBondContact O-N 3.25Å; N756-K758 PolarHBondContact OD1-N 2.94Å; K758-I760 PolarHBondContact O-N 3.39Å; K758-S761 PolarHBondContact O-N 3.43Å; K758-S761 PolarHBondContact O-OG 3.23Å
759	A	72.7	Confident	77.5	Confident	67 Å²	67	58.5 Å²	58.5	55%	0.554	32%	0.315	S	S	*	.	H	α-helix	trans	-63.5	-30.9	-179.1	0	0	0	0	0	113	N756	N756-A759 HydrophobicContact CB-CB 4.18Å; N756-A759 PolarHBondContact O-N 2.92Å; N756-A759 VanDerWaalsContact O-N 3.13Å; N756-A759 PolarHBondContact OD1-N 2.96Å
760	I	78.5	Confident	77.6	Confident	16 Å²	16	57.4 Å²	57.4	8%	0.082	31%	0.312	C	S	.	.	H	α-helix	trans	-100.6	-9	-172.5	-63	160	0	0	0	112.3	S722 I726 I755 N756 K758 Y762 D763 V764 Y792	S722-I760 VanDerWaalsContact CB-CD1 3.5Å; I726-I760 HydrophobicContact CD1-CG2 3.16Å; I755-I760 HydrophobicContact CG2-CD1 3.54Å; N756-I760 WeakPolarHBondContact O-CD1 3.48Å; N756-I760 PolarHBondContact O-N 3.45Å; K758-I760 PolarHBondContact O-N 3.39Å; I760-Y762 PolarHBondContact O-N 2.82Å; I760-Y762 VanDerWaalsContact O-N 3.11Å; I760-D763 PolarHBondContact O-N 3.29Å; I760-D763 VanDerWaalsContact O-N 3.13Å; I760-V764 HydrophobicContact CG2-CG2 3.78Å; I760-V764 PolarHBondContact O-N 2.87Å; I760-Y792 HydrophobicContact CG2-CD1 4.11Å
761	S	75.9	Confident	78	Confident	55 Å²	55	53.1 Å²	53.1	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-53.2	-36.3	-175.8	59.9	0	0	0	0	114.4	T757 K758 N765	T757-S761 WeakPolarHBondContact O-CA 3.45Å; T757-S761 VanDerWaalsContact O-CB 3.25Å; T757-S761 WeakPolarHBondContact O-CB 3.28Å; T757-S761 PolarHBondContact O-N 2.89Å; K758-S761 PolarHBondContact O-N 3.43Å; K758-S761 PolarHBondContact O-OG 3.23Å; S761-N765 WeakPolarHBondContact O-CB 3.36Å; S761-N765 PolarHBondContact O-N 2.97Å; S761-N765 VanDerWaalsContact O-N 3.08Å; S761-N765 PolarHBondContact O-ND2 3.22Å
762	Y	82	Confident	78.4	Confident	91 Å²	91	49.5 Å²	49.5	36%	0.357	27%	0.267	S	S	.	.	H	α-helix	trans	-75.2	-40.6	-179.1	-177.7	-113.7	0	0	0	112.4	Y601 R605 I760 N765 Q766	Y601-Y762 WeakPolarHBondContact OH-CD1 3.36Å; R605-Y762 HydrophobicContact CB-CE1 4.12Å; R605-Y762 WeakPolarHBondContact CB-OH 3.27Å; R605-Y762 HydrophobicContact CG-CE1 4.03Å; R605-Y762 WeakPolarHBondContact CG-OH 3.4Å; R605-Y762 VanDerWaalsContact CZ-CE1 3.49Å; R605-Y762 VanDerWaalsContact NH1-CD1 3.29Å; I760-Y762 PolarHBondContact O-N 2.82Å; I760-Y762 VanDerWaalsContact O-N 3.11Å; Y762-N765 PolarHBondContact O-N 3.23Å; Y762-Q766 HydrophobicContact CE1-CG 4.38Å; Y762-Q766 HydrophobicContact CE2-CG 4.42Å; Y762-Q766 VanDerWaalsContact O-CG 3.3Å; Y762-Q766 WeakPolarHBondContact O-CG 3.49Å; Y762-Q766 PolarHBondContact O-N 3.08Å; Y762-Q766 PolarHBondContact OH-NE2 3.32Å
763	D	82.1	Confident	78.9	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.048	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-38.4	176.1	-63.1	-46.3	0	0	0	111.7	R605 I726 I760 Q766 L767	R605-D763 IonicContact CZ-OD1 3.54Å; R605-D763 IonicContact NH1-OD1 3.65Å; R605-D763 PolarHBondContact NH1-OD1 2.88Å; R605-D763 IonicContact NH2-OD1 2.67Å; R605-D763 PolarHBondContact NH2-OD1 2.86Å; I726-D763 HydrophobicContact CG2-CB 3.95Å; I760-D763 PolarHBondContact O-N 3.29Å; I760-D763 VanDerWaalsContact O-N 3.13Å; D763-Q766 PolarHBondContact O-N 3.16Å; D763-L767 PolarHBondContact O-N 3.38Å
764	V	84.5	Confident	79.4	Confident	6 Å²	6	49.8 Å²	49.8	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-42.3	171.5	173.5	0	0	0	0	111.4	I726 I760 Q766 L767 L768 L787	I726-V764 HydrophobicContact CD1-CG2 3.93Å; I760-V764 HydrophobicContact CG2-CG2 3.78Å; I760-V764 PolarHBondContact O-N 2.87Å; V764-Q766 VanDerWaalsContact C-N 3.25Å; V764-Q766 PolarHBondContact O-N 2.91Å; V764-L767 PolarHBondContact O-N 3Å; V764-L768 HydrophobicContact CG1-CD1 4.06Å; V764-L768 HydrophobicContact CG1-CG 4.38Å; V764-L768 WeakPolarHBondContact O-CB 3.33Å; V764-L768 VanDerWaalsContact O-CG 3.28Å; V764-L768 WeakPolarHBondContact O-CG 3.2Å; V764-L768 PolarHBondContact O-N 3.15Å; V764-L787 HydrophobicContact CG1-CD1 4.22Å; V764-L787 HydrophobicContact CG1-CD2 4.33Å; V764-L787 HydrophobicContact CG2-CD2 4.42Å
765	N	83.3	Confident	79.7	Confident	54 Å²	54	45 Å²	45	29%	0.289	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-32.5	175.4	-83.8	-55.5	0	0	0	112.6	S761 Y762 T769 K802	S761-N765 WeakPolarHBondContact O-CB 3.36Å; S761-N765 PolarHBondContact O-N 2.97Å; S761-N765 VanDerWaalsContact O-N 3.08Å; S761-N765 PolarHBondContact O-ND2 3.22Å; Y762-N765 PolarHBondContact O-N 3.23Å; N765-T769 WeakPolarHBondContact O-CB 3.42Å; N765-T769 PolarHBondContact O-N 2.78Å; N765-T769 PolarHBondContact O-OG1 3.32Å; N765-K802 WeakPolarHBondContact OD1-CG 3.4Å
766	Q	85	Confident	80.1	Confident	62 Å²	62	49 Å²	49	29%	0.29	26%	0.259	S	S	.	.	H	α-helix	trans	-74.6	-44.4	176.7	-71.4	-81.4	21.8	0	0	111.4	M730 Y762 D763 V764 L768 T769 K770	M730-Q766 HydrophobicContact CE-CB 4.47Å; M730-Q766 HydrophobicContact SD-CB 4.38Å; Y762-Q766 HydrophobicContact CE1-CG 4.38Å; Y762-Q766 HydrophobicContact CE2-CG 4.42Å; Y762-Q766 VanDerWaalsContact O-CG 3.3Å; Y762-Q766 WeakPolarHBondContact O-CG 3.49Å; Y762-Q766 PolarHBondContact O-N 3.08Å; Y762-Q766 PolarHBondContact OH-NE2 3.32Å; D763-Q766 PolarHBondContact O-N 3.16Å; V764-Q766 VanDerWaalsContact C-N 3.25Å; V764-Q766 PolarHBondContact O-N 2.91Å; Q766-L768 PolarHBondContact O-N 3.42Å; Q766-T769 PolarHBondContact O-N 2.86Å; Q766-K770 WeakPolarHBondContact O-CB 3.45Å; Q766-K770 PolarHBondContact O-N 2.8Å
767	L	86.6	Confident	80.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-48	170.2	174.5	64	0	0	0	111.9	I726 A729 M730 V733 L745 D763 V764 K770 A771 L783 L787	I726-L767 HydrophobicContact CG2-CB 4.38Å; I726-L767 HydrophobicContact CG2-CD2 4.4Å; A729-L767 HydrophobicContact CB-CD1 4.29Å; A729-L767 HydrophobicContact CB-CD2 4.43Å; M730-L767 HydrophobicContact CB-CD1 4.38Å; M730-L767 HydrophobicContact CG-CB 3.76Å; M730-L767 HydrophobicContact CG-CD1 3.69Å; M730-L767 HydrophobicContact CG-CG 4.3Å; M730-L767 HydrophobicContact SD-CB 4.37Å; V733-L767 HydrophobicContact CB-CD1 4.42Å; V733-L767 HydrophobicContact CG2-CD1 3.93Å; L745-L767 HydrophobicContact CD1-CD2 4.39Å; D763-L767 PolarHBondContact O-N 3.38Å; V764-L767 PolarHBondContact O-N 3Å; L767-K770 PolarHBondContact O-N 2.81Å; L767-A771 WeakPolarHBondContact O-CB 3.2Å; L767-A771 PolarHBondContact O-N 2.82Å; L767-L783 HydrophobicContact CD1-CD2 4.22Å; L767-L783 HydrophobicContact CD2-CD1 4.49Å; L767-L783 HydrophobicContact CG-CD2 4.18Å; L767-L787 HydrophobicContact CD2-CD1 4.29Å; L767-L787 HydrophobicContact CD2-CD2 4.21Å
768	L	86.4	Confident	81.1	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-38.6	177.9	-70	174.4	0	0	0	112.7	V764 Q766 A771 C772 V784 L787 P799	V764-L768 HydrophobicContact CG1-CD1 4.06Å; V764-L768 HydrophobicContact CG1-CG 4.38Å; V764-L768 WeakPolarHBondContact O-CB 3.33Å; V764-L768 VanDerWaalsContact O-CG 3.28Å; V764-L768 WeakPolarHBondContact O-CG 3.2Å; V764-L768 PolarHBondContact O-N 3.15Å; Q766-L768 PolarHBondContact O-N 3.42Å; L768-A771 PolarHBondContact O-N 3.39Å; L768-C772 PolarHBondContact O-N 3.09Å; L768-C772 PolarHBondContact O-SG 3.47Å; L768-V784 HydrophobicContact CD2-CG2 3.73Å; L768-L787 HydrophobicContact CD2-CD1 3.64Å; L768-L787 HydrophobicContact CG-CD1 4.14Å; L768-P799 HydrophobicContact CD1-CB 3.77Å; L768-P799 HydrophobicContact CD1-CG 4.43Å
769	T	85.4	Confident	81.9	Confident	27 Å²	27	45.4 Å²	45.4	17%	0.166	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-45.4	175.9	-54.7	0	0	0	0	110	N765 Q766 A771 C772 E773 K802 V806	N765-T769 WeakPolarHBondContact O-CB 3.42Å; N765-T769 PolarHBondContact O-N 2.78Å; N765-T769 PolarHBondContact O-OG1 3.32Å; Q766-T769 PolarHBondContact O-N 2.86Å; T769-A771 PolarHBondContact O-N 2.84Å; T769-C772 PolarHBondContact O-N 2.85Å; T769-E773 PolarHBondContact O-N 2.96Å; T769-K802 WeakPolarHBondContact OG1-CE 3.22Å; T769-K802 PolarHBondContact OG1-NZ 2.89Å; T769-V806 HydrophobicContact CG2-CG1 4.29Å; T769-V806 HydrophobicContact CG2-CG2 4.42Å
770	K	84.7	Confident	82.6	Confident	70 Å²	70	42.4 Å²	42.4	30%	0.304	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-38.4	176.6	-161.9	72.9	-156	156	0	113	V733 Q766 L767 C772 E773 C774	V733-K770 HydrophobicContact CG1-CB 4.44Å; V733-K770 HydrophobicContact CG1-CG 4.24Å; Q766-K770 WeakPolarHBondContact O-CB 3.45Å; Q766-K770 PolarHBondContact O-N 2.8Å; L767-K770 PolarHBondContact O-N 2.81Å; K770-C772 VanDerWaalsContact C-N 3.34Å; K770-C772 PolarHBondContact O-N 3.5Å; K770-E773 IonicContact NZ-OE2 3.94Å; K770-E773 PolarHBondContact NZ-OE2 3.11Å; K770-E773 WeakPolarHBondContact O-CB 3.46Å; K770-E773 PolarHBondContact O-N 2.95Å; K770-C774 PolarHBondContact O-N 2.83Å
771	A	86.4	Confident	82.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-37.4	175.4	0	0	0	0	0	112.4	V733 F738 L767 L768 T769 E773 C774 G775 L780 L783	V733-A771 HydrophobicContact CG1-CB 4.17Å; F738-A771 HydrophobicContact CE1-CB 4.12Å; L767-A771 WeakPolarHBondContact O-CB 3.2Å; L767-A771 PolarHBondContact O-N 2.82Å; L768-A771 PolarHBondContact O-N 3.39Å; T769-A771 PolarHBondContact O-N 2.84Å; A771-E773 VanDerWaalsContact C-N 3.28Å; A771-E773 PolarHBondContact O-N 3.42Å; A771-C774 PolarHBondContact O-N 3.49Å; A771-G775 PolarHBondContact O-N 3.48Å; A771-L780 HydrophobicContact CB-CD1 3.6Å; A771-L783 HydrophobicContact CB-CD2 3.48Å; A771-L783 VanDerWaalsContact CB-CD2 3.48Å
772	C	83.7	Confident	83.4	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.034	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-28.4	174.5	-65.6	0	0	0	0	113.3	L768 T769 K770 V806 L807	L768-C772 PolarHBondContact O-N 3.09Å; L768-C772 PolarHBondContact O-SG 3.47Å; T769-C772 PolarHBondContact O-N 2.85Å; K770-C772 VanDerWaalsContact C-N 3.34Å; K770-C772 PolarHBondContact O-N 3.5Å; C772-V806 HydrophobicContact CB-CB 4.37Å; C772-V806 HydrophobicContact CB-CG1 3.67Å; C772-L807 HydrophobicContact CB-CD2 4.26Å
773	E	82	Confident	83.7	Confident	101 Å²	101	38 Å²	38	47%	0.472	19%	0.194	S	C	.	.	H	α-helix	trans	-77.1	-42.3	174.5	-66.6	169.8	-168.3	0	0	112.3	T769 K770 A771	T769-E773 PolarHBondContact O-N 2.96Å; K770-E773 IonicContact NZ-OE2 3.94Å; K770-E773 PolarHBondContact NZ-OE2 3.11Å; K770-E773 WeakPolarHBondContact O-CB 3.46Å; K770-E773 PolarHBondContact O-N 2.95Å; A771-E773 VanDerWaalsContact C-N 3.28Å; A771-E773 PolarHBondContact O-N 3.42Å
774	C	76.3	Confident	83.9	Confident	38 Å²	38	37.5 Å²	37.5	26%	0.257	19%	0.192	S	C	.	.	H	α-helix	trans	-99.7	-24.5	-165.9	-63.4	0	0	0	0	115.3	V733 F738 K770 A771	V733-C774 HydrophobicContact CG1-CB 4.45Å; F738-C774 HydrophobicContact CZ-CB 4.1Å; K770-C774 PolarHBondContact O-N 2.83Å; A771-C774 PolarHBondContact O-N 3.49Å
775	G	73.1	Confident	83.9	Confident	5 Å²	5	39.8 Å²	39.8	5%	0.052	20%	0.202	C	C	.	.			trans	-101	160.3	-168.4	0	0	0	0	0	115.3	A771	A771-G775 PolarHBondContact O-N 3.48Å
776	N	80.1	Confident	84	Confident	110 Å²	110	37.2 Å²	37.2	59%	0.588	19%	0.188	S	C	*	.			trans	-76.5	163.9	160.1	-69.9	-31	0	0	0	110.6	E778 E779 L780	N776-E778 VanDerWaalsContact C-N 3.33Å; N776-E778 PolarHBondContact O-N 3.05Å; N776-E779 HydrophobicContact CB-CG 4.38Å; N776-E779 WeakPolarHBondContact CB-OE2 3.42Å; N776-E779 PolarHBondContact N-OE2 2.77Å; N776-E779 PolarHBondContact O-N 3.37Å; N776-L780 WeakPolarHBondContact O-CB 3.39Å; N776-L780 PolarHBondContact O-N 3.47Å
777	V	81.1	Confident	84.1	Confident	24 Å²	24	34.2 Å²	34.2	15%	0.145	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-38.6	-176.3	172.8	0	0	0	0	112.3	L780 C781 K815 D818 F819 A822	V777-L780 PolarHBondContact O-N 3.43Å; V777-C781 WeakPolarHBondContact O-CB 3.46Å; V777-C781 PolarHBondContact O-N 3.16Å; V777-C781 PolarHBondContact O-SG 2.84Å; V777-K815 HydrophobicContact CG2-CB 4.48Å; V777-D818 HydrophobicContact CG1-CB 4.49Å; V777-D818 HydrophobicContact CG2-CB 3.93Å; V777-F819 HydrophobicContact CG1-CB 4.11Å; V777-F819 HydrophobicContact CG1-CD2 4.34Å; V777-F819 HydrophobicContact CG2-CB 4.43Å; V777-A822 HydrophobicContact CG1-CB 3.82Å
778	E	83.6	Confident	83.8	Confident	154 Å²	154	36.4 Å²	36.4	72%	0.72	19%	0.185	S	C	*	.	H	α-helix	trans	-63.2	-49.5	177	-64.1	-177.2	158.5	0	0	111.6	N776 L780 C781 D782	N776-E778 VanDerWaalsContact C-N 3.33Å; N776-E778 PolarHBondContact O-N 3.05Å; E778-L780 VanDerWaalsContact C-N 3.3Å; E778-L780 PolarHBondContact O-N 2.95Å; E778-C781 CarbonylContact O-C 3.59Å; E778-C781 WeakPolarHBondContact O-CA 3.5Å; E778-C781 WeakPolarHBondContact O-CB 2.85Å; E778-C781 PolarHBondContact O-N 3.25Å; E778-D782 PolarHBondContact O-N 3.05Å
779	E	86.5	Confident	83.5	Confident	57 Å²	57	41.7 Å²	41.7	27%	0.266	21%	0.21	S	C	.	.	H	α-helix	trans	-60.3	-38.5	177.2	-59.8	174.1	130.4	0	0	112.2	F738 N776 D782 L783	F738-E779 HydrophobicContact CB-CB 3.95Å; F738-E779 HydrophobicContact CB-CG 4.17Å; F738-E779 HydrophobicContact CD1-CB 3.87Å; F738-E779 HydrophobicContact CD2-CB 4.12Å; F738-E779 VanDerWaalsContact CD2-CD 3.49Å; F738-E779 HydrophobicContact CD2-CG 4.26Å; F738-E779 WeakPolarHBondContact CD2-OE1 3.41Å; F738-E779 HydrophobicContact CE1-CB 4.43Å; F738-E779 HydrophobicContact CG-CB 3.71Å; F738-E779 HydrophobicContact CG-CG 4.17Å; N776-E779 HydrophobicContact CB-CG 4.38Å; N776-E779 WeakPolarHBondContact CB-OE2 3.42Å; N776-E779 PolarHBondContact N-OE2 2.77Å; N776-E779 PolarHBondContact O-N 3.37Å; E779-D782 PolarHBondContact O-N 3.24Å; E779-L783 WeakPolarHBondContact O-CB 3.3Å; E779-L783 PolarHBondContact O-N 2.9Å
780	L	86.3	Confident	83.1	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-66.6	-39.7	174.5	-177.6	63.5	0	0	0	111.4	A771 N776 V777 E778 V784 C803 L807 F819	A771-L780 HydrophobicContact CB-CD1 3.6Å; N776-L780 WeakPolarHBondContact O-CB 3.39Å; N776-L780 PolarHBondContact O-N 3.47Å; V777-L780 PolarHBondContact O-N 3.43Å; E778-L780 VanDerWaalsContact C-N 3.3Å; E778-L780 PolarHBondContact O-N 2.95Å; L780-V784 WeakPolarHBondContact O-CB 3.4Å; L780-V784 VanDerWaalsContact O-CG2 3.26Å; L780-V784 WeakPolarHBondContact O-CG2 3.31Å; L780-V784 PolarHBondContact O-N 2.96Å; L780-C803 HydrophobicContact CD2-CB 4.34Å; L780-L807 HydrophobicContact CD2-CD1 4.31Å; L780-F819 HydrophobicContact CD2-CD2 3.72Å; L780-F819 HydrophobicContact CD2-CE2 3.74Å; L780-F819 HydrophobicContact CG-CD2 4.26Å; L780-F819 HydrophobicContact CG-CE2 3.94Å
781	C	85.3	Confident	82.6	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-68.3	-38.7	174.6	-73.2	0	0	0	0	112.5	V777 E778 V784 E785	V777-C781 WeakPolarHBondContact O-CB 3.46Å; V777-C781 PolarHBondContact O-N 3.16Å; V777-C781 PolarHBondContact O-SG 2.84Å; E778-C781 CarbonylContact O-C 3.59Å; E778-C781 WeakPolarHBondContact O-CA 3.5Å; E778-C781 WeakPolarHBondContact O-CB 2.85Å; E778-C781 PolarHBondContact O-N 3.25Å; C781-V784 PolarHBondContact O-N 3.1Å; C781-E785 VanDerWaalsContact O-CB 3.31Å; C781-E785 WeakPolarHBondContact O-CB 3Å; C781-E785 PolarHBondContact O-N 3.13Å
782	D	87.3	Confident	81.9	Confident	66 Å²	66	38.4 Å²	38.4	35%	0.353	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-44.1	173.8	-68.4	-17.2	0	0	0	111.1	V742 E778 E779 E785 A786 R826	V742-D782 HydrophobicContact CG2-CB 4.29Å; E778-D782 PolarHBondContact O-N 3.05Å; E779-D782 PolarHBondContact O-N 3.24Å; D782-E785 PolarHBondContact O-N 2.9Å; D782-A786 WeakPolarHBondContact O-CB 3.35Å; D782-A786 PolarHBondContact O-N 3.16Å; D782-R826 IonicContact OD1-CZ 3.39Å; D782-R826 IonicContact OD1-NH1 3.47Å; D782-R826 PolarHBondContact OD1-NH1 2.98Å; D782-R826 IonicContact OD1-NH2 2.73Å; D782-R826 PolarHBondContact OD1-NH2 2.95Å
783	L	88	Confident	81.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-42.5	177.2	-172.3	69	0	0	0	112.2	V733 V742 L745 L767 A771 E779 A786 L787	V733-L783 HydrophobicContact CG2-CD2 4.12Å; V742-L783 HydrophobicContact CG2-CD1 4.29Å; L745-L783 HydrophobicContact CD1-CD1 3.74Å; L767-L783 HydrophobicContact CD1-CD2 4.22Å; L767-L783 HydrophobicContact CD2-CD1 4.49Å; L767-L783 HydrophobicContact CG-CD2 4.18Å; A771-L783 HydrophobicContact CB-CD2 3.48Å; A771-L783 VanDerWaalsContact CB-CD2 3.48Å; E779-L783 WeakPolarHBondContact O-CB 3.3Å; E779-L783 PolarHBondContact O-N 2.9Å; L783-A786 PolarHBondContact O-N 3.31Å; L783-L787 HydrophobicContact CG-CD1 4.33Å; L783-L787 WeakPolarHBondContact O-CB 3.1Å; L783-L787 VanDerWaalsContact O-CG 3.29Å; L783-L787 WeakPolarHBondContact O-CG 3.29Å; L783-L787 PolarHBondContact O-N 2.84Å
784	V	86.5	Confident	79.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-41.3	176.1	168.4	0	0	0	0	111.3	L768 L780 C781 L787 L788 P799 L800 F827	L768-V784 HydrophobicContact CD2-CG2 3.73Å; L780-V784 WeakPolarHBondContact O-CB 3.4Å; L780-V784 VanDerWaalsContact O-CG2 3.26Å; L780-V784 WeakPolarHBondContact O-CG2 3.31Å; L780-V784 PolarHBondContact O-N 2.96Å; C781-V784 PolarHBondContact O-N 3.1Å; V784-L787 PolarHBondContact O-N 3.35Å; V784-L788 HydrophobicContact CG1-CD1 3.93Å; V784-L788 VanDerWaalsContact O-CG 3.27Å; V784-L788 WeakPolarHBondContact O-CG 3.45Å; V784-L788 PolarHBondContact O-N 2.93Å; V784-P799 HydrophobicContact CG1-CB 4Å; V784-P799 HydrophobicContact CG2-CB 4.4Å; V784-L800 HydrophobicContact CG1-CD2 3.79Å; V784-L800 HydrophobicContact CG1-CG 4.47Å; V784-F827 HydrophobicContact CB-CZ 4.29Å; V784-F827 HydrophobicContact CG1-CE1 4.46Å; V784-F827 HydrophobicContact CG1-CE2 4.18Å; V784-F827 HydrophobicContact CG1-CZ 3.85Å
785	E	85.1	Confident	78.9	Confident	53 Å²	53	40.1 Å²	40.1	25%	0.248	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-46.8	174.6	-173.1	171	-95.1	0	0	111	C781 D782 L787 L788 E789 R826 F827	C781-E785 VanDerWaalsContact O-CB 3.31Å; C781-E785 WeakPolarHBondContact O-CB 3Å; C781-E785 PolarHBondContact O-N 3.13Å; D782-E785 PolarHBondContact O-N 2.9Å; E785-L787 VanDerWaalsContact C-N 3.33Å; E785-L787 PolarHBondContact O-N 3.32Å; E785-L788 PolarHBondContact O-N 2.88Å; E785-L788 VanDerWaalsContact O-N 3.11Å; E785-E789 HydrophobicContact CG-CG 4.3Å; E785-E789 WeakPolarHBondContact O-CB 3.42Å; E785-E789 WeakPolarHBondContact O-CG 3.3Å; E785-E789 PolarHBondContact O-N 3.48Å; E785-R826 VanDerWaalsContact CD-NE 3.32Å; E785-R826 IonicContact OE1-CZ 3.14Å; E785-R826 IonicContact OE1-NE 2.69Å; E785-R826 PolarHBondContact OE1-NE 3.33Å; E785-R826 IonicContact OE1-NH2 3.59Å; E785-R826 IonicContact OE2-CZ 3.59Å; E785-R826 IonicContact OE2-NE 3.6Å; E785-R826 PolarHBondContact OE2-NE 2.97Å; E785-R826 IonicContact OE2-NH2 3.35Å; E785-R826 PolarHBondContact OE2-NH2 2.9Å; E785-F827 HydrophobicContact CB-CE1 4.03Å; E785-F827 HydrophobicContact CB-CZ 4.25Å; E785-F827 HydrophobicContact CG-CE1 4.46Å
786	A	85.3	Confident	78.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.5	-44.5	175.6	0	0	0	0	0	112.1	V742 K746 D782 L783 L788 E789 S790	V742-A786 HydrophobicContact CB-CB 4.45Å; V742-A786 HydrophobicContact CG1-CB 3.94Å; V742-A786 HydrophobicContact CG2-CB 4.17Å; K746-A786 HydrophobicContact CG-CB 4.48Å; D782-A786 WeakPolarHBondContact O-CB 3.35Å; D782-A786 PolarHBondContact O-N 3.16Å; L783-A786 PolarHBondContact O-N 3.31Å; A786-L788 VanDerWaalsContact C-N 3.35Å; A786-L788 PolarHBondContact O-N 3.23Å; A786-E789 PolarHBondContact O-N 3.07Å; A786-S790 VanDerWaalsContact O-CB 3.31Å; A786-S790 WeakPolarHBondContact O-CB 3Å; A786-S790 PolarHBondContact O-N 2.76Å; A786-S790 PolarHBondContact O-OG 3.27Å
787	L	85.5	Confident	77.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-34.3	176.9	-73.8	166	0	0	0	113.4	L745 V764 L767 L768 L783 V784 E785 G791 Y792	L745-L787 HydrophobicContact CD1-CD2 3.97Å; L745-L787 HydrophobicContact CD1-CG 4.2Å; L745-L787 HydrophobicContact CD2-CD2 4.5Å; V764-L787 HydrophobicContact CG1-CD1 4.22Å; V764-L787 HydrophobicContact CG1-CD2 4.33Å; V764-L787 HydrophobicContact CG2-CD2 4.42Å; L767-L787 HydrophobicContact CD2-CD1 4.29Å; L767-L787 HydrophobicContact CD2-CD2 4.21Å; L768-L787 HydrophobicContact CD2-CD1 3.64Å; L768-L787 HydrophobicContact CG-CD1 4.14Å; L783-L787 HydrophobicContact CG-CD1 4.33Å; L783-L787 WeakPolarHBondContact O-CB 3.1Å; L783-L787 VanDerWaalsContact O-CG 3.29Å; L783-L787 WeakPolarHBondContact O-CG 3.29Å; L783-L787 PolarHBondContact O-N 2.84Å; V784-L787 PolarHBondContact O-N 3.35Å; E785-L787 VanDerWaalsContact C-N 3.33Å; E785-L787 PolarHBondContact O-N 3.32Å; L787-G791 PolarHBondContact O-N 3.14Å; L787-Y792 HydrophobicContact CD2-CD2 3.92Å; L787-Y792 HydrophobicContact CD2-CG 4.12Å; L787-Y792 PolarHBondContact O-N 3.05Å
788	L	81.1	Confident	77.3	Confident	45 Å²	45	48 Å²	48	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-73.2	-43.9	175.6	-72.1	167.8	0	0	0	111.7	V784 E785 A786 N796 P799 F827	V784-L788 HydrophobicContact CG1-CD1 3.93Å; V784-L788 VanDerWaalsContact O-CG 3.27Å; V784-L788 WeakPolarHBondContact O-CG 3.45Å; V784-L788 PolarHBondContact O-N 2.93Å; E785-L788 PolarHBondContact O-N 2.88Å; E785-L788 VanDerWaalsContact O-N 3.11Å; A786-L788 VanDerWaalsContact C-N 3.35Å; A786-L788 PolarHBondContact O-N 3.23Å; L788-N796 HydrophobicContact CD2-CB 4.38Å; L788-P799 HydrophobicContact CD2-CG 4.43Å; L788-F827 HydrophobicContact CD1-CD1 4.15Å; L788-F827 HydrophobicContact CD1-CE1 3.96Å
789	E	81.3	Confident	77.1	Confident	113 Å²	113	40.8 Å²	40.8	53%	0.528	23%	0.228	S	C	.	.	H	α-helix	trans	-66.9	-43.6	177.9	-72	-176.4	151	0	0	112.5	K746 E785 A786 G791	K746-E789 VanDerWaalsContact CE-OE2 3.27Å; K746-E789 WeakPolarHBondContact CE-OE2 3.37Å; K746-E789 IonicContact NZ-OE2 2.69Å; K746-E789 PolarHBondContact NZ-OE2 3Å; E785-E789 HydrophobicContact CG-CG 4.3Å; E785-E789 WeakPolarHBondContact O-CB 3.42Å; E785-E789 WeakPolarHBondContact O-CG 3.3Å; E785-E789 PolarHBondContact O-N 3.48Å; A786-E789 PolarHBondContact O-N 3.07Å; E789-G791 VanDerWaalsContact C-N 3.29Å; E789-G791 PolarHBondContact O-N 2.62Å
790	S	76.8	Confident	76.8	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.028	22%	0.216	C	C	.	.	H	α-helix	trans	-78.1	-11.1	-179	55.1	0	0	0	0	113.8	R749 I755 A786 Y792	R749-S790 WeakPolarHBondContact CD-O 3.47Å; R749-S790 PolarHBondContact NE-O 3.33Å; R749-S790 VanDerWaalsContact NE-O 3.16Å; I755-S790 WeakPolarHBondContact CD1-O 3.39Å; A786-S790 VanDerWaalsContact O-CB 3.31Å; A786-S790 WeakPolarHBondContact O-CB 3Å; A786-S790 PolarHBondContact O-N 2.76Å; A786-S790 PolarHBondContact O-OG 3.27Å; S790-Y792 WeakPolarHBondContact OG-CD2 3.29Å; S790-Y792 VanDerWaalsContact OG-CE2 3.26Å; S790-Y792 WeakPolarHBondContact OG-CE2 3.44Å
791	G	72.8	Confident	76.4	Confident	23 Å²	23	40.7 Å²	40.7	24%	0.237	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	18.2	170.2	0	0	0	0	0	115.5	T757 L787 E789 S793	T757-G791 VanDerWaalsContact CG2-O 3.24Å; T757-G791 WeakPolarHBondContact CG2-O 3.21Å; L787-G791 PolarHBondContact O-N 3.14Å; E789-G791 VanDerWaalsContact C-N 3.29Å; E789-G791 PolarHBondContact O-N 2.62Å; G791-S793 PolarHBondContact O-N 2.87Å
792	Y	73	Confident	76.1	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.008	24%	0.243	C	C	.	.	S	Bend	trans	-69.1	-16.7	174.3	-68.3	-85.4	0	0	0	113.4	I726 L745 H748 I755 T757 I760 L787 S790	I726-Y792 HydrophobicContact CD1-CD1 3.8Å; I726-Y792 HydrophobicContact CD1-CE1 3.85Å; I726-Y792 HydrophobicContact CG1-CD1 4.49Å; I726-Y792 HydrophobicContact CG1-CE1 4.18Å; L745-Y792 HydrophobicContact CB-CE2 4.27Å; L745-Y792 HydrophobicContact CD2-CD2 4.29Å; L745-Y792 HydrophobicContact CD2-CE2 3.59Å; L745-Y792 HydrophobicContact CG-CE2 4.49Å; H748-Y792 AromaticContact ND1-CZ 3.99Å; H748-Y792 PolarHBondContact ND1-OH 2.79Å; I755-Y792 HydrophobicContact CD1-CD1 4.11Å; I755-Y792 HydrophobicContact CD1-CD2 4.37Å; I755-Y792 HydrophobicContact CD1-CE1 3.96Å; I755-Y792 HydrophobicContact CD1-CE2 4.22Å; I755-Y792 HydrophobicContact CD1-CG 4.31Å; I755-Y792 HydrophobicContact CG2-CD1 3.78Å; I755-Y792 HydrophobicContact CG2-CE1 4.22Å; I755-Y792 HydrophobicContact CG2-CG 4.46Å; T757-Y792 VanDerWaalsContact CG2-O 3.26Å; T757-Y792 WeakPolarHBondContact CG2-O 3.42Å; I760-Y792 HydrophobicContact CG2-CD1 4.11Å; L787-Y792 HydrophobicContact CD2-CD2 3.92Å; L787-Y792 HydrophobicContact CD2-CG 4.12Å; L787-Y792 PolarHBondContact O-N 3.05Å; S790-Y792 WeakPolarHBondContact OG-CD2 3.29Å; S790-Y792 VanDerWaalsContact OG-CE2 3.26Å; S790-Y792 WeakPolarHBondContact OG-CE2 3.44Å
793	S	65.9	Low	75.9	Confident	21 Å²	21	40.7 Å²	40.7	15%	0.147	23%	0.226	C	C	.	.			trans	-126.3	120.5	173	69.7	0	0	0	0	112.7	G791	G791-S793 PolarHBondContact O-N 2.87Å
794	V	55	Low	75.4	Confident	123 Å²	123	40.7 Å²	40.7	75%	0.745	23%	0.226	S	C	*	.	S	Bend	trans	-94.2	114.8	168.1	172.5	0	0	0	0	108.1	T757	T757-V794 HydrophobicContact CG2-CB 4.47Å; T757-V794 HydrophobicContact CG2-CG2 3.84Å
795	G	57.1	Low	74.9	Confident	35 Å²	35	47.8 Å²	47.8	36%	0.361	25%	0.253	S	S	.	.	S	Bend	trans	116.9	81.5	-173.8	0	0	0	0	0	111.8	N797 M798	G795-N797 PolarHBondContact O-N 2.81Å; G795-M798 PolarHBondContact O-N 3.21Å
796	N	57.9	Low	74.6	Confident	112 Å²	112	45.9 Å²	45.9	60%	0.599	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-8.3	-156.6	-52.4	21.5	0	0	0	117	L788	L788-N796 HydrophobicContact CD2-CB 4.38Å
797	N	68.1	Low	74.3	Confident	71 Å²	71	46 Å²	46	38%	0.38	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-12.8	-178.5	-62.6	-11.7	0	0	0	113.5	G795 L800 L801	G795-N797 PolarHBondContact O-N 2.81Å; N797-L800 PolarHBondContact O-N 3.09Å; N797-L801 HydrophobicContact CB-CD1 4.35Å; N797-L801 WeakPolarHBondContact O-CG 3.42Å; N797-L801 PolarHBondContact O-N 3.02Å
798	M	74.7	Confident	73.9	Confident	122 Å²	122	47.8 Å²	47.8	60%	0.601	26%	0.255	S	S	*	.	H	α-helix	trans	-63.5	-45.8	-173.1	-74.4	-62.2	-66.4	0	0	113.7	G795 L800 L801 K802	G795-M798 PolarHBondContact O-N 3.21Å; M798-L800 VanDerWaalsContact C-N 3.33Å; M798-L800 PolarHBondContact O-N 3.49Å; M798-L801 PolarHBondContact O-N 2.93Å; M798-K802 WeakPolarHBondContact O-CB 3.4Å; M798-K802 PolarHBondContact O-N 2.71Å
799	P	79.4	Confident	73.8	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-57.5	-43.5	174.1	-27.5	37	0	0	0	113	L768 V784 L788 K802 C803	L768-P799 HydrophobicContact CD1-CB 3.77Å; L768-P799 HydrophobicContact CD1-CG 4.43Å; V784-P799 HydrophobicContact CG1-CB 4Å; V784-P799 HydrophobicContact CG2-CB 4.4Å; L788-P799 HydrophobicContact CD2-CG 4.43Å; P799-K802 PolarHBondContact O-N 2.8Å; P799-C803 PolarHBondContact O-N 3.5Å; P799-C803 PolarHBondContact O-SG 2.86Å
800	L	81.2	Confident	73.6	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-46.4	-179.3	-60	174.9	0	0	0	112	V784 N797 M798 K802 C803 A804 F819 F827 P831	V784-L800 HydrophobicContact CG1-CD2 3.79Å; V784-L800 HydrophobicContact CG1-CG 4.47Å; N797-L800 PolarHBondContact O-N 3.09Å; M798-L800 VanDerWaalsContact C-N 3.33Å; M798-L800 PolarHBondContact O-N 3.49Å; L800-K802 VanDerWaalsContact C-N 3.33Å; L800-K802 PolarHBondContact O-N 2.75Å; L800-C803 PolarHBondContact O-N 3.45Å; L800-A804 VanDerWaalsContact O-CB 3.23Å; L800-A804 WeakPolarHBondContact O-CB 3.4Å; L800-A804 PolarHBondContact O-N 2.7Å; L800-F819 HydrophobicContact CD2-CZ 3.99Å; L800-F827 HydrophobicContact CD1-CB 4.08Å; L800-F827 HydrophobicContact CD1-CD2 4.02Å; L800-F827 HydrophobicContact CD1-CG 4.14Å; L800-F827 HydrophobicContact CD2-CD2 3.42Å; L800-F827 VanDerWaalsContact CD2-CD2 3.42Å; L800-F827 HydrophobicContact CD2-CE2 3.54Å; L800-F827 HydrophobicContact CD2-CG 4.25Å; L800-F827 HydrophobicContact CD2-CZ 4.41Å; L800-F827 HydrophobicContact CG-CD2 4.35Å; L800-P831 HydrophobicContact CB-CB 4.48Å; L800-P831 HydrophobicContact CB-CG 4.41Å
801	L	77	Confident	73.4	Confident	58 Å²	58	51 Å²	51	30%	0.304	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-33.6	177.6	-69.7	170.8	0	0	0	112.5	N797 M798 R805 P831	N797-L801 HydrophobicContact CB-CD1 4.35Å; N797-L801 WeakPolarHBondContact O-CG 3.42Å; N797-L801 PolarHBondContact O-N 3.02Å; M798-L801 PolarHBondContact O-N 2.93Å; L801-R805 WeakPolarHBondContact O-CB 3.36Å; L801-R805 WeakPolarHBondContact O-CG 3.3Å; L801-R805 PolarHBondContact O-N 3.5Å; L801-P831 HydrophobicContact CD2-CB 3.95Å
802	K	79.9	Confident	73.5	Confident	68 Å²	68	52.7 Å²	52.7	30%	0.296	30%	0.303	S	S	.	.	H	α-helix	trans	-68.5	-50	175.2	176	61.7	177.1	169.2	0	111.2	N765 T769 M798 P799 L800 A804 R805 V806	N765-K802 WeakPolarHBondContact OD1-CG 3.4Å; T769-K802 WeakPolarHBondContact OG1-CE 3.22Å; T769-K802 PolarHBondContact OG1-NZ 2.89Å; M798-K802 WeakPolarHBondContact O-CB 3.4Å; M798-K802 PolarHBondContact O-N 2.71Å; P799-K802 PolarHBondContact O-N 2.8Å; L800-K802 VanDerWaalsContact C-N 3.33Å; L800-K802 PolarHBondContact O-N 2.75Å; K802-A804 VanDerWaalsContact C-N 3.35Å; K802-A804 PolarHBondContact O-N 3.45Å; K802-R805 PolarHBondContact O-N 3.22Å; K802-V806 HydrophobicContact CD-CG2 4.1Å; K802-V806 WeakPolarHBondContact O-CG2 3.33Å; K802-V806 PolarHBondContact O-N 2.69Å
803	C	81.6	Confident	73.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-47.9	178.6	-63.4	0	0	0	0	111.1	L780 P799 L800 R805 V806 L807 F819	L780-C803 HydrophobicContact CD2-CB 4.34Å; P799-C803 PolarHBondContact O-N 3.5Å; P799-C803 PolarHBondContact O-SG 2.86Å; L800-C803 PolarHBondContact O-N 3.45Å; C803-R805 PolarHBondContact O-N 2.56Å; C803-V806 PolarHBondContact O-N 2.85Å; C803-L807 WeakPolarHBondContact O-CG 3.38Å; C803-L807 PolarHBondContact O-N 3.37Å; C803-F819 HydrophobicContact CB-CD1 4.49Å; C803-F819 HydrophobicContact CB-CE1 3.65Å; C803-F819 HydrophobicContact CB-CE2 4.15Å; C803-F819 HydrophobicContact CB-CZ 3.45Å; C803-F819 VanDerWaalsContact CB-CZ 3.45Å
804	A	77.5	Confident	74.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-52.6	-50.3	175.5	0	0	0	0	0	114	L800 K802 V806 L807 L808 F832	L800-A804 VanDerWaalsContact O-CB 3.23Å; L800-A804 WeakPolarHBondContact O-CB 3.4Å; L800-A804 PolarHBondContact O-N 2.7Å; K802-A804 VanDerWaalsContact C-N 3.35Å; K802-A804 PolarHBondContact O-N 3.45Å; A804-V806 VanDerWaalsContact C-N 3.35Å; A804-V806 PolarHBondContact O-N 3.37Å; A804-L807 PolarHBondContact O-N 3.27Å; A804-L808 WeakPolarHBondContact O-CB 3.41Å; A804-L808 WeakPolarHBondContact O-CG 3.45Å; A804-L808 PolarHBondContact O-N 3.17Å; A804-F832 HydrophobicContact CB-CB 4.17Å; A804-F832 HydrophobicContact CB-CD1 3.07Å; A804-F832 HydrophobicContact CB-CD2 4.03Å; A804-F832 HydrophobicContact CB-CE1 3.25Å; A804-F832 HydrophobicContact CB-CE2 4.12Å; A804-F832 HydrophobicContact CB-CG 3.52Å; A804-F832 HydrophobicContact CB-CZ 3.77Å
805	R	76	Confident	75.7	Confident	148 Å²	148	56.6 Å²	56.6	56%	0.558	31%	0.309	S	S	*	.	H	α-helix	trans	-67.4	-34.6	-179.6	-75.9	175.7	171.2	178.8	-3.8	112.5	L801 K802 C803 A809 E835	L801-R805 WeakPolarHBondContact O-CB 3.36Å; L801-R805 WeakPolarHBondContact O-CG 3.3Å; L801-R805 PolarHBondContact O-N 3.5Å; K802-R805 PolarHBondContact O-N 3.22Å; C803-R805 PolarHBondContact O-N 2.56Å; R805-A809 WeakPolarHBondContact O-CB 3.25Å; R805-A809 PolarHBondContact O-N 3.16Å; R805-E835 IonicContact NE-OE2 3.05Å; R805-E835 IonicContact NH2-OE1 2.7Å
806	V	79.9	Confident	76.9	Confident	13 Å²	13	54.9 Å²	54.9	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-68.8	-45.5	174.3	173.1	0	0	0	0	110.7	T769 C772 K802 C803 A804 L808 A809 N810	T769-V806 HydrophobicContact CG2-CG1 4.29Å; T769-V806 HydrophobicContact CG2-CG2 4.42Å; C772-V806 HydrophobicContact CB-CB 4.37Å; C772-V806 HydrophobicContact CB-CG1 3.67Å; K802-V806 HydrophobicContact CD-CG2 4.1Å; K802-V806 WeakPolarHBondContact O-CG2 3.33Å; K802-V806 PolarHBondContact O-N 2.69Å; C803-V806 PolarHBondContact O-N 2.85Å; A804-V806 VanDerWaalsContact C-N 3.35Å; A804-V806 PolarHBondContact O-N 3.37Å; V806-L808 PolarHBondContact O-N 2.54Å; V806-A809 PolarHBondContact O-N 2.88Å; V806-N810 WeakPolarHBondContact O-CB 3.47Å; V806-N810 PolarHBondContact O-N 2.92Å; V806-N810 PolarHBondContact O-OD1 3.48Å
807	L	79.6	Confident	77.9	Confident	4 Å²	4	50 Å²	50	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-42.1	176.6	-69.1	171.4	0	0	0	112.3	C772 L780 C803 A804 N810 G811 D812 K815 A816 F819	C772-L807 HydrophobicContact CB-CD2 4.26Å; L780-L807 HydrophobicContact CD2-CD1 4.31Å; C803-L807 WeakPolarHBondContact O-CG 3.38Å; C803-L807 PolarHBondContact O-N 3.37Å; A804-L807 PolarHBondContact O-N 3.27Å; L807-N810 PolarHBondContact O-N 2.94Å; L807-G811 PolarHBondContact O-N 3.39Å; L807-D812 PolarHBondContact O-N 2.99Å; L807-K815 HydrophobicContact CD2-CB 4.02Å; L807-K815 HydrophobicContact CD2-CD 4.38Å; L807-A816 HydrophobicContact CB-CB 4.13Å; L807-F819 HydrophobicContact CD1-CB 3.65Å; L807-F819 HydrophobicContact CD1-CD1 3.95Å; L807-F819 HydrophobicContact CD1-CD2 4.43Å; L807-F819 HydrophobicContact CD1-CG 3.75Å
808	L	77.2	Confident	78.6	Confident	36 Å²	36	48.7 Å²	48.7	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-64.8	-42.9	173.4	-76.6	175.7	0	0	0	112.7	A804 V806 N810 G811 L813 A816 F832 E835 L836 A839	A804-L808 WeakPolarHBondContact O-CB 3.41Å; A804-L808 WeakPolarHBondContact O-CG 3.45Å; A804-L808 PolarHBondContact O-N 3.17Å; V806-L808 PolarHBondContact O-N 2.54Å; L808-N810 VanDerWaalsContact C-N 3.31Å; L808-N810 PolarHBondContact O-N 3.49Å; L808-G811 PolarHBondContact O-N 3.13Å; L808-G811 VanDerWaalsContact O-N 3.16Å; L808-L813 HydrophobicContact CD2-CD2 4.27Å; L808-A816 HydrophobicContact CD2-CB 4.19Å; L808-F832 HydrophobicContact CD1-CD2 3.83Å; L808-F832 HydrophobicContact CD1-CE2 4.29Å; L808-F832 HydrophobicContact CG-CE2 4.49Å; L808-E835 HydrophobicContact CD1-CB 4.02Å; L808-L836 HydrophobicContact CD2-CD1 3.77Å; L808-A839 HydrophobicContact CD2-CB 4.2Å
809	A	77.7	Confident	79	Confident	85 Å²	85	42.9 Å²	42.9	70%	0.702	23%	0.23	S	C	*	.	H	α-helix	trans	-67.1	-31.3	178	0	0	0	0	0	112.8	R805 V806 G811	R805-A809 WeakPolarHBondContact O-CB 3.25Å; R805-A809 PolarHBondContact O-N 3.16Å; V806-A809 PolarHBondContact O-N 2.88Å; A809-G811 PolarHBondContact O-N 2.87Å
810	N	76.5	Confident	79.1	Confident	93 Å²	93	42.7 Å²	42.7	50%	0.497	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.7	174.8	-69	-2.5	0	0	0	113.1	V806 L807 L808 D812	V806-N810 WeakPolarHBondContact O-CB 3.47Å; V806-N810 PolarHBondContact O-N 2.92Å; V806-N810 PolarHBondContact O-OD1 3.48Å; L807-N810 PolarHBondContact O-N 2.94Å; L808-N810 VanDerWaalsContact C-N 3.31Å; L808-N810 PolarHBondContact O-N 3.49Å; N810-D812 PolarHBondContact O-N 2.86Å
811	G	72.9	Confident	79	Confident	53 Å²	53	44 Å²	44	55%	0.546	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	0.6	178.7	0	0	0	0	0	115.5	L807 L808 A809 L813	L807-G811 PolarHBondContact O-N 3.39Å; L808-G811 PolarHBondContact O-N 3.13Å; L808-G811 VanDerWaalsContact O-N 3.16Å; A809-G811 PolarHBondContact O-N 2.87Å; G811-L813 VanDerWaalsContact C-N 3.28Å; G811-L813 PolarHBondContact O-N 2.88Å
812	D	76	Confident	79.2	Confident	57 Å²	57	42.6 Å²	42.6	31%	0.305	23%	0.233	S	C	.	.			trans	-81.6	75.2	179.6	-164.3	-25.8	0	0	0	110.8	L807 N810 K814 K815 A816	L807-D812 PolarHBondContact O-N 2.99Å; N810-D812 PolarHBondContact O-N 2.86Å; D812-K814 PolarHBondContact O-N 3.49Å; D812-K814 PolarHBondContact OD1-N 3.24Å; D812-K815 HydrophobicContact CB-CB 4.23Å; D812-K815 PolarHBondContact O-N 3.5Å; D812-K815 PolarHBondContact OD1-N 2.88Å; D812-K815 WeakPolarHBondContact OD2-CD 3.14Å; D812-K815 WeakPolarHBondContact OD2-CE 3.47Å; D812-K815 VanDerWaalsContact OD2-CG 3.25Å; D812-K815 WeakPolarHBondContact OD2-CG 3.33Å; D812-A816 WeakPolarHBondContact O-CB 3.42Å; D812-A816 PolarHBondContact O-N 3.5Å
813	L	78.8	Confident	79.2	Confident	34 Å²	34	39.3 Å²	39.3	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-57.5	-29.8	-179.5	-66.8	173.7	0	0	0	112.7	L808 G811 V817 A839 L840 A843 L848	L808-L813 HydrophobicContact CD2-CD2 4.27Å; G811-L813 VanDerWaalsContact C-N 3.28Å; G811-L813 PolarHBondContact O-N 2.88Å; L813-V817 WeakPolarHBondContact O-CG2 3.38Å; L813-V817 PolarHBondContact O-N 2.93Å; L813-A839 HydrophobicContact CD2-CB 3.86Å; L813-L840 HydrophobicContact CB-CD2 4.42Å; L813-L840 HydrophobicContact CD1-CD2 4.43Å; L813-A843 HydrophobicContact CD1-CB 3.53Å; L813-L848 HydrophobicContact CB-CD1 4.41Å
814	K	80	Confident	78.9	Confident	133 Å²	133	39.6 Å²	39.6	58%	0.578	22%	0.22	S	C	*	.	H	α-helix	trans	-70.1	-53.9	177.8	-173.3	-176.9	173.9	-174.1	0	110.3	D812 A816 V817 D818	D812-K814 PolarHBondContact O-N 3.49Å; D812-K814 PolarHBondContact OD1-N 3.24Å; K814-A816 PolarHBondContact O-N 2.91Å; K814-V817 PolarHBondContact O-N 3.18Å; K814-V817 VanDerWaalsContact O-N 3.09Å; K814-D818 WeakPolarHBondContact CE-OD2 3.47Å; K814-D818 PolarHBondContact O-N 3.23Å
815	K	80.7	Confident	79	Confident	61 Å²	61	44.3 Å²	44.3	27%	0.265	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-33.3	175	-72.2	-172.9	-167.9	-173.2	0	112.3	V777 L807 D812 F819	V777-K815 HydrophobicContact CG2-CB 4.48Å; L807-K815 HydrophobicContact CD2-CB 4.02Å; L807-K815 HydrophobicContact CD2-CD 4.38Å; D812-K815 HydrophobicContact CB-CB 4.23Å; D812-K815 PolarHBondContact O-N 3.5Å; D812-K815 PolarHBondContact OD1-N 2.88Å; D812-K815 WeakPolarHBondContact OD2-CD 3.14Å; D812-K815 WeakPolarHBondContact OD2-CE 3.47Å; D812-K815 VanDerWaalsContact OD2-CG 3.25Å; D812-K815 WeakPolarHBondContact OD2-CG 3.33Å; K815-F819 WeakPolarHBondContact O-CB 3.23Å; K815-F819 PolarHBondContact O-N 3.33Å
816	A	82.2	Confident	79	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.9	-39.9	175.7	0	0	0	0	0	112.9	L807 L808 D812 K814 F820 L836	L807-A816 HydrophobicContact CB-CB 4.13Å; L808-A816 HydrophobicContact CD2-CB 4.19Å; D812-A816 WeakPolarHBondContact O-CB 3.42Å; D812-A816 PolarHBondContact O-N 3.5Å; K814-A816 PolarHBondContact O-N 2.91Å; A816-F820 WeakPolarHBondContact O-CB 3.25Å; A816-F820 PolarHBondContact O-N 3.06Å; A816-L836 HydrophobicContact CB-CD1 3.98Å
817	V	79.2	Confident	78.7	Confident	9 Å²	9	42.8 Å²	42.8	6%	0.055	24%	0.243	C	C	.	.	H	α-helix	trans	-70.5	-46.7	173.8	172.6	0	0	0	0	111.2	L813 K814 F819 F820 D821 L836 L840 L848	L813-V817 WeakPolarHBondContact O-CG2 3.38Å; L813-V817 PolarHBondContact O-N 2.93Å; K814-V817 PolarHBondContact O-N 3.18Å; K814-V817 VanDerWaalsContact O-N 3.09Å; V817-F819 VanDerWaalsContact C-N 3.3Å; V817-F819 PolarHBondContact O-N 3.44Å; V817-F820 WeakPolarHBondContact O-CB 3.45Å; V817-F820 PolarHBondContact O-N 3.33Å; V817-F820 VanDerWaalsContact O-N 3.07Å; V817-D821 PolarHBondContact O-N 2.84Å; V817-L836 HydrophobicContact CG2-CD1 4.12Å; V817-L836 HydrophobicContact CG2-CD2 4.01Å; V817-L836 HydrophobicContact CG2-CG 4.38Å; V817-L840 HydrophobicContact CG2-CD1 4.2Å; V817-L848 HydrophobicContact CG1-CD2 4.47Å; V817-L848 HydrophobicContact CG2-CB 4.34Å; V817-L848 HydrophobicContact CG2-CD1 4.17Å
818	D	82.3	Confident	78.2	Confident	43 Å²	43	53.1 Å²	53.1	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-40.7	178.9	-66.6	-20.1	0	0	0	110.8	V777 K814 D821 A822	V777-D818 HydrophobicContact CG1-CB 4.49Å; V777-D818 HydrophobicContact CG2-CB 3.93Å; K814-D818 WeakPolarHBondContact CE-OD2 3.47Å; K814-D818 PolarHBondContact O-N 3.23Å; D818-D821 PolarHBondContact O-N 2.92Å; D818-A822 WeakPolarHBondContact O-CB 3.38Å; D818-A822 PolarHBondContact O-N 2.81Å
819	F	83.2	Confident	77.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.6	-32.6	173.8	-178.4	-100.5	0	0	0	113.3	V777 L780 L800 C803 L807 K815 V817 S823 F832	V777-F819 HydrophobicContact CG1-CB 4.11Å; V777-F819 HydrophobicContact CG1-CD2 4.34Å; V777-F819 HydrophobicContact CG2-CB 4.43Å; L780-F819 HydrophobicContact CD2-CD2 3.72Å; L780-F819 HydrophobicContact CD2-CE2 3.74Å; L780-F819 HydrophobicContact CG-CD2 4.26Å; L780-F819 HydrophobicContact CG-CE2 3.94Å; L800-F819 HydrophobicContact CD2-CZ 3.99Å; C803-F819 HydrophobicContact CB-CD1 4.49Å; C803-F819 HydrophobicContact CB-CE1 3.65Å; C803-F819 HydrophobicContact CB-CE2 4.15Å; C803-F819 HydrophobicContact CB-CZ 3.45Å; C803-F819 VanDerWaalsContact CB-CZ 3.45Å; L807-F819 HydrophobicContact CD1-CB 3.65Å; L807-F819 HydrophobicContact CD1-CD1 3.95Å; L807-F819 HydrophobicContact CD1-CD2 4.43Å; L807-F819 HydrophobicContact CD1-CG 3.75Å; K815-F819 WeakPolarHBondContact O-CB 3.23Å; K815-F819 PolarHBondContact O-N 3.33Å; V817-F819 VanDerWaalsContact C-N 3.3Å; V817-F819 PolarHBondContact O-N 3.44Å; F819-S823 WeakPolarHBondContact O-CB 3.28Å; F819-S823 PolarHBondContact O-N 3.13Å; F819-S823 PolarHBondContact O-OG 3.2Å; F819-F832 HydrophobicContact CD1-CE1 4.4Å
820	F	81.1	Confident	77.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-45.7	172.6	178.3	-87.1	0	0	0	111.1	A816 V817 S823 C824 L830 P831 F832 A833 L836 L862 L865 I866	A816-F820 WeakPolarHBondContact O-CB 3.25Å; A816-F820 PolarHBondContact O-N 3.06Å; V817-F820 WeakPolarHBondContact O-CB 3.45Å; V817-F820 PolarHBondContact O-N 3.33Å; V817-F820 VanDerWaalsContact O-N 3.07Å; F820-S823 PolarHBondContact O-N 3.12Å; F820-C824 VanDerWaalsContact CE1-SG 3.54Å; F820-C824 PolarHBondContact O-N 3.38Å; F820-C824 PolarHBondContact O-SG 3.09Å; F820-L830 HydrophobicContact CE1-CD2 4.25Å; F820-L830 HydrophobicContact CZ-CB 4.42Å; F820-L830 HydrophobicContact CZ-CD2 3.7Å; F820-P831 WeakPolarHBondContact CD2-O 3.2Å; F820-P831 WeakPolarHBondContact CE2-O 3.09Å; F820-F832 HydrophobicContact CB-CE1 4.22Å; F820-F832 HydrophobicContact CB-CZ 3.76Å; F820-F832 HydrophobicContact CD2-CD1 4.37Å; F820-F832 AromaticContact CD2-CE1 3.93Å; F820-F832 HydrophobicContact CD2-CE1 3.93Å; F820-F832 HydrophobicContact CD2-CE2 4.42Å; F820-F832 AromaticContact CD2-CZ 3.98Å; F820-F832 HydrophobicContact CD2-CZ 3.98Å; F820-F832 HydrophobicContact CG-CZ 4.38Å; F820-A833 HydrophobicContact CE2-CB 3.79Å; F820-A833 HydrophobicContact CZ-CB 4.04Å; F820-L836 HydrophobicContact CB-CD2 4.03Å; F820-L836 HydrophobicContact CD2-CD2 4.25Å; F820-L836 HydrophobicContact CG-CD2 4.13Å; F820-L862 HydrophobicContact CD1-CD1 3.4Å; F820-L862 HydrophobicContact CD2-CD1 4.39Å; F820-L862 HydrophobicContact CE1-CD1 3.31Å; F820-L862 HydrophobicContact CE2-CD1 4.32Å; F820-L862 HydrophobicContact CG-CD1 3.96Å; F820-L862 HydrophobicContact CZ-CD1 3.79Å; F820-L865 HydrophobicContact CE1-CB 4.39Å; F820-I866 HydrophobicContact CE1-CG1 4.4Å; F820-I866 HydrophobicContact CZ-CG1 4.06Å
821	D	80.8	Confident	76.8	Confident	28 Å²	28	51.7 Å²	51.7	15%	0.15	25%	0.253	C	S	.	.	H	α-helix	trans	-65	-51.5	178.6	-169.6	14.5	0	0	0	111.2	V817 D818 S823 C824 V825 L865	V817-D821 PolarHBondContact O-N 2.84Å; D818-D821 PolarHBondContact O-N 2.92Å; D821-S823 PolarHBondContact O-N 2.89Å; D821-S823 VanDerWaalsContact O-N 3.17Å; D821-C824 WeakPolarHBondContact O-CA 3.48Å; D821-C824 WeakPolarHBondContact O-CB 3.05Å; D821-C824 PolarHBondContact O-N 2.93Å; D821-V825 PolarHBondContact O-N 3.25Å; D821-L865 HydrophobicContact CB-CD1 3.86Å; D821-L865 VanDerWaalsContact OD1-CD2 3.3Å; D821-L865 WeakPolarHBondContact OD1-CD2 3.24Å
822	A	80.9	Confident	76.8	Confident	29 Å²	29	49.8 Å²	49.8	24%	0.24	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-37.6	173.8	0	0	0	0	0	112.2	V777 D818 V825 R826	V777-A822 HydrophobicContact CG1-CB 3.82Å; D818-A822 WeakPolarHBondContact O-CB 3.38Å; D818-A822 PolarHBondContact O-N 2.81Å; A822-V825 PolarHBondContact O-N 2.64Å; A822-R826 WeakPolarHBondContact O-CB 3.45Å; A822-R826 PolarHBondContact O-N 2.77Å
823	S	79.3	Confident	76.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-36.1	174.5	-65.2	0	0	0	0	113.7	F819 F820 D821 F827 R828	F819-S823 WeakPolarHBondContact O-CB 3.28Å; F819-S823 PolarHBondContact O-N 3.13Å; F819-S823 PolarHBondContact O-OG 3.2Å; F820-S823 PolarHBondContact O-N 3.12Å; D821-S823 PolarHBondContact O-N 2.89Å; D821-S823 VanDerWaalsContact O-N 3.17Å; S823-F827 PolarHBondContact O-N 3.38Å; S823-F827 VanDerWaalsContact O-N 3.13Å; S823-R828 PolarHBondContact O-N 3.42Å
824	C	75.2	Confident	76.6	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.034	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-39.9	175.2	-71.9	0	0	0	0	111.8	F820 D821 R828 R829	F820-C824 VanDerWaalsContact CE1-SG 3.54Å; F820-C824 PolarHBondContact O-N 3.38Å; F820-C824 PolarHBondContact O-SG 3.09Å; D821-C824 WeakPolarHBondContact O-CA 3.48Å; D821-C824 WeakPolarHBondContact O-CB 3.05Å; D821-C824 PolarHBondContact O-N 2.93Å; C824-R828 WeakPolarHBondContact O-CA 3.45Å; C824-R828 PolarHBondContact O-N 3.16Å; C824-R829 WeakPolarHBondContact CA-O 3.25Å; C824-R829 PolarHBondContact SG-O 3.16Å; C824-R829 VanDerWaalsContact SG-O 3.37Å
825	V	78.6	Confident	76.5	Confident	100 Å²	100	46.5 Å²	46.5	61%	0.606	22%	0.222	S	C	*	.	H	α-helix	trans	-75.2	-54.7	179.3	177.3	0	0	0	0	111.4	D821 A822	D821-V825 PolarHBondContact O-N 3.25Å; A822-V825 PolarHBondContact O-N 2.64Å
826	R	77.9	Confident	76.5	Confident	91 Å²	91	43.6 Å²	43.6	34%	0.343	21%	0.21	S	C	.	.	H	α-helix	trans	-76.1	-48.2	-170.8	-161.7	174.1	-170	154.1	-2.7	112.8	D782 E785 A822	D782-R826 IonicContact OD1-CZ 3.39Å; D782-R826 IonicContact OD1-NH1 3.47Å; D782-R826 PolarHBondContact OD1-NH1 2.98Å; D782-R826 IonicContact OD1-NH2 2.73Å; D782-R826 PolarHBondContact OD1-NH2 2.95Å; E785-R826 VanDerWaalsContact CD-NE 3.32Å; E785-R826 IonicContact OE1-CZ 3.14Å; E785-R826 IonicContact OE1-NE 2.69Å; E785-R826 PolarHBondContact OE1-NE 3.33Å; E785-R826 IonicContact OE1-NH2 3.59Å; E785-R826 IonicContact OE2-CZ 3.59Å; E785-R826 IonicContact OE2-NE 3.6Å; E785-R826 PolarHBondContact OE2-NE 2.97Å; E785-R826 IonicContact OE2-NH2 3.35Å; E785-R826 PolarHBondContact OE2-NH2 2.9Å; A822-R826 WeakPolarHBondContact O-CB 3.45Å; A822-R826 PolarHBondContact O-N 2.77Å
827	F	72.9	Confident	76.4	Confident	38 Å²	38	43.6 Å²	43.6	17%	0.167	21%	0.21	C	C	.	.	S	Bend	trans	-98.4	-6.7	-174.9	-51.7	-63.7	0	0	0	114.1	V784 E785 L788 L800 S823 R829	V784-F827 HydrophobicContact CB-CZ 4.29Å; V784-F827 HydrophobicContact CG1-CE1 4.46Å; V784-F827 HydrophobicContact CG1-CE2 4.18Å; V784-F827 HydrophobicContact CG1-CZ 3.85Å; E785-F827 HydrophobicContact CB-CE1 4.03Å; E785-F827 HydrophobicContact CB-CZ 4.25Å; E785-F827 HydrophobicContact CG-CE1 4.46Å; L788-F827 HydrophobicContact CD1-CD1 4.15Å; L788-F827 HydrophobicContact CD1-CE1 3.96Å; L800-F827 HydrophobicContact CD1-CB 4.08Å; L800-F827 HydrophobicContact CD1-CD2 4.02Å; L800-F827 HydrophobicContact CD1-CG 4.14Å; L800-F827 HydrophobicContact CD2-CD2 3.42Å; L800-F827 VanDerWaalsContact CD2-CD2 3.42Å; L800-F827 HydrophobicContact CD2-CE2 3.54Å; L800-F827 HydrophobicContact CD2-CG 4.25Å; L800-F827 HydrophobicContact CD2-CZ 4.41Å; L800-F827 HydrophobicContact CG-CD2 4.35Å; S823-F827 PolarHBondContact O-N 3.38Å; S823-F827 VanDerWaalsContact O-N 3.13Å; F827-R829 VanDerWaalsContact C-N 3.27Å; F827-R829 PolarHBondContact O-N 3.05Å
828	R	69.9	Low	76.5	Confident	221 Å²	221	44.5 Å²	44.5	83%	0.834	22%	0.215	S	C	*	.			trans	54.9	38.9	-176	-56	-177.1	-178.3	-178.9	0.6	113.1	S823 C824	S823-R828 PolarHBondContact O-N 3.42Å; C824-R828 WeakPolarHBondContact O-CA 3.45Å; C824-R828 PolarHBondContact O-N 3.16Å
829	R	66.7	Low	76.5	Confident	132 Å²	132	43.5 Å²	43.5	50%	0.498	21%	0.213	S	C	.	.			trans	-127.6	151.1	178.7	-62	-58.8	-176.8	175	0.5	111	C824 F827 P831	C824-R829 WeakPolarHBondContact CA-O 3.25Å; C824-R829 PolarHBondContact SG-O 3.16Å; C824-R829 VanDerWaalsContact SG-O 3.37Å; F827-R829 VanDerWaalsContact C-N 3.27Å; F827-R829 PolarHBondContact O-N 3.05Å; R829-P831 WeakPolarHBondContact O-CD 3.3Å
830	L	67.6	Low	76.3	Confident	38 Å²	38	43.6 Å²	43.6	20%	0.199	21%	0.214	C	C	.	.			trans	-112.9	72.9	172.9	-62.2	131	0	0	0	109.9	F820 K869 R870	F820-L830 HydrophobicContact CE1-CD2 4.25Å; F820-L830 HydrophobicContact CZ-CB 4.42Å; F820-L830 HydrophobicContact CZ-CD2 3.7Å; L830-K869 HydrophobicContact CD1-CB 3.75Å; L830-K869 HydrophobicContact CD2-CB 3.9Å; L830-K869 HydrophobicContact CD2-CG 4.12Å; L830-K869 HydrophobicContact CG-CB 4.24Å; L830-R870 HydrophobicContact CD1-CG 3.74Å
831	P	65.8	Low	76.3	Confident	14 Å²	14	44.1 Å²	44.1	9%	0.091	22%	0.217	C	C	.	.			trans	-68.6	153.8	175.8	34.3	-36.6	0	0	0	109.7	L800 L801 F820 R829 A833	L800-P831 HydrophobicContact CB-CB 4.48Å; L800-P831 HydrophobicContact CB-CG 4.41Å; L801-P831 HydrophobicContact CD2-CB 3.95Å; F820-P831 WeakPolarHBondContact CD2-O 3.2Å; F820-P831 WeakPolarHBondContact CE2-O 3.09Å; R829-P831 WeakPolarHBondContact O-CD 3.3Å; P831-A833 PolarHBondContact O-N 3.05Å
832	F	72.7	Confident	76.4	Confident	13 Å²	13	48.9 Å²	48.9	6%	0.057	24%	0.238	C	C	.	.	S	Bend	trans	50.6	9.3	167.1	77.5	-82.8	0	0	0	120.8	A804 L808 F819 F820 S834 E835 L836	A804-F832 HydrophobicContact CB-CB 4.17Å; A804-F832 HydrophobicContact CB-CD1 3.07Å; A804-F832 HydrophobicContact CB-CD2 4.03Å; A804-F832 HydrophobicContact CB-CE1 3.25Å; A804-F832 HydrophobicContact CB-CE2 4.12Å; A804-F832 HydrophobicContact CB-CG 3.52Å; A804-F832 HydrophobicContact CB-CZ 3.77Å; L808-F832 HydrophobicContact CD1-CD2 3.83Å; L808-F832 HydrophobicContact CD1-CE2 4.29Å; L808-F832 HydrophobicContact CG-CE2 4.49Å; F819-F832 HydrophobicContact CD1-CE1 4.4Å; F820-F832 HydrophobicContact CB-CE1 4.22Å; F820-F832 HydrophobicContact CB-CZ 3.76Å; F820-F832 HydrophobicContact CD2-CD1 4.37Å; F820-F832 AromaticContact CD2-CE1 3.93Å; F820-F832 HydrophobicContact CD2-CE1 3.93Å; F820-F832 HydrophobicContact CD2-CE2 4.42Å; F820-F832 AromaticContact CD2-CZ 3.98Å; F820-F832 HydrophobicContact CD2-CZ 3.98Å; F820-F832 HydrophobicContact CG-CZ 4.38Å; F832-S834 VanDerWaalsContact C-N 3.26Å; F832-S834 PolarHBondContact O-N 3.25Å; F832-E835 WeakPolarHBondContact O-CB 3.27Å; F832-E835 PolarHBondContact O-N 3.33Å; F832-L836 HydrophobicContact CD2-CB 3.82Å; F832-L836 HydrophobicContact CD2-CD2 4.46Å; F832-L836 HydrophobicContact CE2-CB 3.86Å; F832-L836 HydrophobicContact CE2-CD1 4.2Å; F832-L836 HydrophobicContact CE2-CD2 3.76Å; F832-L836 HydrophobicContact CE2-CG 4.16Å; F832-L836 HydrophobicContact CZ-CD2 4.36Å; F832-L836 PolarHBondContact O-N 3.43Å; F832-L836 VanDerWaalsContact O-N 3.15Å
833	A	77.1	Confident	76.3	Confident	5 Å²	5	50 Å²	50	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-47.1	-40.8	-175	0	0	0	0	0	115.3	F820 P831 L837 I866	F820-A833 HydrophobicContact CE2-CB 3.79Å; F820-A833 HydrophobicContact CZ-CB 4.04Å; P831-A833 PolarHBondContact O-N 3.05Å; A833-L837 WeakPolarHBondContact O-CB 3.4Å; A833-L837 WeakPolarHBondContact O-CG 3.38Å; A833-L837 PolarHBondContact O-N 2.89Å; A833-I866 HydrophobicContact CB-CD1 4.02Å; A833-I866 HydrophobicContact CB-CG1 4.47Å
834	S	74.6	Confident	76.2	Confident	71 Å²	71	56.7 Å²	56.7	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-68.9	-34.4	178.5	53.5	0	0	0	0	114	F832 V838	F832-S834 VanDerWaalsContact C-N 3.26Å; F832-S834 PolarHBondContact O-N 3.25Å; S834-V838 WeakPolarHBondContact O-CG2 2.93Å; S834-V838 PolarHBondContact O-N 3.38Å
835	E	77.6	Confident	76.1	Confident	78 Å²	78	59 Å²	59	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-72.3	-42	178.5	-63.4	172.9	169.2	0	0	109.4	R805 L808 F832 V838 A839	R805-E835 IonicContact NE-OE2 3.05Å; R805-E835 IonicContact NH2-OE1 2.7Å; L808-E835 HydrophobicContact CD1-CB 4.02Å; F832-E835 WeakPolarHBondContact O-CB 3.27Å; F832-E835 PolarHBondContact O-N 3.33Å; E835-V838 PolarHBondContact O-N 2.98Å; E835-A839 WeakPolarHBondContact O-CB 3.22Å; E835-A839 PolarHBondContact O-N 3.2Å
836	L	80.8	Confident	75.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.3	-41.5	176.4	-171.8	62.8	0	0	0	112.9	L808 A816 V817 F820 F832 V838 A839 L840 L862	L808-L836 HydrophobicContact CD2-CD1 3.77Å; A816-L836 HydrophobicContact CB-CD1 3.98Å; V817-L836 HydrophobicContact CG2-CD1 4.12Å; V817-L836 HydrophobicContact CG2-CD2 4.01Å; V817-L836 HydrophobicContact CG2-CG 4.38Å; F820-L836 HydrophobicContact CB-CD2 4.03Å; F820-L836 HydrophobicContact CD2-CD2 4.25Å; F820-L836 HydrophobicContact CG-CD2 4.13Å; F832-L836 HydrophobicContact CD2-CB 3.82Å; F832-L836 HydrophobicContact CD2-CD2 4.46Å; F832-L836 HydrophobicContact CE2-CB 3.86Å; F832-L836 HydrophobicContact CE2-CD1 4.2Å; F832-L836 HydrophobicContact CE2-CD2 3.76Å; F832-L836 HydrophobicContact CE2-CG 4.16Å; F832-L836 HydrophobicContact CZ-CD2 4.36Å; F832-L836 PolarHBondContact O-N 3.43Å; F832-L836 VanDerWaalsContact O-N 3.15Å; L836-V838 PolarHBondContact O-N 3.14Å; L836-A839 PolarHBondContact O-N 3.5Å; L836-L840 HydrophobicContact CG-CD1 4.49Å; L836-L840 WeakPolarHBondContact O-CG 3.29Å; L836-L840 PolarHBondContact O-N 3.42Å; L836-L862 HydrophobicContact CB-CD2 4.16Å; L836-L862 HydrophobicContact CD2-CD1 3.67Å; L836-L862 HydrophobicContact CD2-CD2 3.58Å; L836-L862 HydrophobicContact CD2-CG 4.26Å; L836-L862 HydrophobicContact CG-CD2 3.6Å
837	L	80.6	Confident	75.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59	-45.5	173.8	-80.4	170.9	0	0	0	111.9	A833 L840 I841 L849 L862 I866 M878 A882	A833-L837 WeakPolarHBondContact O-CB 3.4Å; A833-L837 WeakPolarHBondContact O-CG 3.38Å; A833-L837 PolarHBondContact O-N 2.89Å; L837-L840 PolarHBondContact O-N 3.27Å; L837-I841 WeakPolarHBondContact O-CD1 3.47Å; L837-I841 WeakPolarHBondContact O-CG1 3.32Å; L837-I841 PolarHBondContact O-N 3.42Å; L837-L849 HydrophobicContact CD2-CD1 4Å; L837-L862 HydrophobicContact CD2-CD2 4.02Å; L837-L862 HydrophobicContact CG-CD2 4.17Å; L837-I866 HydrophobicContact CD1-CD1 3.87Å; L837-I866 HydrophobicContact CD2-CD1 4.3Å; L837-I866 HydrophobicContact CG-CD1 4.06Å; L837-M878 HydrophobicContact CD1-CB 3.97Å; L837-A882 HydrophobicContact CB-CB 4.05Å
838	V	81.4	Confident	74.8	Confident	28 Å²	28	56.7 Å²	56.7	17%	0.17	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-43.3	176.8	171	0	0	0	0	111	S834 E835 L836 I841 Q842 A882	S834-V838 WeakPolarHBondContact O-CG2 2.93Å; S834-V838 PolarHBondContact O-N 3.38Å; E835-V838 PolarHBondContact O-N 2.98Å; L836-V838 PolarHBondContact O-N 3.14Å; V838-I841 PolarHBondContact O-N 2.73Å; V838-Q842 HydrophobicContact CG1-CG 4.39Å; V838-Q842 WeakPolarHBondContact O-CB 2.83Å; V838-Q842 VanDerWaalsContact O-CG 3.31Å; V838-Q842 WeakPolarHBondContact O-CG 3.16Å; V838-Q842 PolarHBondContact O-N 2.91Å; V838-A882 HydrophobicContact CG2-CB 3.78Å
839	A	81	Confident	74.6	Confident	23 Å²	23	47.4 Å²	47.4	19%	0.19	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-43.5	178.4	0	0	0	0	0	112.6	L808 L813 E835 L836 Q842 A843	L808-A839 HydrophobicContact CD2-CB 4.2Å; L813-A839 HydrophobicContact CD2-CB 3.86Å; E835-A839 WeakPolarHBondContact O-CB 3.22Å; E835-A839 PolarHBondContact O-N 3.2Å; L836-A839 PolarHBondContact O-N 3.5Å; A839-Q842 PolarHBondContact O-N 2.9Å; A839-A843 VanDerWaalsContact O-CB 3.29Å; A839-A843 WeakPolarHBondContact O-CB 3.43Å; A839-A843 PolarHBondContact O-N 3.27Å
840	L	80.4	Confident	74.3	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-38.7	177.2	-69.8	179.3	0	0	0	113	L813 V817 L836 L837 Q842 A843 E844 N845 L848 L849 L862	L813-L840 HydrophobicContact CB-CD2 4.42Å; L813-L840 HydrophobicContact CD1-CD2 4.43Å; V817-L840 HydrophobicContact CG2-CD1 4.2Å; L836-L840 HydrophobicContact CG-CD1 4.49Å; L836-L840 WeakPolarHBondContact O-CG 3.29Å; L836-L840 PolarHBondContact O-N 3.42Å; L837-L840 PolarHBondContact O-N 3.27Å; L840-Q842 VanDerWaalsContact C-N 3.35Å; L840-A843 PolarHBondContact O-N 3.3Å; L840-E844 PolarHBondContact O-N 3.46Å; L840-E844 VanDerWaalsContact O-N 3.17Å; L840-N845 HydrophobicContact CD2-CB 4.18Å; L840-N845 PolarHBondContact O-N 2.92Å; L840-L848 HydrophobicContact CD1-CB 4.19Å; L840-L848 HydrophobicContact CD2-CB 3.84Å; L840-L848 HydrophobicContact CD2-CD1 3.99Å; L840-L849 HydrophobicContact CB-CD1 3.85Å; L840-L849 HydrophobicContact CD1-CD1 4.18Å; L840-L862 HydrophobicContact CD1-CB 4.21Å; L840-L862 HydrophobicContact CD1-CD2 3.55Å
841	I	81.2	Confident	73.4	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.062	29%	0.289	C	S	.	.	H	α-helix	trans	-68.4	-34.7	176.5	-65.5	164.8	0	0	0	111.3	L837 V838 L849 L879 A882 L883 A886 R888	L837-I841 WeakPolarHBondContact O-CD1 3.47Å; L837-I841 WeakPolarHBondContact O-CG1 3.32Å; L837-I841 PolarHBondContact O-N 3.42Å; V838-I841 PolarHBondContact O-N 2.73Å; I841-L849 HydrophobicContact CG1-CD1 4.23Å; I841-L879 HydrophobicContact CD1-CD1 3.98Å; I841-A882 HydrophobicContact CD1-CB 3.68Å; I841-L883 HydrophobicContact CD1-CD2 4.28Å; I841-L883 HydrophobicContact CD1-CG 4.43Å; I841-L883 HydrophobicContact CG2-CD2 4.22Å; I841-A886 HydrophobicContact CB-CB 4.29Å; I841-A886 HydrophobicContact CG2-CB 3.49Å; I841-A886 VanDerWaalsContact CG2-CB 3.49Å; I841-R888 PolarHBondContact O-NH2 3.35Å; I841-R888 VanDerWaalsContact O-NH2 3.14Å
842	Q	82.1	Confident	72	Confident	127 Å²	127	55.2 Å²	55.2	59%	0.593	31%	0.31	S	S	*	.	H	α-helix	trans	-73.1	-35.6	174.9	-74.7	178.1	-14.6	0	0	112.6	V838 A839 L840 E844 A886	V838-Q842 HydrophobicContact CG1-CG 4.39Å; V838-Q842 WeakPolarHBondContact O-CB 2.83Å; V838-Q842 VanDerWaalsContact O-CG 3.31Å; V838-Q842 WeakPolarHBondContact O-CG 3.16Å; V838-Q842 PolarHBondContact O-N 2.91Å; A839-Q842 PolarHBondContact O-N 2.9Å; L840-Q842 VanDerWaalsContact C-N 3.35Å; Q842-E844 VanDerWaalsContact C-N 3.26Å; Q842-E844 PolarHBondContact O-N 2.85Å; Q842-A886 HydrophobicContact CG-CB 4.4Å
843	A	79.8	Confident	70	Confident	52 Å²	52	63.5 Å²	63.5	43%	0.43	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	1.2	177.2	0	0	0	0	0	114.3	L813 A839 L840 N845	L813-A843 HydrophobicContact CD1-CB 3.53Å; A839-A843 VanDerWaalsContact O-CB 3.29Å; A839-A843 WeakPolarHBondContact O-CB 3.43Å; A839-A843 PolarHBondContact O-N 3.27Å; L840-A843 PolarHBondContact O-N 3.3Å; A843-N845 HydrophobicContact CB-CB 4.44Å; A843-N845 PolarHBondContact O-N 3.45Å
844	E	77.2	Confident	67.9	Low	141 Å²	141	74 Å²	74	66%	0.659	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	21.6	-174.6	-49.2	-144.9	110.8	0	0	114.7	L840 Q842 S846 R888	L840-E844 PolarHBondContact O-N 3.46Å; L840-E844 VanDerWaalsContact O-N 3.17Å; Q842-E844 VanDerWaalsContact C-N 3.26Å; Q842-E844 PolarHBondContact O-N 2.85Å; E844-S846 VanDerWaalsContact C-N 3.28Å; E844-S846 PolarHBondContact O-N 2.92Å; E844-R888 IonicContact OE1-CZ 2.88Å; E844-R888 IonicContact OE1-NH1 2.67Å; E844-R888 IonicContact OE1-NH2 3.23Å; E844-R888 PolarHBondContact OE1-NH2 3.09Å
845	N	72	Confident	66	Low	55 Å²	55	79.8 Å²	79.8	29%	0.294	41%	0.406	S	S	.	.			trans	-83.1	74.8	-172.7	-167.5	-24.5	0	0	0	110.7	L840 A843 A847 L848 L849	L840-N845 HydrophobicContact CD2-CB 4.18Å; L840-N845 PolarHBondContact O-N 2.92Å; A843-N845 HydrophobicContact CB-CB 4.44Å; A843-N845 PolarHBondContact O-N 3.45Å; N845-A847 VanDerWaalsContact C-N 3.25Å; N845-A847 PolarHBondContact O-N 2.78Å; N845-L848 WeakPolarHBondContact ND2-CD1 3.4Å; N845-L848 PolarHBondContact O-N 3.48Å; N845-L848 PolarHBondContact OD1-N 3.13Å; N845-L849 PolarHBondContact O-N 3.25Å
846	S	66.4	Low	64	Low	87 Å²	87	81 Å²	81	61%	0.608	42%	0.423	S	S	*	.	H	α-helix	trans	-56	-38.7	178	55.1	0	0	0	0	112.3	E844 L848 L849 Q850	E844-S846 VanDerWaalsContact C-N 3.28Å; E844-S846 PolarHBondContact O-N 2.92Å; S846-L848 VanDerWaalsContact C-N 3.34Å; S846-L848 PolarHBondContact O-N 3.42Å; S846-L849 WeakPolarHBondContact O-CA 3.33Å; S846-L849 WeakPolarHBondContact O-CB 3.5Å; S846-L849 PolarHBondContact O-N 2.64Å; S846-Q850 PolarHBondContact O-N 2.96Å
847	A	69	Low	61.8	Low	56 Å²	56	93.1 Å²	93.1	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-32.6	-176.2	0	0	0	0	0	114.5	N845	N845-A847 VanDerWaalsContact C-N 3.25Å; N845-A847 PolarHBondContact O-N 2.78Å
848	L	67.1	Low	59.9	Low	36 Å²	36	101 Å²	101	19%	0.188	51%	0.508	C	S	.	.	H	α-helix	trans	-84.7	-22.2	172.4	-69.4	-179.6	0	0	0	112.8	L813 V817 L840 N845 S846 L862	L813-L848 HydrophobicContact CB-CD1 4.41Å; V817-L848 HydrophobicContact CG1-CD2 4.47Å; V817-L848 HydrophobicContact CG2-CB 4.34Å; V817-L848 HydrophobicContact CG2-CD1 4.17Å; L840-L848 HydrophobicContact CD1-CB 4.19Å; L840-L848 HydrophobicContact CD2-CB 3.84Å; L840-L848 HydrophobicContact CD2-CD1 3.99Å; N845-L848 WeakPolarHBondContact ND2-CD1 3.4Å; N845-L848 PolarHBondContact O-N 3.48Å; N845-L848 PolarHBondContact OD1-N 3.13Å; S846-L848 VanDerWaalsContact C-N 3.34Å; S846-L848 PolarHBondContact O-N 3.42Å; L848-L862 PolarHBondContact O-N 3.47Å; L848-L862 VanDerWaalsContact O-N 3.13Å
849	L	65.8	Low	58.2	Low	27 Å²	27	104.4 Å²	104.4	14%	0.141	53%	0.525	C	S	.	.	H	α-helix	trans	-79	-45.9	178.6	-161.4	94	0	0	0	111.7	L837 L840 I841 N845 S846 Y863	L837-L849 HydrophobicContact CD2-CD1 4Å; L840-L849 HydrophobicContact CB-CD1 3.85Å; L840-L849 HydrophobicContact CD1-CD1 4.18Å; I841-L849 HydrophobicContact CG1-CD1 4.23Å; N845-L849 PolarHBondContact O-N 3.25Å; S846-L849 WeakPolarHBondContact O-CA 3.33Å; S846-L849 WeakPolarHBondContact O-CB 3.5Å; S846-L849 PolarHBondContact O-N 2.64Å; L849-Y863 VanDerWaalsContact O-CB 3.26Å; L849-Y863 WeakPolarHBondContact O-CB 3.17Å; L849-Y863 PolarHBondContact O-N 3.45Å
850	Q	61.2	Low	56.8	Low	109 Å²	109	106.3 Å²	106.3	51%	0.509	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.4	135.5	-178.4	-71.3	179.6	-21.6	0	0	109.2	S846 G852	S846-Q850 PolarHBondContact O-N 2.96Å; Q850-G852 PolarHBondContact O-N 2.95Å
851	R	47.9	Very low	56	Low	189 Å²	189	106.6 Å²	106.6	71%	0.713	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-27.8	115.7	-172.3	-80.7	-178.2	169	169	0.1	116.6
852	G	35.8	Very low	55.5	Low	50 Å²	50	106 Å²	106	52%	0.515	53%	0.532	S	S	.	.			trans	-78	129.4	154.1	0	0	0	0	0	111.5	Q850 R854	Q850-G852 PolarHBondContact O-N 2.95Å; G852-R854 PolarHBondContact O-N 2.71Å; G852-R854 VanDerWaalsContact O-N 3.11Å
853	E	30.9	Very low	55.1	Low	186 Å²	186	100.9 Å²	100.9	87%	0.869	51%	0.508	S	S	*	.			trans	-71.9	97.6	177.1	-63.2	-179.5	149.3	0	0	111.9
854	R	32.8	Very low	54.9	Low	227 Å²	227	101 Å²	101	86%	0.857	50%	0.501	S	S	*	.	S	Bend	trans	-179.4	119	144.9	-97.7	148.8	-162.8	-156.8	3.2	113.7	G852 S856	G852-R854 PolarHBondContact O-N 2.71Å; G852-R854 VanDerWaalsContact O-N 3.11Å; R854-S856 PolarHBondContact O-N 3.25Å
855	E	34.2	Very low	54.7	Low	192 Å²	192	94.5 Å²	94.5	90%	0.897	47%	0.471	S	S	*	.	S	Bend	trans	55.3	53	137.4	-58.2	-178.9	162.5	0	0	120.2
856	S	35.5	Very low	54.9	Low	102 Å²	102	91.9 Å²	91.9	71%	0.713	46%	0.457	S	S	*	.			trans	-152.6	142.6	136.5	-166.8	0	0	0	0	111.6	R854 M858	R854-S856 PolarHBondContact O-N 3.25Å; S856-M858 VanDerWaalsContact C-N 3.27Å; S856-M858 PolarHBondContact O-N 3.13Å; S856-M858 VanDerWaalsContact O-N 3.16Å
857	R	35.6	Very low	55.6	Low	256 Å²	256	89.9 Å²	89.9	97%	0.966	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	16.3	-161.2	-128.5	175.8	-175.4	173.3	0.2	114.9
858	M	39.8	Very low	55.9	Low	166 Å²	166	92.2 Å²	92.2	82%	0.818	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	-13.3	-160.8	-119	164.5	169.2	0	0	117.6	S856	S856-M858 VanDerWaalsContact C-N 3.27Å; S856-M858 PolarHBondContact O-N 3.13Å; S856-M858 VanDerWaalsContact O-N 3.16Å
859	N	46.2	Very low	56.2	Low	99 Å²	99	95 Å²	95	53%	0.529	45%	0.453	S	S	.	.			trans	-105	121.8	-176.6	-65.5	36.6	0	0	0	111.5
860	N	52.7	Low	56.4	Low	62 Å²	62	99 Å²	99	33%	0.332	47%	0.466	S	S	.	.			trans	-87.6	147.7	168.9	-78.8	-17.2	0	0	0	109.7	D864 L865 E868	N860-D864 HydrophobicContact CB-CB 4.19Å; N860-L865 HydrophobicContact CB-CD1 4.48Å; N860-L865 HydrophobicContact CB-CD2 4.18Å; N860-L865 HydrophobicContact CB-CG 3.83Å; N860-E868 PolarHBondContact ND2-OE2 3.18Å
861	G	63.3	Low	57	Low	8 Å²	8	95.3 Å²	95.3	8%	0.082	46%	0.458	C	S	.	.			trans	-66.3	158.8	175.6	0	0	0	0	0	111.6	Y863 D864 L865	G861-Y863 PolarHBondContact O-N 3.11Å; G861-D864 PolarHBondContact N-OD2 3.17Å; G861-D864 WeakPolarHBondContact O-CB 3.23Å; G861-D864 PolarHBondContact O-N 2.9Å; G861-L865 PolarHBondContact O-N 3.01Å
862	L	70.6	Confident	58.3	Low	0 Å²	0	91 Å²	91	0%	0	45%	0.446	C	S	.	.	H	α-helix	trans	-56.2	-42.1	-178	178.4	66.4	0	0	0	112.1	F820 L836 L837 L840 L848 L865 I866	F820-L862 HydrophobicContact CD1-CD1 3.4Å; F820-L862 HydrophobicContact CD2-CD1 4.39Å; F820-L862 HydrophobicContact CE1-CD1 3.31Å; F820-L862 HydrophobicContact CE2-CD1 4.32Å; F820-L862 HydrophobicContact CG-CD1 3.96Å; F820-L862 HydrophobicContact CZ-CD1 3.79Å; L836-L862 HydrophobicContact CB-CD2 4.16Å; L836-L862 HydrophobicContact CD2-CD1 3.67Å; L836-L862 HydrophobicContact CD2-CD2 3.58Å; L836-L862 HydrophobicContact CD2-CG 4.26Å; L836-L862 HydrophobicContact CG-CD2 3.6Å; L837-L862 HydrophobicContact CD2-CD2 4.02Å; L837-L862 HydrophobicContact CG-CD2 4.17Å; L840-L862 HydrophobicContact CD1-CB 4.21Å; L840-L862 HydrophobicContact CD1-CD2 3.55Å; L848-L862 PolarHBondContact O-N 3.47Å; L848-L862 VanDerWaalsContact O-N 3.13Å; L862-L865 PolarHBondContact O-N 3.47Å; L862-I866 HydrophobicContact CD1-CD1 4.09Å; L862-I866 HydrophobicContact CD1-CG1 4.42Å; L862-I866 HydrophobicContact CD2-CD1 4.46Å; L862-I866 HydrophobicContact CG-CD1 3.9Å; L862-I866 VanDerWaalsContact O-CG1 3.26Å; L862-I866 WeakPolarHBondContact O-CG1 3.45Å; L862-I866 PolarHBondContact O-N 2.67Å
863	Y	73.1	Confident	60.2	Low	19 Å²	19	91.6 Å²	91.6	8%	0.075	44%	0.441	C	S	.	.	H	α-helix	trans	-65.4	-42	177.7	-171.9	-99.6	0	0	0	111.5	L849 G861 L865 I866 V867 A875 L876 L879	L849-Y863 VanDerWaalsContact O-CB 3.26Å; L849-Y863 WeakPolarHBondContact O-CB 3.17Å; L849-Y863 PolarHBondContact O-N 3.45Å; G861-Y863 PolarHBondContact O-N 3.11Å; Y863-L865 PolarHBondContact O-N 2.88Å; Y863-I866 PolarHBondContact O-N 2.97Å; Y863-V867 HydrophobicContact CD1-CG2 3.9Å; Y863-V867 HydrophobicContact CE1-CG2 3.52Å; Y863-V867 VanDerWaalsContact O-CG2 3.31Å; Y863-V867 WeakPolarHBondContact O-CG2 3.25Å; Y863-V867 PolarHBondContact O-N 2.64Å; Y863-A875 HydrophobicContact CE2-CB 3.8Å; Y863-L876 VanDerWaalsContact OH-CD2 3.23Å; Y863-L876 WeakPolarHBondContact OH-CD2 3.45Å; Y863-L876 WeakPolarHBondContact OH-CG 3.46Å; Y863-L879 HydrophobicContact CD2-CD2 4.28Å; Y863-L879 HydrophobicContact CE2-CB 4.08Å; Y863-L879 HydrophobicContact CE2-CD2 3.76Å; Y863-L879 HydrophobicContact CE2-CG 4.47Å
864	D	75.3	Confident	62.2	Low	54 Å²	54	83.5 Å²	83.5	29%	0.289	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177.5	-54.8	-34.5	0	0	0	111.2	N860 G861 I866 V867 E868	N860-D864 HydrophobicContact CB-CB 4.19Å; G861-D864 PolarHBondContact N-OD2 3.17Å; G861-D864 WeakPolarHBondContact O-CB 3.23Å; G861-D864 PolarHBondContact O-N 2.9Å; D864-I866 PolarHBondContact O-N 3.36Å; D864-V867 PolarHBondContact O-N 3.12Å; D864-E868 WeakPolarHBondContact O-CB 3.18Å; D864-E868 PolarHBondContact O-N 3.08Å
865	L	73.8	Confident	64.4	Low	4 Å²	4	72.7 Å²	72.7	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-42.3	173.8	-79.2	162	0	0	0	112.4	F820 D821 N860 G861 L862 Y863 E868 K869	F820-L865 HydrophobicContact CE1-CB 4.39Å; D821-L865 HydrophobicContact CB-CD1 3.86Å; D821-L865 VanDerWaalsContact OD1-CD2 3.3Å; D821-L865 WeakPolarHBondContact OD1-CD2 3.24Å; N860-L865 HydrophobicContact CB-CD1 4.48Å; N860-L865 HydrophobicContact CB-CD2 4.18Å; N860-L865 HydrophobicContact CB-CG 3.83Å; G861-L865 PolarHBondContact O-N 3.01Å; L862-L865 PolarHBondContact O-N 3.47Å; Y863-L865 PolarHBondContact O-N 2.88Å; L865-E868 PolarHBondContact O-N 3.09Å; L865-K869 WeakPolarHBondContact O-CG 3.32Å; L865-K869 PolarHBondContact O-N 2.89Å; L865-K869 VanDerWaalsContact O-N 3.12Å
866	I	76.1	Confident	66.7	Low	1 Å²	1	64.1 Å²	64.1	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-41.8	177.7	-69.3	168.9	0	0	0	110.7	F820 A833 L837 L862 Y863 D864 K869 R870 A875 M878	F820-I866 HydrophobicContact CE1-CG1 4.4Å; F820-I866 HydrophobicContact CZ-CG1 4.06Å; A833-I866 HydrophobicContact CB-CD1 4.02Å; A833-I866 HydrophobicContact CB-CG1 4.47Å; L837-I866 HydrophobicContact CD1-CD1 3.87Å; L837-I866 HydrophobicContact CD2-CD1 4.3Å; L837-I866 HydrophobicContact CG-CD1 4.06Å; L862-I866 HydrophobicContact CD1-CD1 4.09Å; L862-I866 HydrophobicContact CD1-CG1 4.42Å; L862-I866 HydrophobicContact CD2-CD1 4.46Å; L862-I866 HydrophobicContact CG-CD1 3.9Å; L862-I866 VanDerWaalsContact O-CG1 3.26Å; L862-I866 WeakPolarHBondContact O-CG1 3.45Å; L862-I866 PolarHBondContact O-N 2.67Å; Y863-I866 PolarHBondContact O-N 2.97Å; D864-I866 PolarHBondContact O-N 3.36Å; I866-K869 PolarHBondContact O-N 3.46Å; I866-R870 PolarHBondContact O-N 3.16Å; I866-A875 HydrophobicContact CG2-CB 3.77Å; I866-M878 HydrophobicContact CG2-CE 3.35Å
867	V	80	Confident	68.8	Low	45 Å²	45	59.3 Å²	59.3	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-45.2	174	171.7	0	0	0	0	110.6	Y863 D864 K869 G871 E872 A875	Y863-V867 HydrophobicContact CD1-CG2 3.9Å; Y863-V867 HydrophobicContact CE1-CG2 3.52Å; Y863-V867 VanDerWaalsContact O-CG2 3.31Å; Y863-V867 WeakPolarHBondContact O-CG2 3.25Å; Y863-V867 PolarHBondContact O-N 2.64Å; D864-V867 PolarHBondContact O-N 3.12Å; V867-K869 VanDerWaalsContact C-N 3.31Å; V867-K869 PolarHBondContact O-N 3.12Å; V867-G871 VanDerWaalsContact O-CA 3.22Å; V867-G871 WeakPolarHBondContact O-CA 3.5Å; V867-G871 PolarHBondContact O-N 2.86Å; V867-E872 HydrophobicContact CG1-CB 4.4Å; V867-A875 HydrophobicContact CB-CB 4.44Å; V867-A875 HydrophobicContact CG2-CB 3.49Å; V867-A875 VanDerWaalsContact CG2-CB 3.49Å
868	E	77	Confident	71	Confident	105 Å²	105	47.9 Å²	47.9	49%	0.491	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-37.2	179.5	-162.7	-159.1	123.4	0	0	112.7	N860 D864 L865	N860-E868 PolarHBondContact ND2-OE2 3.18Å; D864-E868 WeakPolarHBondContact O-CB 3.18Å; D864-E868 PolarHBondContact O-N 3.08Å; L865-E868 PolarHBondContact O-N 3.09Å
869	K	73.2	Confident	73.1	Confident	94 Å²	94	40.8 Å²	40.8	41%	0.409	21%	0.214	S	C	.	.	H	α-helix	trans	-100.6	-26.1	-175.3	-52.7	-53.9	-173.2	-159.2	0	116	L830 L865 I866 V867	L830-K869 HydrophobicContact CD1-CB 3.75Å; L830-K869 HydrophobicContact CD2-CB 3.9Å; L830-K869 HydrophobicContact CD2-CG 4.12Å; L830-K869 HydrophobicContact CG-CB 4.24Å; L865-K869 WeakPolarHBondContact O-CG 3.32Å; L865-K869 PolarHBondContact O-N 2.89Å; L865-K869 VanDerWaalsContact O-N 3.12Å; I866-K869 PolarHBondContact O-N 3.46Å; V867-K869 VanDerWaalsContact C-N 3.31Å; V867-K869 PolarHBondContact O-N 3.12Å
870	R	69.6	Low	74.8	Confident	110 Å²	110	36 Å²	36	42%	0.415	19%	0.189	S	C	.	.	H	α-helix	trans	-117.8	-4	-179.9	-67.7	-162.5	179.8	179.4	3.2	114.7	L830 I866 M878	L830-R870 HydrophobicContact CD1-CG 3.74Å; I866-R870 PolarHBondContact O-N 3.16Å; R870-M878 PolarHBondContact NH1-SD 2.87Å; R870-M878 VanDerWaalsContact NH1-SD 3.4Å
871	G	72.8	Confident	76.3	Confident	33 Å²	33	33.7 Å²	33.7	34%	0.34	18%	0.176	S	C	.	.	H	α-helix	trans	77.1	158.6	-175	0	0	0	0	0	113.3	V867 S873 S874 A875	V867-G871 VanDerWaalsContact O-CA 3.22Å; V867-G871 WeakPolarHBondContact O-CA 3.5Å; V867-G871 PolarHBondContact O-N 2.86Å; G871-S873 PolarHBondContact O-N 3.33Å; G871-S874 PolarHBondContact O-N 3.02Å; G871-A875 WeakPolarHBondContact O-CB 3.38Å; G871-A875 PolarHBondContact O-N 3.04Å; G871-A875 VanDerWaalsContact O-N 3.09Å
872	E	76.9	Confident	77.3	Confident	99 Å²	99	33.4 Å²	33.4	46%	0.463	17%	0.173	S	C	.	.	H	α-helix	trans	-62.5	-38.2	-170.8	-169.8	172.1	-160.4	0	0	113.4	V867 A875 L876 R899	V867-E872 HydrophobicContact CG1-CB 4.4Å; E872-A875 PolarHBondContact O-N 3.38Å; E872-L876 HydrophobicContact CG-CD1 3.91Å; E872-L876 HydrophobicContact CG-CG 4.3Å; E872-L876 WeakPolarHBondContact O-CB 3.19Å; E872-L876 VanDerWaalsContact O-CG 3.27Å; E872-L876 WeakPolarHBondContact O-CG 3.27Å; E872-L876 PolarHBondContact O-N 3.18Å; E872-R899 IonicContact OE1-CZ 3.44Å; E872-R899 IonicContact OE1-NH1 3.46Å; E872-R899 PolarHBondContact OE1-NH1 2.93Å; E872-R899 IonicContact OE1-NH2 3.39Å; E872-R899 PolarHBondContact OE1-NH2 3.45Å
873	S	74.5	Confident	77.9	Confident	61 Å²	61	34 Å²	34	43%	0.427	18%	0.177	S	C	.	.	H	α-helix	trans	-62.1	-46	178.7	164.9	0	0	0	0	112.9	G871 L876 T877	G871-S873 PolarHBondContact O-N 3.33Å; S873-L876 PolarHBondContact O-N 2.87Å; S873-T877 WeakPolarHBondContact O-CB 3.29Å; S873-T877 PolarHBondContact O-N 2.99Å; S873-T877 PolarHBondContact O-OG1 3.24Å
874	S	74.3	Confident	78.5	Confident	16 Å²	16	33.1 Å²	33.1	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-71.6	-33.8	176.4	-179.1	0	0	0	0	111.8	G871 T877 M878 Q907	G871-S874 PolarHBondContact O-N 3.02Å; S874-T877 PolarHBondContact O-N 2.57Å; S874-M878 WeakPolarHBondContact O-CE 3.34Å; S874-M878 WeakPolarHBondContact O-CG 3.45Å; S874-M878 PolarHBondContact O-N 3Å; S874-Q907 PolarHBondContact OG-NE2 3.27Å; S874-Q907 PolarHBondContact OG-OE1 3.31Å
875	A	78.8	Confident	78.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-45.8	173	0	0	0	0	0	111.7	Y863 I866 V867 G871 E872 M878 L879	Y863-A875 HydrophobicContact CE2-CB 3.8Å; I866-A875 HydrophobicContact CG2-CB 3.77Å; V867-A875 HydrophobicContact CB-CB 4.44Å; V867-A875 HydrophobicContact CG2-CB 3.49Å; V867-A875 VanDerWaalsContact CG2-CB 3.49Å; G871-A875 WeakPolarHBondContact O-CB 3.38Å; G871-A875 PolarHBondContact O-N 3.04Å; G871-A875 VanDerWaalsContact O-N 3.09Å; E872-A875 PolarHBondContact O-N 3.38Å; A875-M878 PolarHBondContact O-N 2.94Å; A875-L879 WeakPolarHBondContact O-CB 3.16Å; A875-L879 PolarHBondContact O-N 3Å
876	L	80.7	Confident	79.3	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.068	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-46.1	174.4	-72.7	168.4	0	0	0	111.6	Y863 E872 S873 M878 L879 T880 L895 I901	Y863-L876 VanDerWaalsContact OH-CD2 3.23Å; Y863-L876 WeakPolarHBondContact OH-CD2 3.45Å; Y863-L876 WeakPolarHBondContact OH-CG 3.46Å; E872-L876 HydrophobicContact CG-CD1 3.91Å; E872-L876 HydrophobicContact CG-CG 4.3Å; E872-L876 WeakPolarHBondContact O-CB 3.19Å; E872-L876 VanDerWaalsContact O-CG 3.27Å; E872-L876 WeakPolarHBondContact O-CG 3.27Å; E872-L876 PolarHBondContact O-N 3.18Å; S873-L876 PolarHBondContact O-N 2.87Å; L876-M878 PolarHBondContact O-N 3.33Å; L876-L879 PolarHBondContact O-N 3.35Å; L876-L879 VanDerWaalsContact O-N 3.14Å; L876-T880 PolarHBondContact O-N 3.06Å; L876-T880 PolarHBondContact O-OG1 2.77Å; L876-L895 HydrophobicContact CD2-CD1 4.31Å; L876-L895 HydrophobicContact CD2-CD2 4.33Å; L876-L895 HydrophobicContact CD2-CG 4.49Å; L876-I901 HydrophobicContact CB-CD1 3.98Å; L876-I901 HydrophobicContact CB-CG1 3.95Å; L876-I901 HydrophobicContact CB-CG2 4.25Å; L876-I901 HydrophobicContact CD1-CD1 4.36Å; L876-I901 HydrophobicContact CD1-CG1 3.92Å; L876-I901 HydrophobicContact CD2-CD1 4.23Å; L876-I901 HydrophobicContact CG-CD1 4.42Å; L876-I901 HydrophobicContact CG-CG1 4.39Å
877	T	80.4	Confident	79.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-55.8	-48.8	176.2	-62.4	0	0	0	0	111.5	S873 S874 L879 T880 L881 T902 F903 Q907	S873-T877 WeakPolarHBondContact O-CB 3.29Å; S873-T877 PolarHBondContact O-N 2.99Å; S873-T877 PolarHBondContact O-OG1 3.24Å; S874-T877 PolarHBondContact O-N 2.57Å; T877-L879 PolarHBondContact O-N 3.19Å; T877-T880 PolarHBondContact O-N 2.77Å; T877-L881 HydrophobicContact CG2-CD1 4.02Å; T877-L881 VanDerWaalsContact O-CG 3.3Å; T877-L881 WeakPolarHBondContact O-CG 3.33Å; T877-L881 PolarHBondContact O-N 2.84Å; T877-T902 PolarHBondContact OG1-O 3.37Å; T877-F903 HydrophobicContact CG2-CD1 4.02Å; T877-Q907 HydrophobicContact CG2-CB 4.08Å
878	M	81.6	Confident	79.7	Confident	16 Å²	16	41.2 Å²	41.2	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-37.4	177.2	-71.8	-173.7	-70.8	0	0	112.5	L837 I866 R870 S874 A875 L876 A882	L837-M878 HydrophobicContact CD1-CB 3.97Å; I866-M878 HydrophobicContact CG2-CE 3.35Å; R870-M878 PolarHBondContact NH1-SD 2.87Å; R870-M878 VanDerWaalsContact NH1-SD 3.4Å; S874-M878 WeakPolarHBondContact O-CE 3.34Å; S874-M878 WeakPolarHBondContact O-CG 3.45Å; S874-M878 PolarHBondContact O-N 3Å; A875-M878 PolarHBondContact O-N 2.94Å; L876-M878 PolarHBondContact O-N 3.33Å; M878-A882 VanDerWaalsContact O-CB 3.22Å; M878-A882 WeakPolarHBondContact O-CB 3.48Å; M878-A882 PolarHBondContact O-N 2.98Å
879	L	83.2	Confident	79.9	Confident	17 Å²	17	38.9 Å²	38.9	9%	0.089	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-45.5	175.5	-178.8	61.3	0	0	0	111.8	I841 Y863 A875 L876 T877 L881 A882 L883 L895	I841-L879 HydrophobicContact CD1-CD1 3.98Å; Y863-L879 HydrophobicContact CD2-CD2 4.28Å; Y863-L879 HydrophobicContact CE2-CB 4.08Å; Y863-L879 HydrophobicContact CE2-CD2 3.76Å; Y863-L879 HydrophobicContact CE2-CG 4.47Å; A875-L879 WeakPolarHBondContact O-CB 3.16Å; A875-L879 PolarHBondContact O-N 3Å; L876-L879 PolarHBondContact O-N 3.35Å; L876-L879 VanDerWaalsContact O-N 3.14Å; T877-L879 PolarHBondContact O-N 3.19Å; L879-L881 PolarHBondContact O-N 2.91Å; L879-A882 PolarHBondContact O-N 3.42Å; L879-L883 HydrophobicContact CD1-CG 4.41Å; L879-L883 HydrophobicContact CG-CD1 4.22Å; L879-L883 WeakPolarHBondContact O-CG 3.26Å; L879-L883 PolarHBondContact O-N 2.94Å; L879-L895 HydrophobicContact CD2-CD1 3.83Å; L879-L895 HydrophobicContact CG-CD1 4.5Å
880	T	83.1	Confident	80.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-46	177.2	-48.2	0	0	0	0	111.5	L876 T877 A882 L883 I884 A892 L895 L896 F903	L876-T880 PolarHBondContact O-N 3.06Å; L876-T880 PolarHBondContact O-OG1 2.77Å; T877-T880 PolarHBondContact O-N 2.77Å; T880-A882 VanDerWaalsContact C-N 3.3Å; T880-A882 PolarHBondContact O-N 2.7Å; T880-L883 PolarHBondContact O-N 2.72Å; T880-I884 HydrophobicContact CG2-CD1 4.34Å; T880-I884 WeakPolarHBondContact O-CG1 3.31Å; T880-I884 PolarHBondContact O-N 3.42Å; T880-A892 HydrophobicContact CG2-CB 4.14Å; T880-L895 WeakPolarHBondContact OG1-CD2 3.33Å; T880-L896 HydrophobicContact CG2-CD1 3.96Å; T880-L896 HydrophobicContact CG2-CD2 4.47Å; T880-L896 HydrophobicContact CG2-CG 4.14Å; T880-F903 HydrophobicContact CG2-CE1 4.18Å; T880-F903 HydrophobicContact CG2-CZ 3.86Å
881	L	84.1	Confident	80.9	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-66.9	-30.5	177.5	-65.7	174.5	0	0	0	112.5	T877 L879 S885 F903 L908 F911	T877-L881 HydrophobicContact CG2-CD1 4.02Å; T877-L881 VanDerWaalsContact O-CG 3.3Å; T877-L881 WeakPolarHBondContact O-CG 3.33Å; T877-L881 PolarHBondContact O-N 2.84Å; L879-L881 PolarHBondContact O-N 2.91Å; L881-S885 WeakPolarHBondContact O-CB 3.26Å; L881-S885 PolarHBondContact O-N 3.44Å; L881-S885 PolarHBondContact O-OG 3.28Å; L881-F903 HydrophobicContact CD2-CE1 4.13Å; L881-F903 HydrophobicContact CG-CE1 4.38Å; L881-L908 HydrophobicContact CD2-CD1 4.09Å; L881-F911 HydrophobicContact CB-CD2 3.91Å; L881-F911 HydrophobicContact CB-CE2 3.92Å; L881-F911 HydrophobicContact CD1-CB 4.1Å; L881-F911 HydrophobicContact CD1-CD2 4.22Å; L881-F911 HydrophobicContact CD1-CG 4.25Å; L881-F911 HydrophobicContact CD2-CB 4.35Å; L881-F911 HydrophobicContact CD2-CD1 3.92Å; L881-F911 HydrophobicContact CD2-CD2 4.06Å; L881-F911 HydrophobicContact CD2-CE1 4.19Å; L881-F911 HydrophobicContact CD2-CE2 4.31Å; L881-F911 HydrophobicContact CD2-CG 3.86Å; L881-F911 HydrophobicContact CD2-CZ 4.38Å; L881-F911 HydrophobicContact CG-CD2 4.28Å; L881-F911 HydrophobicContact CG-CG 4.44Å
882	A	83.4	Confident	81.4	Confident	3 Å²	3	39 Å²	39	3%	0.025	19%	0.19	C	C	.	.	H	α-helix	trans	-72.8	-39.9	172.4	0	0	0	0	0	112.2	L837 V838 I841 M878 L879 T880 S885 A886	L837-A882 HydrophobicContact CB-CB 4.05Å; V838-A882 HydrophobicContact CG2-CB 3.78Å; I841-A882 HydrophobicContact CD1-CB 3.68Å; M878-A882 VanDerWaalsContact O-CB 3.22Å; M878-A882 WeakPolarHBondContact O-CB 3.48Å; M878-A882 PolarHBondContact O-N 2.98Å; L879-A882 PolarHBondContact O-N 3.42Å; T880-A882 VanDerWaalsContact C-N 3.3Å; T880-A882 PolarHBondContact O-N 2.7Å; A882-S885 CarbonylContact O-C 3.56Å; A882-S885 WeakPolarHBondContact O-CB 3.44Å; A882-S885 PolarHBondContact O-N 3.42Å; A882-A886 VanDerWaalsContact O-CB 3.31Å; A882-A886 WeakPolarHBondContact O-CB 3.46Å; A882-A886 PolarHBondContact O-N 3.48Å
883	L	84.7	Confident	81.6	Confident	13 Å²	13	37 Å²	37	7%	0.068	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-42.7	173.4	-72.8	168.6	0	0	0	111.8	I841 L879 T880 A886 R887 R888 Q891 A892	I841-L883 HydrophobicContact CD1-CD2 4.28Å; I841-L883 HydrophobicContact CD1-CG 4.43Å; I841-L883 HydrophobicContact CG2-CD2 4.22Å; L879-L883 HydrophobicContact CD1-CG 4.41Å; L879-L883 HydrophobicContact CG-CD1 4.22Å; L879-L883 WeakPolarHBondContact O-CG 3.26Å; L879-L883 PolarHBondContact O-N 2.94Å; T880-L883 PolarHBondContact O-N 2.72Å; L883-A886 CarbonylContact O-C 3.54Å; L883-A886 PolarHBondContact O-N 2.81Å; L883-R887 PolarHBondContact O-N 2.98Å; L883-R887 VanDerWaalsContact O-N 3.11Å; L883-R888 HydrophobicContact CB-CB 4.47Å; L883-R888 HydrophobicContact CD2-CB 3.92Å; L883-R888 HydrophobicContact CD2-CG 4.46Å; L883-R888 PolarHBondContact O-N 3.06Å; L883-Q891 HydrophobicContact CD1-CB 4.45Å; L883-Q891 HydrophobicContact CD2-CB 4.25Å; L883-A892 HydrophobicContact CB-CB 4.05Å
884	I	84.2	Confident	81.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-48	172.4	-68.1	167.9	0	0	0	110.1	T880 A886 R887 A892 F911 L927 V930	T880-I884 HydrophobicContact CG2-CD1 4.34Å; T880-I884 WeakPolarHBondContact O-CG1 3.31Å; T880-I884 PolarHBondContact O-N 3.42Å; I884-A886 PolarHBondContact O-N 3.42Å; I884-R887 PolarHBondContact O-N 2.91Å; I884-A892 HydrophobicContact CG1-CB 4.12Å; I884-F911 HydrophobicContact CG2-CZ 4.41Å; I884-L927 HydrophobicContact CD1-CD1 3.77Å; I884-V930 HydrophobicContact CD1-CG1 4.37Å
885	S	83.1	Confident	82.1	Confident	16 Å²	16	39.5 Å²	39.5	11%	0.112	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-30.1	175.9	-61.5	0	0	0	0	113.8	L881 A882 R887 F911 R915	L881-S885 WeakPolarHBondContact O-CB 3.26Å; L881-S885 PolarHBondContact O-N 3.44Å; L881-S885 PolarHBondContact O-OG 3.28Å; A882-S885 CarbonylContact O-C 3.56Å; A882-S885 WeakPolarHBondContact O-CB 3.44Å; A882-S885 PolarHBondContact O-N 3.42Å; S885-R887 VanDerWaalsContact C-N 3.33Å; S885-F911 WeakPolarHBondContact OG-CE2 3.33Å; S885-R915 VanDerWaalsContact OG-CZ 3.28Å; S885-R915 PolarHBondContact OG-NH1 3.42Å; S885-R915 VanDerWaalsContact OG-NH1 3.14Å; S885-R915 PolarHBondContact OG-NH2 2.68Å
886	A	83.3	Confident	82	Confident	21 Å²	21	40.4 Å²	40.4	17%	0.174	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	7.5	177.2	0	0	0	0	0	113.3	I841 Q842 A882 L883 I884 R888	I841-A886 HydrophobicContact CB-CB 4.29Å; I841-A886 HydrophobicContact CG2-CB 3.49Å; I841-A886 VanDerWaalsContact CG2-CB 3.49Å; Q842-A886 HydrophobicContact CG-CB 4.4Å; A882-A886 VanDerWaalsContact O-CB 3.31Å; A882-A886 WeakPolarHBondContact O-CB 3.46Å; A882-A886 PolarHBondContact O-N 3.48Å; L883-A886 CarbonylContact O-C 3.54Å; L883-A886 PolarHBondContact O-N 2.81Å; I884-A886 PolarHBondContact O-N 3.42Å; A886-R888 HydrophobicContact CB-CG 4.4Å; A886-R888 PolarHBondContact O-N 2.81Å
887	R	81.8	Confident	81.8	Confident	170 Å²	170	46.6 Å²	46.6	64%	0.642	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	20.8	-178.5	-55.6	-175.7	178.2	172.1	3.4	115.4	L883 I884 S885 I889	L883-R887 PolarHBondContact O-N 2.98Å; L883-R887 VanDerWaalsContact O-N 3.11Å; I884-R887 PolarHBondContact O-N 2.91Å; S885-R887 VanDerWaalsContact C-N 3.33Å; R887-I889 PolarHBondContact O-N 3.43Å; R887-I889 VanDerWaalsContact O-N 3.1Å
888	R	82.8	Confident	81.4	Confident	67 Å²	67	54.3 Å²	54.3	25%	0.253	25%	0.249	S	C	.	.			trans	-88.2	58.7	176.3	-58.4	-165.9	-178.1	-136.8	-8.5	110.8	I841 E844 L883 A886 E890 Q891 A892	I841-R888 PolarHBondContact O-NH2 3.35Å; I841-R888 VanDerWaalsContact O-NH2 3.14Å; E844-R888 IonicContact OE1-CZ 2.88Å; E844-R888 IonicContact OE1-NH1 2.67Å; E844-R888 IonicContact OE1-NH2 3.23Å; E844-R888 PolarHBondContact OE1-NH2 3.09Å; L883-R888 HydrophobicContact CB-CB 4.47Å; L883-R888 HydrophobicContact CD2-CB 3.92Å; L883-R888 HydrophobicContact CD2-CG 4.46Å; L883-R888 PolarHBondContact O-N 3.06Å; A886-R888 HydrophobicContact CB-CG 4.4Å; A886-R888 PolarHBondContact O-N 2.81Å; R888-E890 PolarHBondContact O-N 2.75Å; R888-Q891 HydrophobicContact CB-CB 4.12Å; R888-Q891 HydrophobicContact CB-CG 4.32Å; R888-Q891 PolarHBondContact O-N 3Å; R888-Q891 VanDerWaalsContact O-N 3.1Å; R888-A892 PolarHBondContact O-N 2.84Å
889	I	81.8	Confident	80.6	Confident	56 Å²	56	58.9 Å²	58.9	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-48.9	-171	-57.4	179.1	0	0	0	111.4	R887 Q891 A892 E893 S926 V930	R887-I889 PolarHBondContact O-N 3.43Å; R887-I889 VanDerWaalsContact O-N 3.1Å; I889-Q891 VanDerWaalsContact C-N 3.25Å; I889-Q891 PolarHBondContact O-N 3.25Å; I889-A892 WeakPolarHBondContact O-CB 3.46Å; I889-A892 PolarHBondContact O-N 3.43Å; I889-A892 VanDerWaalsContact O-N 3.08Å; I889-E893 PolarHBondContact O-N 3.28Å; I889-S926 WeakPolarHBondContact CD1-OG 3.43Å; I889-V930 HydrophobicContact CG2-CG2 3.62Å
890	E	82.1	Confident	79.7	Confident	149 Å²	149	66.3 Å²	66.3	70%	0.696	31%	0.305	S	S	*	.	H	α-helix	trans	-58.5	-35.8	177.5	-63.3	178.7	-174.8	0	0	112.9	R888 Q894	R888-E890 PolarHBondContact O-N 2.75Å; E890-Q894 WeakPolarHBondContact O-CB 3.04Å; E890-Q894 VanDerWaalsContact O-CG 3.22Å; E890-Q894 WeakPolarHBondContact O-CG 3.5Å; E890-Q894 PolarHBondContact O-N 2.86Å
891	Q	82.1	Confident	78.9	Confident	91 Å²	91	66.6 Å²	66.6	43%	0.425	31%	0.307	S	S	.	.	H	α-helix	trans	-73.2	-36.2	178.1	-61.6	-177.6	8	0	0	111	L883 R888 I889 L895	L883-Q891 HydrophobicContact CD1-CB 4.45Å; L883-Q891 HydrophobicContact CD2-CB 4.25Å; R888-Q891 HydrophobicContact CB-CB 4.12Å; R888-Q891 HydrophobicContact CB-CG 4.32Å; R888-Q891 PolarHBondContact O-N 3Å; R888-Q891 VanDerWaalsContact O-N 3.1Å; I889-Q891 VanDerWaalsContact C-N 3.25Å; I889-Q891 PolarHBondContact O-N 3.25Å; Q891-L895 WeakPolarHBondContact O-CB 3.14Å; Q891-L895 PolarHBondContact O-N 3.47Å
892	A	81.7	Confident	78.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-45.2	172	0	0	0	0	0	111.6	T880 L883 I884 R888 I889 L895 L896 V930	T880-A892 HydrophobicContact CG2-CB 4.14Å; L883-A892 HydrophobicContact CB-CB 4.05Å; I884-A892 HydrophobicContact CG1-CB 4.12Å; R888-A892 PolarHBondContact O-N 2.84Å; I889-A892 WeakPolarHBondContact O-CB 3.46Å; I889-A892 PolarHBondContact O-N 3.43Å; I889-A892 VanDerWaalsContact O-N 3.08Å; A892-L895 PolarHBondContact O-N 3.26Å; A892-L896 WeakPolarHBondContact O-CG 3.34Å; A892-L896 PolarHBondContact O-N 2.71Å; A892-V930 HydrophobicContact CB-CG1 4.46Å
893	E	80.9	Confident	77.5	Confident	56 Å²	56	71.6 Å²	71.6	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-45.4	174.2	-75.1	-167.1	-155.2	0	0	112.6	I889 L895 L896 K897 V930	I889-E893 PolarHBondContact O-N 3.28Å; E893-L895 VanDerWaalsContact C-N 3.27Å; E893-L895 PolarHBondContact O-N 3.25Å; E893-L896 PolarHBondContact O-N 2.89Å; E893-K897 WeakPolarHBondContact O-CB 3.39Å; E893-K897 VanDerWaalsContact O-CG 3.31Å; E893-K897 WeakPolarHBondContact O-CG 3.41Å; E893-K897 PolarHBondContact O-N 2.91Å; E893-K897 IonicContact OE2-NZ 3.4Å; E893-K897 PolarHBondContact OE2-NZ 3.06Å; E893-V930 HydrophobicContact CG-CG2 4.09Å
894	Q	81.2	Confident	76.6	Confident	95 Å²	95	74.5 Å²	74.5	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-35.6	177.1	-76.5	-179.7	35.2	0	0	112	E890 K898	E890-Q894 WeakPolarHBondContact O-CB 3.04Å; E890-Q894 VanDerWaalsContact O-CG 3.22Å; E890-Q894 WeakPolarHBondContact O-CG 3.5Å; E890-Q894 PolarHBondContact O-N 2.86Å; Q894-K898 VanDerWaalsContact O-CB 3.22Å; Q894-K898 WeakPolarHBondContact O-CB 3.49Å; Q894-K898 WeakPolarHBondContact O-CD 3.35Å; Q894-K898 WeakPolarHBondContact O-CG 3.42Å; Q894-K898 PolarHBondContact O-N 3.07Å
895	L	79.9	Confident	75.8	Confident	34 Å²	34	78 Å²	78	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-68.4	-40.8	177	-174.8	119.6	0	0	0	111.3	L876 L879 T880 Q891 A892 E893 R899 I901	L876-L895 HydrophobicContact CD2-CD1 4.31Å; L876-L895 HydrophobicContact CD2-CD2 4.33Å; L876-L895 HydrophobicContact CD2-CG 4.49Å; L879-L895 HydrophobicContact CD2-CD1 3.83Å; L879-L895 HydrophobicContact CG-CD1 4.5Å; T880-L895 WeakPolarHBondContact OG1-CD2 3.33Å; Q891-L895 WeakPolarHBondContact O-CB 3.14Å; Q891-L895 PolarHBondContact O-N 3.47Å; A892-L895 PolarHBondContact O-N 3.26Å; E893-L895 VanDerWaalsContact C-N 3.27Å; E893-L895 PolarHBondContact O-N 3.25Å; L895-R899 PolarHBondContact O-N 3.48Å; L895-R899 VanDerWaalsContact O-N 3.16Å; L895-I901 HydrophobicContact CD2-CD1 3.33Å; L895-I901 HydrophobicContact CG-CD1 3.98Å
896	L	76	Confident	75	Confident	20 Å²	20	79.3 Å²	79.3	11%	0.105	39%	0.392	C	S	.	.	H	α-helix	trans	-69.1	-37.2	173.2	-73.1	162	0	0	0	113.3	T880 A892 E893 K898 I901 F903 V930 M934	T880-L896 HydrophobicContact CG2-CD1 3.96Å; T880-L896 HydrophobicContact CG2-CD2 4.47Å; T880-L896 HydrophobicContact CG2-CG 4.14Å; A892-L896 WeakPolarHBondContact O-CG 3.34Å; A892-L896 PolarHBondContact O-N 2.71Å; E893-L896 PolarHBondContact O-N 2.89Å; L896-K898 VanDerWaalsContact C-N 3.35Å; L896-I901 HydrophobicContact CD2-CB 3.96Å; L896-I901 HydrophobicContact CD2-CD1 4.2Å; L896-I901 HydrophobicContact CD2-CG2 4.48Å; L896-F903 HydrophobicContact CD1-CE2 4.45Å; L896-F903 HydrophobicContact CD1-CZ 4.33Å; L896-F903 HydrophobicContact CD2-CE2 3.69Å; L896-F903 HydrophobicContact CD2-CZ 4.01Å; L896-V930 HydrophobicContact CD1-CG1 3.19Å; L896-M934 HydrophobicContact CD2-CE 4.26Å
897	K	75.3	Confident	74.4	Confident	143 Å²	143	80.4 Å²	80.4	62%	0.622	39%	0.393	S	S	*	.	H	α-helix	trans	-73.5	-24.4	176.5	-74.1	165.9	178.1	161.7	0	113.1	E893	E893-K897 WeakPolarHBondContact O-CB 3.39Å; E893-K897 VanDerWaalsContact O-CG 3.31Å; E893-K897 WeakPolarHBondContact O-CG 3.41Å; E893-K897 PolarHBondContact O-N 2.91Å; E893-K897 IonicContact OE2-NZ 3.4Å; E893-K897 PolarHBondContact OE2-NZ 3.06Å
898	K	72.9	Confident	74.1	Confident	162 Å²	162	73.2 Å²	73.2	70%	0.704	37%	0.367	S	S	*	.	H	α-helix	trans	-91.8	-16.9	178.7	-75	171.3	179.9	168.7	0	113.8	Q894 L896	Q894-K898 VanDerWaalsContact O-CB 3.22Å; Q894-K898 WeakPolarHBondContact O-CB 3.49Å; Q894-K898 WeakPolarHBondContact O-CD 3.35Å; Q894-K898 WeakPolarHBondContact O-CG 3.42Å; Q894-K898 PolarHBondContact O-N 3.07Å; L896-K898 VanDerWaalsContact C-N 3.35Å
899	R	64.5	Low	73.5	Confident	112 Å²	112	71.2 Å²	71.2	42%	0.423	36%	0.363	S	S	.	.	S	Bend	trans	-146.6	128.9	-174.8	-66.7	-176.2	164.2	-144.1	-13.2	110.2	E872 L895 I901	E872-R899 IonicContact OE1-CZ 3.44Å; E872-R899 IonicContact OE1-NH1 3.46Å; E872-R899 PolarHBondContact OE1-NH1 2.93Å; E872-R899 IonicContact OE1-NH2 3.39Å; E872-R899 PolarHBondContact OE1-NH2 3.45Å; L895-R899 PolarHBondContact O-N 3.48Å; L895-R899 VanDerWaalsContact O-N 3.16Å; R899-I901 VanDerWaalsContact C-N 3.27Å; R899-I901 HydrophobicContact CB-CD1 4.21Å; R899-I901 HydrophobicContact CB-CG1 4.04Å; R899-I901 WeakPolarHBondContact O-CG1 3.34Å; R899-I901 PolarHBondContact O-N 3.19Å
900	D	64.7	Low	72.8	Confident	172 Å²	172	70.8 Å²	70.8	92%	0.92	37%	0.367	S	S	*	.			trans	-69.1	79.6	176.5	-61.8	-40.1	0	0	0	111.2	T902	D900-T902 PolarHBondContact O-N 2.83Å
901	I	66.9	Low	72.6	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.036	34%	0.338	C	S	.	.			trans	-88.4	106.2	-176.4	-62.9	159.5	0	0	0	109.8	L876 L895 L896 R899 F903 M934	L876-I901 HydrophobicContact CB-CD1 3.98Å; L876-I901 HydrophobicContact CB-CG1 3.95Å; L876-I901 HydrophobicContact CB-CG2 4.25Å; L876-I901 HydrophobicContact CD1-CD1 4.36Å; L876-I901 HydrophobicContact CD1-CG1 3.92Å; L876-I901 HydrophobicContact CD2-CD1 4.23Å; L876-I901 HydrophobicContact CG-CD1 4.42Å; L876-I901 HydrophobicContact CG-CG1 4.39Å; L895-I901 HydrophobicContact CD2-CD1 3.33Å; L895-I901 HydrophobicContact CG-CD1 3.98Å; L896-I901 HydrophobicContact CD2-CB 3.96Å; L896-I901 HydrophobicContact CD2-CD1 4.2Å; L896-I901 HydrophobicContact CD2-CG2 4.48Å; R899-I901 VanDerWaalsContact C-N 3.27Å; R899-I901 HydrophobicContact CB-CD1 4.21Å; R899-I901 HydrophobicContact CB-CG1 4.04Å; R899-I901 WeakPolarHBondContact O-CG1 3.34Å; R899-I901 PolarHBondContact O-N 3.19Å; I901-F903 PolarHBondContact O-N 3.04Å; I901-M934 VanDerWaalsContact O-CE 3.25Å; I901-M934 WeakPolarHBondContact O-CE 3.33Å
902	T	66.3	Low	72.3	Confident	94 Å²	94	60.3 Å²	60.3	58%	0.577	32%	0.318	S	S	*	.			trans	-72.5	114.9	163.9	49.6	0	0	0	0	109.8	T877 D900 D904	T877-T902 PolarHBondContact OG1-O 3.37Å; D900-T902 PolarHBondContact O-N 2.83Å; T902-D904 PolarHBondContact O-N 2.85Å
903	F	70.4	Confident	71.8	Confident	26 Å²	26	63.7 Å²	63.7	11%	0.114	33%	0.331	C	S	.	.			trans	-69.4	126.6	171.5	-75.2	-90.1	0	0	0	109.9	T877 T880 L881 L896 I901 S905 L908 T931 M934 V937	T877-F903 HydrophobicContact CG2-CD1 4.02Å; T880-F903 HydrophobicContact CG2-CE1 4.18Å; T880-F903 HydrophobicContact CG2-CZ 3.86Å; L881-F903 HydrophobicContact CD2-CE1 4.13Å; L881-F903 HydrophobicContact CG-CE1 4.38Å; L896-F903 HydrophobicContact CD1-CE2 4.45Å; L896-F903 HydrophobicContact CD1-CZ 4.33Å; L896-F903 HydrophobicContact CD2-CE2 3.69Å; L896-F903 HydrophobicContact CD2-CZ 4.01Å; I901-F903 PolarHBondContact O-N 3.04Å; F903-S905 PolarHBondContact O-N 2.69Å; F903-L908 HydrophobicContact CB-CD2 4.42Å; F903-L908 HydrophobicContact CD1-CD1 4.13Å; F903-T931 HydrophobicContact CE2-CG2 4.15Å; F903-T931 HydrophobicContact CZ-CG2 4.45Å; F903-M934 HydrophobicContact CD2-CE 3.98Å; F903-M934 HydrophobicContact CE2-CE 4.05Å; F903-V937 HydrophobicContact CD2-CG2 4.16Å
904	D	67.4	Low	71.3	Confident	73 Å²	73	65.9 Å²	65.9	39%	0.39	34%	0.344	S	S	.	.			trans	-64.8	118.2	166.2	167.4	23.7	0	0	0	109.8	T902 G906 Q907 L908	T902-D904 PolarHBondContact O-N 2.85Å; D904-G906 PolarHBondContact O-N 3.22Å; D904-G906 PolarHBondContact OD1-N 3.33Å; D904-Q907 HydrophobicContact CB-CB 4.1Å; D904-Q907 HydrophobicContact CB-CG 4.3Å; D904-Q907 PolarHBondContact O-N 3.05Å; D904-Q907 VanDerWaalsContact OD2-CG 3.26Å; D904-Q907 WeakPolarHBondContact OD2-CG 3.2Å; D904-Q907 PolarHBondContact OD2-N 3.06Å; D904-Q907 PolarHBondContact OD2-NE2 2.82Å; D904-L908 PolarHBondContact O-N 2.79Å
905	S	67.2	Low	71.2	Confident	73 Å²	73	63.3 Å²	63.3	51%	0.51	33%	0.331	S	S	.	.	H	α-helix	trans	-55.5	-33.6	-179.7	-177.1	0	0	0	0	112.5	F903 T909	F903-S905 PolarHBondContact O-N 2.69Å; S905-T909 WeakPolarHBondContact O-CB 3.46Å; S905-T909 PolarHBondContact O-N 3.45Å; S905-T909 PolarHBondContact O-OG1 2.8Å
906	G	66.2	Low	70.9	Confident	45 Å²	45	62.1 Å²	62.1	46%	0.464	33%	0.325	S	S	.	.	H	α-helix	trans	-66.3	-47.3	174.7	0	0	0	0	0	112.6	D904 A910	D904-G906 PolarHBondContact O-N 3.22Å; D904-G906 PolarHBondContact OD1-N 3.33Å; G906-A910 VanDerWaalsContact O-CB 3.24Å; G906-A910 WeakPolarHBondContact O-CB 3.46Å; G906-A910 PolarHBondContact O-N 2.96Å
907	Q	69.8	Low	70.5	Confident	43 Å²	43	67.8 Å²	67.8	20%	0.201	35%	0.354	C	S	.	.	H	α-helix	trans	-64.9	-42.6	176.1	-78.6	166.3	68.7	0	0	112.3	S874 T877 D904 F911	S874-Q907 PolarHBondContact OG-NE2 3.27Å; S874-Q907 PolarHBondContact OG-OE1 3.31Å; T877-Q907 HydrophobicContact CG2-CB 4.08Å; D904-Q907 HydrophobicContact CB-CB 4.1Å; D904-Q907 HydrophobicContact CB-CG 4.3Å; D904-Q907 PolarHBondContact O-N 3.05Å; D904-Q907 VanDerWaalsContact OD2-CG 3.26Å; D904-Q907 WeakPolarHBondContact OD2-CG 3.2Å; D904-Q907 PolarHBondContact OD2-N 3.06Å; D904-Q907 PolarHBondContact OD2-NE2 2.82Å; Q907-F911 WeakPolarHBondContact O-CB 3.21Å; Q907-F911 PolarHBondContact O-N 3.29Å
908	L	76.6	Confident	70.3	Confident	19 Å²	19	63.5 Å²	63.5	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-65.9	-45.4	178.1	-170.1	65.5	0	0	0	111.7	L881 F903 D904 F911 C912 L927 V937	L881-L908 HydrophobicContact CD2-CD1 4.09Å; F903-L908 HydrophobicContact CB-CD2 4.42Å; F903-L908 HydrophobicContact CD1-CD1 4.13Å; D904-L908 PolarHBondContact O-N 2.79Å; L908-F911 WeakPolarHBondContact O-CB 3.32Å; L908-F911 PolarHBondContact O-N 3.28Å; L908-C912 PolarHBondContact O-N 3.28Å; L908-C912 PolarHBondContact O-SG 3.31Å; L908-C912 VanDerWaalsContact O-SG 3.37Å; L908-L927 HydrophobicContact CD1-CD1 4.06Å; L908-L927 HydrophobicContact CD1-CD2 3.86Å; L908-V937 HydrophobicContact CD2-CG1 3.85Å; L908-V937 HydrophobicContact CD2-CG2 4.38Å
909	T	70	Confident	70.2	Confident	26 Å²	26	60.3 Å²	60.3	16%	0.16	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-43.6	176.9	-64.8	0	0	0	0	111.7	S905 F911 C912 R913	S905-T909 WeakPolarHBondContact O-CB 3.46Å; S905-T909 PolarHBondContact O-N 3.45Å; S905-T909 PolarHBondContact O-OG1 2.8Å; T909-F911 VanDerWaalsContact C-N 3.32Å; T909-F911 PolarHBondContact O-N 3.4Å; T909-C912 PolarHBondContact O-N 3.23Å; T909-R913 WeakPolarHBondContact O-CB 3.09Å; T909-R913 WeakPolarHBondContact O-CG 3.26Å; T909-R913 PolarHBondContact O-N 2.93Å
910	A	66.4	Low	70.8	Confident	46 Å²	46	59.7 Å²	59.7	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-39.4	174.8	0	0	0	0	0	111.8	G906 N914	G906-A910 VanDerWaalsContact O-CB 3.24Å; G906-A910 WeakPolarHBondContact O-CB 3.46Å; G906-A910 PolarHBondContact O-N 2.96Å; A910-N914 WeakPolarHBondContact O-CB 3.38Å; A910-N914 PolarHBondContact O-N 2.98Å; A910-N914 PolarHBondContact O-ND2 2.7Å
911	F	78.7	Confident	71.5	Confident	19 Å²	19	53.1 Å²	53.1	8%	0.083	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-54.4	174.1	-176.2	-91.8	0	0	0	111.4	L881 I884 S885 Q907 L908 T909 R913 N914 R915	L881-F911 HydrophobicContact CB-CD2 3.91Å; L881-F911 HydrophobicContact CB-CE2 3.92Å; L881-F911 HydrophobicContact CD1-CB 4.1Å; L881-F911 HydrophobicContact CD1-CD2 4.22Å; L881-F911 HydrophobicContact CD1-CG 4.25Å; L881-F911 HydrophobicContact CD2-CB 4.35Å; L881-F911 HydrophobicContact CD2-CD1 3.92Å; L881-F911 HydrophobicContact CD2-CD2 4.06Å; L881-F911 HydrophobicContact CD2-CE1 4.19Å; L881-F911 HydrophobicContact CD2-CE2 4.31Å; L881-F911 HydrophobicContact CD2-CG 3.86Å; L881-F911 HydrophobicContact CD2-CZ 4.38Å; L881-F911 HydrophobicContact CG-CD2 4.28Å; L881-F911 HydrophobicContact CG-CG 4.44Å; I884-F911 HydrophobicContact CG2-CZ 4.41Å; S885-F911 WeakPolarHBondContact OG-CE2 3.33Å; Q907-F911 WeakPolarHBondContact O-CB 3.21Å; Q907-F911 PolarHBondContact O-N 3.29Å; L908-F911 WeakPolarHBondContact O-CB 3.32Å; L908-F911 PolarHBondContact O-N 3.28Å; T909-F911 VanDerWaalsContact C-N 3.32Å; T909-F911 PolarHBondContact O-N 3.4Å; F911-R913 PolarHBondContact O-N 3.42Å; F911-N914 PolarHBondContact O-N 3.19Å; F911-N914 VanDerWaalsContact O-N 3.16Å; F911-R915 HydrophobicContact CD1-CG 4.08Å; F911-R915 HydrophobicContact CE1-CG 3.78Å; F911-R915 HydrophobicContact CZ-CG 4.01Å; F911-R915 WeakPolarHBondContact O-CG 3.2Å; F911-R915 PolarHBondContact O-N 2.97Å
912	C	76.1	Confident	72.3	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.014	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-45.9	-179.4	-69.2	0	0	0	0	112.2	L908 T909 N914 R915 V916 L924 Y945	L908-C912 PolarHBondContact O-N 3.28Å; L908-C912 PolarHBondContact O-SG 3.31Å; L908-C912 VanDerWaalsContact O-SG 3.37Å; T909-C912 PolarHBondContact O-N 3.23Å; C912-N914 PolarHBondContact O-N 3.3Å; C912-R915 PolarHBondContact O-N 2.78Å; C912-R915 VanDerWaalsContact O-N 3.14Å; C912-V916 WeakPolarHBondContact O-CG2 3.47Å; C912-V916 PolarHBondContact O-N 3.03Å; C912-L924 HydrophobicContact CB-CD2 4.17Å; C912-Y945 HydrophobicContact CB-CD1 4.49Å; C912-Y945 HydrophobicContact CB-CD2 3.63Å; C912-Y945 HydrophobicContact CB-CE2 3.7Å; C912-Y945 HydrophobicContact CB-CG 4.06Å
913	R	69.9	Low	73.1	Confident	71 Å²	71	56.6 Å²	56.6	27%	0.268	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-48.3	174.6	-73.7	178.6	-176.9	171.3	4.8	112.2	T909 F911 R915 V916 L917 Y945 S1022	T909-R913 WeakPolarHBondContact O-CB 3.09Å; T909-R913 WeakPolarHBondContact O-CG 3.26Å; T909-R913 PolarHBondContact O-N 2.93Å; F911-R913 PolarHBondContact O-N 3.42Å; R913-R915 PolarHBondContact O-N 3.07Å; R913-V916 PolarHBondContact O-N 3.27Å; R913-L917 WeakPolarHBondContact O-CB 3.33Å; R913-L917 WeakPolarHBondContact O-CG 3.4Å; R913-L917 PolarHBondContact O-N 3.21Å; R913-Y945 HydrophobicContact CG-CE1 4.31Å; R913-S1022 PolarHBondContact NH2-O 3.22Å; R913-S1022 PolarHBondContact NH2-OG 3.48Å; R913-S1022 VanDerWaalsContact NH2-OG 3.13Å
914	N	71.2	Confident	73.8	Confident	101 Å²	101	55.7 Å²	55.7	54%	0.54	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-27.7	178.4	-71.7	-19.1	0	0	0	112.6	A910 F911 C912 A918	A910-N914 WeakPolarHBondContact O-CB 3.38Å; A910-N914 PolarHBondContact O-N 2.98Å; A910-N914 PolarHBondContact O-ND2 2.7Å; F911-N914 PolarHBondContact O-N 3.19Å; F911-N914 VanDerWaalsContact O-N 3.16Å; C912-N914 PolarHBondContact O-N 3.3Å; N914-A918 WeakPolarHBondContact O-CB 3.33Å; N914-A918 PolarHBondContact O-N 2.94Å; N914-A918 VanDerWaalsContact O-N 3.14Å
915	R	79.7	Confident	74.6	Confident	41 Å²	41	54.7 Å²	54.7	16%	0.155	30%	0.302	C	S	.	.	H	α-helix	trans	-82.9	-33.9	175.5	-60.1	-55	155.5	137.9	-2.1	114	S885 F911 C912 R913 A918 S919 K920 D923 L924	S885-R915 VanDerWaalsContact OG-CZ 3.28Å; S885-R915 PolarHBondContact OG-NH1 3.42Å; S885-R915 VanDerWaalsContact OG-NH1 3.14Å; S885-R915 PolarHBondContact OG-NH2 2.68Å; F911-R915 HydrophobicContact CD1-CG 4.08Å; F911-R915 HydrophobicContact CE1-CG 3.78Å; F911-R915 HydrophobicContact CZ-CG 4.01Å; F911-R915 WeakPolarHBondContact O-CG 3.2Å; F911-R915 PolarHBondContact O-N 2.97Å; C912-R915 PolarHBondContact O-N 2.78Å; C912-R915 VanDerWaalsContact O-N 3.14Å; R913-R915 PolarHBondContact O-N 3.07Å; R915-A918 CarbonylContact O-C 3.51Å; R915-A918 PolarHBondContact O-N 3.24Å; R915-S919 PolarHBondContact O-N 3.45Å; R915-S919 VanDerWaalsContact O-N 3.08Å; R915-K920 HydrophobicContact CB-CB 4.24Å; R915-K920 PolarHBondContact O-N 3.45Å; R915-D923 WeakPolarHBondContact CD-OD2 3.31Å; R915-D923 HydrophobicContact CG-CB 4.21Å; R915-D923 IonicContact CZ-OD2 2.84Å; R915-D923 IonicContact NE-OD2 2.7Å; R915-D923 IonicContact NH1-OD2 2.66Å; R915-D923 PolarHBondContact NH1-OD2 3.43Å; R915-L924 HydrophobicContact CB-CD2 4.15Å; R915-L924 HydrophobicContact CB-CG 4.3Å
916	V	73.2	Confident	75.5	Confident	9 Å²	9	52 Å²	52	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-46.7	169.9	174.1	0	0	0	0	110.4	C912 R913 A918 S919 L924 Y945 I948 Y1020	C912-V916 WeakPolarHBondContact O-CG2 3.47Å; C912-V916 PolarHBondContact O-N 3.03Å; R913-V916 PolarHBondContact O-N 3.27Å; V916-A918 VanDerWaalsContact C-N 3.3Å; V916-A918 PolarHBondContact O-N 3.35Å; V916-S919 PolarHBondContact O-N 3.43Å; V916-S919 VanDerWaalsContact O-N 3.15Å; V916-L924 HydrophobicContact CG2-CD1 3.83Å; V916-Y945 HydrophobicContact CG2-CD1 4.02Å; V916-Y945 HydrophobicContact CG2-CG 4.49Å; V916-I948 HydrophobicContact CG1-CG2 3.74Å; V916-Y1020 HydrophobicContact CG1-CE1 4.18Å
917	L	66.7	Low	76.4	Confident	139 Å²	139	50 Å²	50	73%	0.728	26%	0.262	S	S	*	.	H	α-helix	trans	-64.8	-30.3	176.9	-69.2	172.9	0	0	0	113.4	R913	R913-L917 WeakPolarHBondContact O-CB 3.33Å; R913-L917 WeakPolarHBondContact O-CG 3.4Å; R913-L917 PolarHBondContact O-N 3.21Å
918	A	71.4	Confident	77.1	Confident	54 Å²	54	48.2 Å²	48.2	45%	0.446	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	8.6	175.8	0	0	0	0	0	113.9	N914 R915 V916 K920	N914-A918 WeakPolarHBondContact O-CB 3.33Å; N914-A918 PolarHBondContact O-N 2.94Å; N914-A918 VanDerWaalsContact O-N 3.14Å; R915-A918 CarbonylContact O-C 3.51Å; R915-A918 PolarHBondContact O-N 3.24Å; V916-A918 VanDerWaalsContact C-N 3.3Å; V916-A918 PolarHBondContact O-N 3.35Å; A918-K920 HydrophobicContact CB-CD 4.39Å; A918-K920 HydrophobicContact CB-CG 4.11Å; A918-K920 WeakPolarHBondContact O-CG 3.23Å; A918-K920 PolarHBondContact O-N 3.26Å; A918-K920 VanDerWaalsContact O-N 3.14Å
919	S	70.4	Confident	77.5	Confident	94 Å²	94	50.8 Å²	50.8	66%	0.657	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	29.8	-177.7	-58.8	0	0	0	0	115.3	R915 V916 V921	R915-S919 PolarHBondContact O-N 3.45Å; R915-S919 VanDerWaalsContact O-N 3.08Å; V916-S919 PolarHBondContact O-N 3.43Å; V916-S919 VanDerWaalsContact O-N 3.15Å; S919-V921 VanDerWaalsContact C-N 3.35Å; S919-V921 PolarHBondContact O-N 3.33Å; S919-V921 VanDerWaalsContact O-N 3.13Å
920	K	77.9	Confident	78.1	Confident	100 Å²	100	50.1 Å²	50.1	44%	0.435	27%	0.267	S	S	.	.			trans	-89.7	63.3	-177.7	-64.8	-170.6	179.7	-179.4	0	112.2	R915 A918 R922 D923	R915-K920 HydrophobicContact CB-CB 4.24Å; R915-K920 PolarHBondContact O-N 3.45Å; A918-K920 HydrophobicContact CB-CD 4.39Å; A918-K920 HydrophobicContact CB-CG 4.11Å; A918-K920 WeakPolarHBondContact O-CG 3.23Å; A918-K920 PolarHBondContact O-N 3.26Å; A918-K920 VanDerWaalsContact O-N 3.14Å; K920-R922 VanDerWaalsContact C-N 3.29Å; K920-R922 PolarHBondContact O-N 3.39Å; K920-D923 HydrophobicContact CB-CB 4.35Å; K920-D923 WeakPolarHBondContact CD-OD2 3.2Å; K920-D923 WeakPolarHBondContact O-CB 3.23Å; K920-D923 PolarHBondContact O-N 3.16Å; K920-D923 VanDerWaalsContact O-N 3.09Å
921	V	80.1	Confident	78.8	Confident	33 Å²	33	48 Å²	48	20%	0.2	25%	0.249	C	C	.	.	H	α-helix	trans	-54.7	-41.8	-175.6	-165.2	0	0	0	0	112.8	S919 D923 L924 E925 L946 A949 Y950	S919-V921 VanDerWaalsContact C-N 3.35Å; S919-V921 PolarHBondContact O-N 3.33Å; S919-V921 VanDerWaalsContact O-N 3.13Å; V921-D923 PolarHBondContact O-N 3.27Å; V921-L924 WeakPolarHBondContact O-CA 3.39Å; V921-L924 WeakPolarHBondContact O-CB 3.07Å; V921-L924 PolarHBondContact O-N 3.12Å; V921-E925 HydrophobicContact CG1-CG 4.42Å; V921-E925 PolarHBondContact O-N 2.79Å; V921-L946 HydrophobicContact CG1-CD1 4.2Å; V921-A949 HydrophobicContact CG1-CB 4.02Å; V921-A949 HydrophobicContact CG2-CB 4.08Å; V921-Y950 HydrophobicContact CG1-CD1 4Å; V921-Y950 HydrophobicContact CG1-CE1 3.68Å
922	R	83.4	Confident	78.8	Confident	161 Å²	161	55.1 Å²	55.1	61%	0.608	28%	0.275	S	S	*	.	H	α-helix	trans	-60	-29.4	180	-62.6	-175.3	-172.1	177.6	3.7	113.8	K920 L924 S926	K920-R922 VanDerWaalsContact C-N 3.29Å; K920-R922 PolarHBondContact O-N 3.39Å; R922-L924 VanDerWaalsContact C-N 3.31Å; R922-S926 VanDerWaalsContact O-CB 3.29Å; R922-S926 WeakPolarHBondContact O-CB 3.33Å; R922-S926 PolarHBondContact O-N 3.14Å; R922-S926 PolarHBondContact O-OG 2.99Å
923	D	83.1	Confident	78.6	Confident	13 Å²	13	61 Å²	61	7%	0.07	31%	0.307	C	S	.	.	H	α-helix	trans	-71.8	-31.7	178.4	-60.3	2.1	0	0	0	110.2	R915 K920 V921 L927	R915-D923 WeakPolarHBondContact CD-OD2 3.31Å; R915-D923 HydrophobicContact CG-CB 4.21Å; R915-D923 IonicContact CZ-OD2 2.84Å; R915-D923 IonicContact NE-OD2 2.7Å; R915-D923 IonicContact NH1-OD2 2.66Å; R915-D923 PolarHBondContact NH1-OD2 3.43Å; K920-D923 HydrophobicContact CB-CB 4.35Å; K920-D923 WeakPolarHBondContact CD-OD2 3.2Å; K920-D923 WeakPolarHBondContact O-CB 3.23Å; K920-D923 PolarHBondContact O-N 3.16Å; K920-D923 VanDerWaalsContact O-N 3.09Å; V921-D923 PolarHBondContact O-N 3.27Å; D923-L927 WeakPolarHBondContact O-CB 3.19Å; D923-L927 PolarHBondContact O-N 3.04Å
924	L	84.1	Confident	78.8	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-76.3	-41.4	174.7	-58.5	172.8	0	0	0	111.8	C912 R915 V916 V921 R922 S926 L927 L928 L946 A949	C912-L924 HydrophobicContact CB-CD2 4.17Å; R915-L924 HydrophobicContact CB-CD2 4.15Å; R915-L924 HydrophobicContact CB-CG 4.3Å; V916-L924 HydrophobicContact CG2-CD1 3.83Å; V921-L924 WeakPolarHBondContact O-CA 3.39Å; V921-L924 WeakPolarHBondContact O-CB 3.07Å; V921-L924 PolarHBondContact O-N 3.12Å; R922-L924 VanDerWaalsContact C-N 3.31Å; L924-S926 VanDerWaalsContact C-N 3.32Å; L924-S926 PolarHBondContact O-N 2.83Å; L924-L927 PolarHBondContact O-N 3.36Å; L924-L928 WeakPolarHBondContact O-CB 3.21Å; L924-L928 PolarHBondContact O-N 3.29Å; L924-L946 HydrophobicContact CB-CD1 4.29Å; L924-A949 HydrophobicContact CD1-CB 4.21Å
925	E	85.4	Confident	78.5	Confident	51 Å²	51	61.2 Å²	61.2	24%	0.238	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-40.8	173.3	-67.3	169.9	162.3	0	0	111.7	V921 L928 T929 L946 Y950	V921-E925 HydrophobicContact CG1-CG 4.42Å; V921-E925 PolarHBondContact O-N 2.79Å; E925-L928 PolarHBondContact O-N 2.92Å; E925-T929 PolarHBondContact O-N 3.2Å; E925-T929 VanDerWaalsContact O-N 3.17Å; E925-T929 PolarHBondContact O-OG1 3.47Å; E925-L946 HydrophobicContact CG-CD1 3.73Å; E925-Y950 PolarHBondContact OE1-OH 2.99Å
926	S	85.5	Confident	77.8	Confident	18 Å²	18	63.2 Å²	63.2	13%	0.126	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-45.1	174.7	-58	0	0	0	0	110.8	I889 R922 L924 L928 T929 V930	I889-S926 WeakPolarHBondContact CD1-OG 3.43Å; R922-S926 VanDerWaalsContact O-CB 3.29Å; R922-S926 WeakPolarHBondContact O-CB 3.33Å; R922-S926 PolarHBondContact O-N 3.14Å; R922-S926 PolarHBondContact O-OG 2.99Å; L924-S926 VanDerWaalsContact C-N 3.32Å; L924-S926 PolarHBondContact O-N 2.83Å; S926-L928 PolarHBondContact O-N 3.32Å; S926-T929 PolarHBondContact O-N 3.49Å; S926-V930 WeakPolarHBondContact O-CB 3.47Å; S926-V930 WeakPolarHBondContact O-CG2 3.37Å; S926-V930 PolarHBondContact O-N 3.02Å
927	L	85.7	Confident	77.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-59.1	-45.9	176.3	-179.9	65	0	0	0	111.9	I884 L908 D923 L924 T929 V930 T931 L942	I884-L927 HydrophobicContact CD1-CD1 3.77Å; L908-L927 HydrophobicContact CD1-CD1 4.06Å; L908-L927 HydrophobicContact CD1-CD2 3.86Å; D923-L927 WeakPolarHBondContact O-CB 3.19Å; D923-L927 PolarHBondContact O-N 3.04Å; L924-L927 PolarHBondContact O-N 3.36Å; L927-T929 VanDerWaalsContact C-N 3.3Å; L927-T929 PolarHBondContact O-N 3.45Å; L927-V930 PolarHBondContact O-N 3.38Å; L927-T931 HydrophobicContact CD1-CG2 3.88Å; L927-T931 HydrophobicContact CG-CG2 4.5Å; L927-T931 WeakPolarHBondContact O-CG2 3.27Å; L927-T931 PolarHBondContact O-N 3.1Å; L927-T931 PolarHBondContact O-OG1 3.11Å; L927-T931 VanDerWaalsContact O-OG1 3.1Å; L927-L942 HydrophobicContact CD2-CD2 3.82Å; L927-L942 HydrophobicContact CG-CD2 4.36Å
928	L	84.1	Confident	78.1	Confident	7 Å²	7	59.8 Å²	59.8	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-32.1	-179.8	-173.1	131.6	0	0	0	113.4	L924 E925 S926 L942 Y943 L946	L924-L928 WeakPolarHBondContact O-CB 3.21Å; L924-L928 PolarHBondContact O-N 3.29Å; E925-L928 PolarHBondContact O-N 2.92Å; S926-L928 PolarHBondContact O-N 3.32Å; L928-L942 HydrophobicContact CD1-CB 4.02Å; L928-Y943 HydrophobicContact CD1-CD1 3.92Å; L928-Y943 HydrophobicContact CD1-CD2 4.38Å; L928-Y943 HydrophobicContact CD1-CE1 3.78Å; L928-Y943 HydrophobicContact CD1-CE2 4.25Å; L928-Y943 HydrophobicContact CD1-CG 4.21Å; L928-Y943 HydrophobicContact CD2-CE1 4.3Å; L928-L946 HydrophobicContact CD1-CD2 4.43Å
929	T	84	Confident	78.5	Confident	73 Å²	73	59.2 Å²	59.2	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-68.9	-50.4	170.7	-51.7	0	0	0	0	111	E925 S926 L927 T931 R932	E925-T929 PolarHBondContact O-N 3.2Å; E925-T929 VanDerWaalsContact O-N 3.17Å; E925-T929 PolarHBondContact O-OG1 3.47Å; S926-T929 PolarHBondContact O-N 3.49Å; L927-T929 VanDerWaalsContact C-N 3.3Å; L927-T929 PolarHBondContact O-N 3.45Å; T929-T931 VanDerWaalsContact C-N 3.31Å; T929-T931 PolarHBondContact O-N 3Å; T929-R932 WeakPolarHBondContact O-CB 3.47Å; T929-R932 PolarHBondContact O-N 3.45Å
930	V	83	Confident	78.9	Confident	12 Å²	12	56.5 Å²	56.5	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-31.4	-176	169.2	0	0	0	0	112.6	I884 I889 A892 E893 L896 S926 L927	I884-V930 HydrophobicContact CD1-CG1 4.37Å; I889-V930 HydrophobicContact CG2-CG2 3.62Å; A892-V930 HydrophobicContact CB-CG1 4.46Å; E893-V930 HydrophobicContact CG-CG2 4.09Å; L896-V930 HydrophobicContact CD1-CG1 3.19Å; S926-V930 WeakPolarHBondContact O-CB 3.47Å; S926-V930 WeakPolarHBondContact O-CG2 3.37Å; S926-V930 PolarHBondContact O-N 3.02Å; L927-V930 PolarHBondContact O-N 3.38Å
931	T	82.3	Confident	78.9	Confident	2 Å²	2	54 Å²	54	1%	0.012	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	24.6	178	67.7	0	0	0	0	113.5	F903 L927 T929 M934 V937 R939 L942	F903-T931 HydrophobicContact CE2-CG2 4.15Å; F903-T931 HydrophobicContact CZ-CG2 4.45Å; L927-T931 HydrophobicContact CD1-CG2 3.88Å; L927-T931 HydrophobicContact CG-CG2 4.5Å; L927-T931 WeakPolarHBondContact O-CG2 3.27Å; L927-T931 PolarHBondContact O-N 3.1Å; L927-T931 PolarHBondContact O-OG1 3.11Å; L927-T931 VanDerWaalsContact O-OG1 3.1Å; T929-T931 VanDerWaalsContact C-N 3.31Å; T929-T931 PolarHBondContact O-N 3Å; T931-M934 PolarHBondContact O-N 3.43Å; T931-V937 HydrophobicContact CG2-CG2 4.29Å; T931-R939 PolarHBondContact O-NH1 3.08Å; T931-L942 WeakPolarHBondContact OG1-CD1 3.43Å
932	R	76.9	Confident	78.9	Confident	167 Å²	167	53 Å²	53	63%	0.63	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-48.4	179.2	-172.9	-179.5	-172.8	172.9	4.2	112.7	T929 M934	T929-R932 WeakPolarHBondContact O-CB 3.47Å; T929-R932 PolarHBondContact O-N 3.45Å; R932-M934 VanDerWaalsContact C-N 3.29Å; R932-M934 PolarHBondContact O-N 3.18Å
933	D	73.1	Confident	79	Confident	127 Å²	127	45.3 Å²	45.3	68%	0.679	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	13.5	-173.8	-51.5	-36.3	0	0	0	112.6	P935	D933-P935 WeakPolarHBondContact O-CD 3.36Å
934	M	73.3	Confident	79	Confident	42 Å²	42	44.7 Å²	44.7	21%	0.207	25%	0.249	C	C	.	.			trans	-105.7	93.9	-172.4	-72.8	-72.3	-74.3	0	0	111.4	L896 I901 F903 T931 R932 A936 V937	L896-M934 HydrophobicContact CD2-CE 4.26Å; I901-M934 VanDerWaalsContact O-CE 3.25Å; I901-M934 WeakPolarHBondContact O-CE 3.33Å; F903-M934 HydrophobicContact CD2-CE 3.98Å; F903-M934 HydrophobicContact CE2-CE 4.05Å; T931-M934 PolarHBondContact O-N 3.43Å; R932-M934 VanDerWaalsContact C-N 3.29Å; R932-M934 PolarHBondContact O-N 3.18Å; M934-A936 PolarHBondContact O-N 3.48Å; M934-A936 VanDerWaalsContact O-N 3.14Å; M934-V937 HydrophobicContact CB-CG2 4.36Å; M934-V937 PolarHBondContact O-N 2.94Å
935	P	66.1	Low	78.7	Confident	134 Å²	134	44.6 Å²	44.6	87%	0.87	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17	-178.3	26.8	-35.5	0	0	0	113.9	D933 V937	D933-P935 WeakPolarHBondContact O-CD 3.36Å; P935-V937 PolarHBondContact O-N 2.94Å
936	A	65.3	Low	78.7	Confident	82 Å²	82	42.3 Å²	42.3	68%	0.678	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.7	178.6	0	0	0	0	0	114.5	M934	M934-A936 PolarHBondContact O-N 3.48Å; M934-A936 VanDerWaalsContact O-N 3.14Å
937	V	70.6	Confident	78.6	Confident	12 Å²	12	41.5 Å²	41.5	7%	0.073	23%	0.232	C	C	.	.	S	Bend	trans	-115.4	118.3	-178	-177.1	0	0	0	0	110.1	F903 L908 T931 M934 P935 R939 L942	F903-V937 HydrophobicContact CD2-CG2 4.16Å; L908-V937 HydrophobicContact CD2-CG1 3.85Å; L908-V937 HydrophobicContact CD2-CG2 4.38Å; T931-V937 HydrophobicContact CG2-CG2 4.29Å; M934-V937 HydrophobicContact CB-CG2 4.36Å; M934-V937 PolarHBondContact O-N 2.94Å; P935-V937 PolarHBondContact O-N 2.94Å; V937-R939 PolarHBondContact O-N 3.48Å; V937-L942 HydrophobicContact CG1-CD1 3.68Å; V937-L942 HydrophobicContact CG1-CG 4.08Å
938	S	73.7	Confident	78.3	Confident	65 Å²	65	41.4 Å²	41.4	46%	0.455	23%	0.232	S	C	.	.			trans	-62.4	108.1	179.3	176.4	0	0	0	0	111.8	D940 L941 L942	S938-D940 VanDerWaalsContact C-N 3.27Å; S938-D940 PolarHBondContact O-N 2.81Å; S938-L941 PolarHBondContact O-N 3.36Å; S938-L941 PolarHBondContact OG-N 3.09Å; S938-L942 PolarHBondContact O-N 3.44Å; S938-L942 VanDerWaalsContact O-N 3.16Å
939	R	81.1	Confident	78.2	Confident	41 Å²	41	41.4 Å²	41.4	16%	0.155	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-34.6	174.2	-61.4	-168.7	76.1	69.3	0.2	111.5	T931 V937 L941 L942 Y943 E969 F971	T931-R939 PolarHBondContact O-NH1 3.08Å; V937-R939 PolarHBondContact O-N 3.48Å; R939-L941 PolarHBondContact O-N 3.46Å; R939-L942 PolarHBondContact O-N 3.07Å; R939-Y943 HydrophobicContact CB-CD2 4.26Å; R939-Y943 HydrophobicContact CB-CE2 4.31Å; R939-Y943 WeakPolarHBondContact O-CB 3.34Å; R939-Y943 WeakPolarHBondContact O-CD2 3.44Å; R939-Y943 PolarHBondContact O-N 3.15Å; R939-E969 IonicContact CZ-OE1 2.95Å; R939-E969 IonicContact CZ-OE2 2.75Å; R939-E969 IonicContact NE-OE2 3.86Å; R939-E969 PolarHBondContact NE-OE2 3.42Å; R939-E969 IonicContact NH2-OE1 3.8Å; R939-E969 PolarHBondContact NH2-OE1 3.37Å; R939-E969 IonicContact NH2-OE2 3.91Å; R939-E969 PolarHBondContact NH2-OE2 3.06Å; R939-F971 HydrophobicContact CB-CD2 4.3Å; R939-F971 HydrophobicContact CB-CE2 4.04Å
940	D	79	Confident	78.2	Confident	37 Å²	37	38.4 Å²	38.4	20%	0.198	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-46.2	175.1	-171.1	85.5	0	0	0	111.7	S938 Y943 C944 F971 S974 L977	S938-D940 VanDerWaalsContact C-N 3.27Å; S938-D940 PolarHBondContact O-N 2.81Å; D940-Y943 PolarHBondContact O-N 3.37Å; D940-C944 WeakPolarHBondContact O-CB 3.45Å; D940-C944 PolarHBondContact O-N 3Å; D940-C944 PolarHBondContact O-SG 3.23Å; D940-F971 HydrophobicContact CB-CZ 3.86Å; D940-S974 WeakPolarHBondContact OD1-CB 3.47Å; D940-S974 PolarHBondContact OD1-OG 3.42Å; D940-S974 PolarHBondContact OD2-OG 3.42Å; D940-L977 WeakPolarHBondContact OD1-CD1 3.37Å
941	L	76.8	Confident	77.9	Confident	48 Å²	48	38.6 Å²	38.6	25%	0.251	21%	0.213	S	C	.	.	H	α-helix	trans	-67.1	-39.1	179	-176.2	63.7	0	0	0	112	S938 R939 C944 Y945	S938-L941 PolarHBondContact O-N 3.36Å; S938-L941 PolarHBondContact OG-N 3.09Å; R939-L941 PolarHBondContact O-N 3.46Å; L941-C944 WeakPolarHBondContact O-CB 3.44Å; L941-C944 PolarHBondContact O-N 3.18Å; L941-Y945 HydrophobicContact CD1-CD2 4.28Å; L941-Y945 HydrophobicContact CD1-CE2 3.69Å; L941-Y945 HydrophobicContact CD2-CE2 4.2Å; L941-Y945 HydrophobicContact CG-CD2 4.11Å; L941-Y945 HydrophobicContact CG-CE2 3.67Å; L941-Y945 WeakPolarHBondContact O-CD2 3.36Å; L941-Y945 PolarHBondContact O-N 3.45Å; L941-Y945 VanDerWaalsContact O-N 3.08Å
942	L	81.5	Confident	77.4	Confident	11 Å²	11	42.1 Å²	42.1	6%	0.058	23%	0.231	C	C	.	.	H	α-helix	trans	-66.2	-46.4	174.6	-67.3	-177.2	0	0	0	111.9	L927 L928 T931 V937 S938 R939 C944 Y945 L946	L927-L942 HydrophobicContact CD2-CD2 3.82Å; L927-L942 HydrophobicContact CG-CD2 4.36Å; L928-L942 HydrophobicContact CD1-CB 4.02Å; T931-L942 WeakPolarHBondContact OG1-CD1 3.43Å; V937-L942 HydrophobicContact CG1-CD1 3.68Å; V937-L942 HydrophobicContact CG1-CG 4.08Å; S938-L942 PolarHBondContact O-N 3.44Å; S938-L942 VanDerWaalsContact O-N 3.16Å; R939-L942 PolarHBondContact O-N 3.07Å; L942-C944 VanDerWaalsContact C-N 3.27Å; L942-C944 PolarHBondContact O-N 3.44Å; L942-Y945 PolarHBondContact O-N 3.09Å; L942-L946 WeakPolarHBondContact O-CB 3.2Å; L942-L946 PolarHBondContact O-N 3.02Å
943	Y	85.6	Confident	77.4	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-61.4	-35.3	174.2	-80.7	-61.3	0	0	0	111.6	L928 R939 D940 L946 L947 M966 E969 F971	L928-Y943 HydrophobicContact CD1-CD1 3.92Å; L928-Y943 HydrophobicContact CD1-CD2 4.38Å; L928-Y943 HydrophobicContact CD1-CE1 3.78Å; L928-Y943 HydrophobicContact CD1-CE2 4.25Å; L928-Y943 HydrophobicContact CD1-CG 4.21Å; L928-Y943 HydrophobicContact CD2-CE1 4.3Å; R939-Y943 HydrophobicContact CB-CD2 4.26Å; R939-Y943 HydrophobicContact CB-CE2 4.31Å; R939-Y943 WeakPolarHBondContact O-CB 3.34Å; R939-Y943 WeakPolarHBondContact O-CD2 3.44Å; R939-Y943 PolarHBondContact O-N 3.15Å; D940-Y943 PolarHBondContact O-N 3.37Å; Y943-L946 HydrophobicContact CD1-CD2 4.32Å; Y943-L946 PolarHBondContact O-N 2.92Å; Y943-L947 WeakPolarHBondContact O-CB 3.26Å; Y943-L947 WeakPolarHBondContact O-CG 3.34Å; Y943-L947 PolarHBondContact O-N 2.97Å; Y943-M966 HydrophobicContact CD1-CG 4.23Å; Y943-M966 HydrophobicContact CD1-SD 4.18Å; Y943-M966 HydrophobicContact CD2-CG 4.14Å; Y943-M966 HydrophobicContact CD2-SD 4.49Å; Y943-M966 HydrophobicContact CE1-CG 3.88Å; Y943-M966 HydrophobicContact CE1-SD 4.36Å; Y943-M966 HydrophobicContact CE2-CG 3.78Å; Y943-M966 HydrophobicContact CG-CG 4.37Å; Y943-M966 HydrophobicContact CG-SD 4.26Å; Y943-E969 VanDerWaalsContact OH-CD 3.32Å; Y943-E969 PolarHBondContact OH-OE1 2.75Å; Y943-E969 PolarHBondContact OH-OE2 3.5Å; Y943-F971 HydrophobicContact CD2-CD1 4.49Å; Y943-F971 HydrophobicContact CD2-CE1 4.41Å
944	C	81.5	Confident	77.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-48.7	172.4	-79	0	0	0	0	112.8	D940 L941 L942 L946 L947 I948 R976 L977 I1019	D940-C944 WeakPolarHBondContact O-CB 3.45Å; D940-C944 PolarHBondContact O-N 3Å; D940-C944 PolarHBondContact O-SG 3.23Å; L941-C944 WeakPolarHBondContact O-CB 3.44Å; L941-C944 PolarHBondContact O-N 3.18Å; L942-C944 VanDerWaalsContact C-N 3.27Å; L942-C944 PolarHBondContact O-N 3.44Å; C944-L946 VanDerWaalsContact C-N 3.29Å; C944-L946 PolarHBondContact O-N 2.78Å; C944-L947 PolarHBondContact O-N 3.13Å; C944-I948 WeakPolarHBondContact O-CG1 3.49Å; C944-I948 PolarHBondContact O-N 3.16Å; C944-R976 PolarHBondContact SG-NE 3.21Å; C944-L977 HydrophobicContact CB-CD2 4.45Å; C944-L977 VanDerWaalsContact SG-CD2 3.55Å; C944-I1019 HydrophobicContact CB-CG2 3.62Å
945	Y	79.5	Confident	77.8	Confident	5 Å²	5	37 Å²	37	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-34.6	176.1	-72.7	-57	0	0	0	112.3	C912 R913 V916 L941 L942 I948 A949 S1022	C912-Y945 HydrophobicContact CB-CD1 4.49Å; C912-Y945 HydrophobicContact CB-CD2 3.63Å; C912-Y945 HydrophobicContact CB-CE2 3.7Å; C912-Y945 HydrophobicContact CB-CG 4.06Å; R913-Y945 HydrophobicContact CG-CE1 4.31Å; V916-Y945 HydrophobicContact CG2-CD1 4.02Å; V916-Y945 HydrophobicContact CG2-CG 4.49Å; L941-Y945 HydrophobicContact CD1-CD2 4.28Å; L941-Y945 HydrophobicContact CD1-CE2 3.69Å; L941-Y945 HydrophobicContact CD2-CE2 4.2Å; L941-Y945 HydrophobicContact CG-CD2 4.11Å; L941-Y945 HydrophobicContact CG-CE2 3.67Å; L941-Y945 WeakPolarHBondContact O-CD2 3.36Å; L941-Y945 PolarHBondContact O-N 3.45Å; L941-Y945 VanDerWaalsContact O-N 3.08Å; L942-Y945 PolarHBondContact O-N 3.09Å; Y945-I948 HydrophobicContact CD1-CD1 4.28Å; Y945-A949 WeakPolarHBondContact O-CB 3.32Å; Y945-A949 PolarHBondContact O-N 2.9Å; Y945-S1022 WeakPolarHBondContact OH-CB 3.41Å; Y945-S1022 PolarHBondContact OH-OG 3.5Å
946	L	85.2	Confident	78.4	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-69.3	-43.5	176.6	-169.2	67.9	0	0	0	112.2	V921 L924 E925 L928 L942 Y943 C944 A949 Y950	V921-L946 HydrophobicContact CG1-CD1 4.2Å; L924-L946 HydrophobicContact CB-CD1 4.29Å; E925-L946 HydrophobicContact CG-CD1 3.73Å; L928-L946 HydrophobicContact CD1-CD2 4.43Å; L942-L946 WeakPolarHBondContact O-CB 3.2Å; L942-L946 PolarHBondContact O-N 3.02Å; Y943-L946 HydrophobicContact CD1-CD2 4.32Å; Y943-L946 PolarHBondContact O-N 2.92Å; C944-L946 VanDerWaalsContact C-N 3.29Å; C944-L946 PolarHBondContact O-N 2.78Å; L946-A949 CarbonylContact O-C 3.58Å; L946-A949 WeakPolarHBondContact O-CB 3.38Å; L946-A949 PolarHBondContact O-N 3.4Å; L946-A949 VanDerWaalsContact O-N 3.16Å; L946-Y950 HydrophobicContact CD1-CE1 3.87Å; L946-Y950 HydrophobicContact CD1-CE2 4.25Å; L946-Y950 HydrophobicContact CD2-CE2 3.85Å; L946-Y950 HydrophobicContact CG-CD2 4.25Å; L946-Y950 HydrophobicContact CG-CE1 4.14Å; L946-Y950 HydrophobicContact CG-CE2 3.64Å; L946-Y950 PolarHBondContact O-N 3.05Å
947	L	83.3	Confident	79.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-33.2	175.9	-70.6	-173.5	0	0	0	112.4	Y943 C944 A949 Y950 R951 A959 A962 L977 L980 F981 I984	Y943-L947 WeakPolarHBondContact O-CB 3.26Å; Y943-L947 WeakPolarHBondContact O-CG 3.34Å; Y943-L947 PolarHBondContact O-N 2.97Å; C944-L947 PolarHBondContact O-N 3.13Å; L947-A949 VanDerWaalsContact C-N 3.33Å; L947-Y950 HydrophobicContact CD2-CD2 4.05Å; L947-Y950 PolarHBondContact O-N 3.13Å; L947-R951 VanDerWaalsContact O-CB 3.28Å; L947-R951 WeakPolarHBondContact O-CB 3.21Å; L947-R951 PolarHBondContact O-N 2.74Å; L947-A959 HydrophobicContact CD2-CB 4.09Å; L947-A962 HydrophobicContact CD2-CB 4.25Å; L947-L977 HydrophobicContact CD1-CD2 3.7Å; L947-L980 HydrophobicContact CB-CD1 3.72Å; L947-L980 HydrophobicContact CB-CD2 3.98Å; L947-L980 HydrophobicContact CB-CG 4.3Å; L947-L980 HydrophobicContact CD1-CB 3.99Å; L947-L980 HydrophobicContact CD1-CD1 4.09Å; L947-F981 HydrophobicContact CD1-CD1 4.32Å; L947-F981 HydrophobicContact CD1-CD2 4.45Å; L947-F981 HydrophobicContact CD1-CE1 3.93Å; L947-F981 HydrophobicContact CD1-CE2 4.08Å; L947-F981 HydrophobicContact CD1-CZ 3.81Å; L947-F981 HydrophobicContact CD2-CE1 3.91Å; L947-F981 HydrophobicContact CD2-CZ 4.33Å; L947-I984 HydrophobicContact CB-CD1 4.25Å; L947-I984 HydrophobicContact CD2-CD1 4.12Å
948	I	79.2	Confident	80	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-48.2	165.7	-69.5	159.7	0	0	0	109.9	V916 C944 Y945 Y950 R951 N952 I1019 Y1020	V916-I948 HydrophobicContact CG1-CG2 3.74Å; C944-I948 WeakPolarHBondContact O-CG1 3.49Å; C944-I948 PolarHBondContact O-N 3.16Å; Y945-I948 HydrophobicContact CD1-CD1 4.28Å; I948-Y950 PolarHBondContact O-N 3.43Å; I948-R951 PolarHBondContact O-N 2.92Å; I948-N952 WeakPolarHBondContact O-CB 3.24Å; I948-N952 PolarHBondContact O-N 2.73Å; I948-N952 PolarHBondContact O-OD1 3.24Å; I948-I1019 HydrophobicContact CD1-CB 3.75Å; I948-I1019 HydrophobicContact CD1-CG2 3.36Å; I948-I1019 HydrophobicContact CG1-CB 3.86Å; I948-I1019 HydrophobicContact CG1-CD1 4.33Å; I948-I1019 HydrophobicContact CG1-CG2 3.57Å; I948-Y1020 HydrophobicContact CD1-CD1 4.2Å; I948-Y1020 HydrophobicContact CD1-CE1 4.2Å; I948-Y1020 HydrophobicContact CG2-CE1 3.94Å; I948-Y1020 WeakPolarHBondContact CG2-OH 3.32Å
949	A	80.6	Confident	80.5	Confident	7 Å²	7	36.2 Å²	36.2	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-41.8	-179.1	0	0	0	0	0	111.8	V921 L924 Y945 L946 L947 N952 S953	V921-A949 HydrophobicContact CG1-CB 4.02Å; V921-A949 HydrophobicContact CG2-CB 4.08Å; L924-A949 HydrophobicContact CD1-CB 4.21Å; Y945-A949 WeakPolarHBondContact O-CB 3.32Å; Y945-A949 PolarHBondContact O-N 2.9Å; L946-A949 CarbonylContact O-C 3.58Å; L946-A949 WeakPolarHBondContact O-CB 3.38Å; L946-A949 PolarHBondContact O-N 3.4Å; L946-A949 VanDerWaalsContact O-N 3.16Å; L947-A949 VanDerWaalsContact C-N 3.33Å; A949-N952 PolarHBondContact O-N 2.82Å; A949-S953 WeakPolarHBondContact O-CB 3.44Å; A949-S953 PolarHBondContact O-N 2.98Å; A949-S953 VanDerWaalsContact O-N 3.09Å; A949-S953 PolarHBondContact O-OG 3.05Å
950	Y	84	Confident	80.7	Confident	10 Å²	10	35 Å²	35	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-66	-40.1	175.1	-65.8	-19.9	0	0	0	112.6	V921 E925 L946 L947 I948 S953 M954 N955 N958 A962	V921-Y950 HydrophobicContact CG1-CD1 4Å; V921-Y950 HydrophobicContact CG1-CE1 3.68Å; E925-Y950 PolarHBondContact OE1-OH 2.99Å; L946-Y950 HydrophobicContact CD1-CE1 3.87Å; L946-Y950 HydrophobicContact CD1-CE2 4.25Å; L946-Y950 HydrophobicContact CD2-CE2 3.85Å; L946-Y950 HydrophobicContact CG-CD2 4.25Å; L946-Y950 HydrophobicContact CG-CE1 4.14Å; L946-Y950 HydrophobicContact CG-CE2 3.64Å; L946-Y950 PolarHBondContact O-N 3.05Å; L947-Y950 HydrophobicContact CD2-CD2 4.05Å; L947-Y950 PolarHBondContact O-N 3.13Å; I948-Y950 PolarHBondContact O-N 3.43Å; Y950-S953 WeakPolarHBondContact CA-OG 3.43Å; Y950-S953 CarbonylContact O-C 2.81Å; Y950-S953 WeakPolarHBondContact O-CA 3.31Å; Y950-S953 PolarHBondContact O-N 3.44Å; Y950-S953 VanDerWaalsContact O-N 3.16Å; Y950-S953 PolarHBondContact O-OG 3.42Å; Y950-M954 PolarHBondContact O-N 3.23Å; Y950-N955 PolarHBondContact O-N 3.12Å; Y950-N958 HydrophobicContact CD1-CB 3.85Å; Y950-N958 HydrophobicContact CD2-CB 3.77Å; Y950-N958 HydrophobicContact CE1-CB 3.75Å; Y950-N958 WeakPolarHBondContact CE1-ND2 3.29Å; Y950-N958 HydrophobicContact CE2-CB 3.67Å; Y950-N958 WeakPolarHBondContact CE2-O 3.3Å; Y950-N958 HydrophobicContact CG-CB 3.87Å; Y950-A962 HydrophobicContact CE2-CB 4.23Å
951	R	77.2	Confident	81	Confident	16 Å²	16	37.2 Å²	37.2	6%	0.06	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-48.3	173	-171.7	-170.4	171	-84.3	3.2	112.1	L947 I948 S953 M954 I984 E987 E1012	L947-R951 VanDerWaalsContact O-CB 3.28Å; L947-R951 WeakPolarHBondContact O-CB 3.21Å; L947-R951 PolarHBondContact O-N 2.74Å; I948-R951 PolarHBondContact O-N 2.92Å; R951-S953 PolarHBondContact O-N 3.05Å; R951-S953 VanDerWaalsContact O-N 3.08Å; R951-M954 PolarHBondContact O-N 3.16Å; R951-I984 HydrophobicContact CB-CD1 4.27Å; R951-I984 HydrophobicContact CB-CG1 3.97Å; R951-I984 HydrophobicContact CG-CG1 4.19Å; R951-E987 WeakPolarHBondContact CG-OE2 3.47Å; R951-E987 IonicContact CZ-OE1 2.75Å; R951-E987 VanDerWaalsContact CZ-OE1 3.23Å; R951-E987 IonicContact CZ-OE2 2.69Å; R951-E987 IonicContact NE-OE1 3.8Å; R951-E987 PolarHBondContact NE-OE1 2.85Å; R951-E987 IonicContact NE-OE2 3.59Å; R951-E987 PolarHBondContact NE-OE2 3.22Å; R951-E987 IonicContact NH2-OE1 3.62Å; R951-E987 PolarHBondContact NH2-OE1 3.34Å; R951-E987 IonicContact NH2-OE2 3.66Å; R951-E987 PolarHBondContact NH2-OE2 3.04Å; R951-E1012 IonicContact CZ-OE1 2.81Å; R951-E1012 VanDerWaalsContact NH2-CG 3.26Å; R951-E1012 IonicContact NH2-OE1 2.74Å; R951-E1012 PolarHBondContact NH2-OE1 3.5Å
952	N	72.5	Confident	81.5	Confident	76 Å²	76	35 Å²	35	41%	0.406	17%	0.174	S	C	.	.	H	α-helix	trans	-60	-20.4	175	-68.4	-3.1	0	0	0	112.2	I948 A949 Y1020	I948-N952 WeakPolarHBondContact O-CB 3.24Å; I948-N952 PolarHBondContact O-N 2.73Å; I948-N952 PolarHBondContact O-OD1 3.24Å; A949-N952 PolarHBondContact O-N 2.82Å; N952-Y1020 PolarHBondContact ND2-OH 3.16Å
953	S	77.6	Confident	81.6	Confident	63 Å²	63	35.1 Å²	35.1	44%	0.441	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	3.4	173.2	74.7	0	0	0	0	115.2	A949 Y950 R951 N955	A949-S953 WeakPolarHBondContact O-CB 3.44Å; A949-S953 PolarHBondContact O-N 2.98Å; A949-S953 VanDerWaalsContact O-N 3.09Å; A949-S953 PolarHBondContact O-OG 3.05Å; Y950-S953 WeakPolarHBondContact CA-OG 3.43Å; Y950-S953 CarbonylContact O-C 2.81Å; Y950-S953 WeakPolarHBondContact O-CA 3.31Å; Y950-S953 PolarHBondContact O-N 3.44Å; Y950-S953 VanDerWaalsContact O-N 3.16Å; Y950-S953 PolarHBondContact O-OG 3.42Å; R951-S953 PolarHBondContact O-N 3.05Å; R951-S953 VanDerWaalsContact O-N 3.08Å; S953-N955 VanDerWaalsContact C-N 3.25Å; S953-N955 PolarHBondContact O-N 3.31Å
954	M	72.5	Confident	81.6	Confident	116 Å²	116	38.2 Å²	38.2	57%	0.571	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	36	-176.3	-67.6	-68.7	-176.7	0	0	114.9	Y950 R951	Y950-M954 PolarHBondContact O-N 3.23Å; R951-M954 PolarHBondContact O-N 3.16Å
955	N	81.2	Confident	81.8	Confident	48 Å²	48	43.5 Å²	43.5	26%	0.257	21%	0.21	S	C	.	.			trans	-107.1	81.8	-171.6	-167.9	-6.7	0	0	0	113.1	Y950 S953 R957 N958 A959	Y950-N955 PolarHBondContact O-N 3.12Å; S953-N955 VanDerWaalsContact C-N 3.25Å; S953-N955 PolarHBondContact O-N 3.31Å; N955-R957 VanDerWaalsContact C-N 3.26Å; N955-R957 PolarHBondContact O-N 2.96Å; N955-R957 PolarHBondContact OD1-N 3.31Å; N955-N958 HydrophobicContact CB-CB 4.39Å; N955-N958 PolarHBondContact ND2-ND2 3.32Å; N955-N958 PolarHBondContact ND2-OD1 3.01Å; N955-N958 PolarHBondContact O-N 3.27Å; N955-N958 PolarHBondContact OD1-N 3.36Å; N955-N958 PolarHBondContact OD1-OD1 3.46Å; N955-A959 PolarHBondContact O-N 3.23Å
956	W	79.2	Confident	82	Confident	77 Å²	77	43.2 Å²	43.2	29%	0.292	21%	0.209	S	C	.	.	H	α-helix	trans	-63.2	-26.7	178.4	70.9	-96.8	0	0	0	114.2	A959 A960 I984 F985 C988 Q990	W956-A959 WeakPolarHBondContact O-CB 3.23Å; W956-A959 PolarHBondContact O-N 3.26Å; W956-A960 PolarHBondContact O-N 3.18Å; W956-I984 HydrophobicContact CB-CG2 4.05Å; W956-F985 HydrophobicContact CE3-CE1 4.25Å; W956-C988 HydrophobicContact CB-CB 3.97Å; W956-C988 HydrophobicContact CG-CB 4.16Å; W956-Q990 HydrophobicContact CD2-CG 4.14Å; W956-Q990 HydrophobicContact CG-CG 4.35Å; W956-Q990 HydrophobicContact CZ2-CG 4.42Å
957	R	84.5	Confident	81.9	Confident	155 Å²	155	47 Å²	47	59%	0.585	23%	0.225	S	C	*	.	H	α-helix	trans	-65.6	-47.9	177.7	-67.9	-169.9	-177.7	97.3	-1	110.7	N955 A959 A960 D961	N955-R957 VanDerWaalsContact C-N 3.26Å; N955-R957 PolarHBondContact O-N 2.96Å; N955-R957 PolarHBondContact OD1-N 3.31Å; R957-A959 PolarHBondContact O-N 3.24Å; R957-A960 CarbonylContact O-C 3.49Å; R957-A960 WeakPolarHBondContact O-CB 3.41Å; R957-A960 PolarHBondContact O-N 3.4Å; R957-D961 PolarHBondContact O-N 2.89Å
958	N	84.7	Confident	81.9	Confident	45 Å²	45	54.4 Å²	54.4	24%	0.241	26%	0.259	C	S	.	.	H	α-helix	trans	-61.8	-28.7	174.6	-76.1	40	0	0	0	112.4	Y950 N955 A962	Y950-N958 HydrophobicContact CD1-CB 3.85Å; Y950-N958 HydrophobicContact CD2-CB 3.77Å; Y950-N958 HydrophobicContact CE1-CB 3.75Å; Y950-N958 WeakPolarHBondContact CE1-ND2 3.29Å; Y950-N958 HydrophobicContact CE2-CB 3.67Å; Y950-N958 WeakPolarHBondContact CE2-O 3.3Å; Y950-N958 HydrophobicContact CG-CB 3.87Å; N955-N958 HydrophobicContact CB-CB 4.39Å; N955-N958 PolarHBondContact ND2-ND2 3.32Å; N955-N958 PolarHBondContact ND2-OD1 3.01Å; N955-N958 PolarHBondContact O-N 3.27Å; N955-N958 PolarHBondContact OD1-N 3.36Å; N955-N958 PolarHBondContact OD1-OD1 3.46Å; N958-A962 WeakPolarHBondContact O-CB 3.4Å; N958-A962 PolarHBondContact O-N 2.55Å
959	A	85.1	Confident	81.9	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70.9	-43.3	170.8	0	0	0	0	0	112.1	L947 N955 W956 R957 D961 A962 W963 F981 I984	L947-A959 HydrophobicContact CD2-CB 4.09Å; N955-A959 PolarHBondContact O-N 3.23Å; W956-A959 WeakPolarHBondContact O-CB 3.23Å; W956-A959 PolarHBondContact O-N 3.26Å; R957-A959 PolarHBondContact O-N 3.24Å; A959-D961 VanDerWaalsContact C-N 3.31Å; A959-D961 PolarHBondContact O-N 2.86Å; A959-A962 WeakPolarHBondContact O-CB 3.28Å; A959-A962 PolarHBondContact O-N 3.5Å; A959-A962 VanDerWaalsContact O-N 3.16Å; A959-W963 PolarHBondContact O-N 3.06Å; A959-F981 HydrophobicContact CB-CD1 4.41Å; A959-F981 HydrophobicContact CB-CE1 4.29Å; A959-F981 WeakPolarHBondContact O-CE1 3.48Å; A959-I984 HydrophobicContact CB-CD1 4.13Å; A959-I984 HydrophobicContact CB-CG2 3.88Å
960	A	84.2	Confident	81.8	Confident	17 Å²	17	63.6 Å²	63.6	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-36.7	172.7	0	0	0	0	0	112.3	W956 R957 W963 N964 F985	W956-A960 PolarHBondContact O-N 3.18Å; R957-A960 CarbonylContact O-C 3.49Å; R957-A960 WeakPolarHBondContact O-CB 3.41Å; R957-A960 PolarHBondContact O-N 3.4Å; A960-W963 WeakPolarHBondContact O-CB 3.5Å; A960-W963 PolarHBondContact O-N 3.21Å; A960-N964 PolarHBondContact O-N 3.24Å; A960-N964 PolarHBondContact O-ND2 3.45Å; A960-F985 HydrophobicContact CB-CZ 4.28Å
961	D	86.3	Confident	81.6	Confident	83 Å²	83	65.5 Å²	65.5	44%	0.444	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-37.7	172.5	-67.2	-27.1	0	0	0	111.8	R957 A959 N964 R965	R957-D961 PolarHBondContact O-N 2.89Å; A959-D961 VanDerWaalsContact C-N 3.31Å; A959-D961 PolarHBondContact O-N 2.86Å; D961-N964 PolarHBondContact O-N 2.99Å; D961-R965 WeakPolarHBondContact O-CG 3.16Å; D961-R965 PolarHBondContact O-N 2.92Å
962	A	85.7	Confident	81.7	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-40.6	171.3	0	0	0	0	0	111.7	L947 Y950 N958 A959 R965 M966	L947-A962 HydrophobicContact CD2-CB 4.25Å; Y950-A962 HydrophobicContact CE2-CB 4.23Å; N958-A962 WeakPolarHBondContact O-CB 3.4Å; N958-A962 PolarHBondContact O-N 2.55Å; A959-A962 WeakPolarHBondContact O-CB 3.28Å; A959-A962 PolarHBondContact O-N 3.5Å; A959-A962 VanDerWaalsContact O-N 3.16Å; A962-R965 PolarHBondContact O-N 2.76Å; A962-M966 WeakPolarHBondContact O-CB 3.44Å; A962-M966 WeakPolarHBondContact O-CG 3.41Å; A962-M966 PolarHBondContact O-N 3.19Å
963	W	85.1	Confident	82	Confident	13 Å²	13	69.2 Å²	69.2	5%	0.049	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-44.8	173	179	-118.5	0	0	0	112	A959 A960 M966 K967 P973 F981 D995 L996 L999	A959-W963 PolarHBondContact O-N 3.06Å; A960-W963 WeakPolarHBondContact O-CB 3.5Å; A960-W963 PolarHBondContact O-N 3.21Å; W963-M966 PolarHBondContact O-N 3.4Å; W963-K967 HydrophobicContact CZ2-CD 4.23Å; W963-K967 HydrophobicContact CZ2-CG 4.43Å; W963-K967 WeakPolarHBondContact O-CG 3.32Å; W963-K967 PolarHBondContact O-N 3.18Å; W963-P973 HydrophobicContact CH2-CG 4.2Å; W963-P973 HydrophobicContact CZ3-CB 4.28Å; W963-P973 HydrophobicContact CZ3-CG 3.81Å; W963-F981 HydrophobicContact CB-CE1 4.14Å; W963-F981 HydrophobicContact CB-CZ 4.08Å; W963-F981 HydrophobicContact CE3-CD2 4.41Å; W963-F981 AromaticContact CE3-CE2 3.81Å; W963-F981 HydrophobicContact CE3-CE2 3.81Å; W963-F981 HydrophobicContact CE3-CZ 4.13Å; W963-F981 HydrophobicContact CZ3-CE2 4.4Å; W963-D995 PolarHBondContact NE1-OD2 3.25Å; W963-L996 HydrophobicContact CD2-CD1 4.43Å; W963-L996 HydrophobicContact CD2-CD2 4.33Å; W963-L996 HydrophobicContact CE3-CD1 4.32Å; W963-L996 HydrophobicContact CG-CD2 4.47Å; W963-L996 HydrophobicContact CH2-CD1 3.96Å; W963-L996 HydrophobicContact CZ2-CB 4.08Å; W963-L996 HydrophobicContact CZ2-CD1 4.05Å; W963-L996 HydrophobicContact CZ3-CD1 4.11Å; W963-L999 HydrophobicContact CH2-CD1 3.88Å; W963-L999 HydrophobicContact CZ2-CD1 4.25Å
964	N	85	Confident	81.9	Confident	66 Å²	66	68 Å²	68	35%	0.353	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-42.2	176.3	-68.9	-31.4	0	0	0	112.3	A960 D961 M966 K967 E968	A960-N964 PolarHBondContact O-N 3.24Å; A960-N964 PolarHBondContact O-ND2 3.45Å; D961-N964 PolarHBondContact O-N 2.99Å; N964-M966 PolarHBondContact O-N 2.85Å; N964-K967 WeakPolarHBondContact O-CB 3.4Å; N964-K967 PolarHBondContact O-N 3.44Å; N964-K967 VanDerWaalsContact OD1-CE 3.27Å; N964-K967 WeakPolarHBondContact OD1-CE 3.38Å; N964-K967 PolarHBondContact OD1-NZ 3.13Å; N964-E968 WeakPolarHBondContact O-CG 3.37Å; N964-E968 PolarHBondContact O-N 3.18Å
965	R	84.8	Confident	81.8	Confident	111 Å²	111	68.8 Å²	68.8	42%	0.419	33%	0.325	S	S	.	.	H	α-helix	trans	-61.8	-41	173.2	-72.4	179.3	-173.8	-171.7	4.4	112.6	D961 A962 K967 E968 E969	D961-R965 WeakPolarHBondContact O-CG 3.16Å; D961-R965 PolarHBondContact O-N 2.92Å; A962-R965 PolarHBondContact O-N 2.76Å; R965-K967 VanDerWaalsContact C-N 3.3Å; R965-K967 PolarHBondContact O-N 3.01Å; R965-E968 PolarHBondContact O-N 3.37Å; R965-E969 WeakPolarHBondContact O-CB 3.47Å; R965-E969 VanDerWaalsContact O-CG 3.29Å; R965-E969 WeakPolarHBondContact O-CG 3.39Å; R965-E969 PolarHBondContact O-N 2.89Å
966	M	85	Confident	81.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-38.6	175.6	-70.5	162.9	71.3	0	0	111.2	Y943 A962 W963 N964 E969 N970 F971 P973 L977 F981	Y943-M966 HydrophobicContact CD1-CG 4.23Å; Y943-M966 HydrophobicContact CD1-SD 4.18Å; Y943-M966 HydrophobicContact CD2-CG 4.14Å; Y943-M966 HydrophobicContact CD2-SD 4.49Å; Y943-M966 HydrophobicContact CE1-CG 3.88Å; Y943-M966 HydrophobicContact CE1-SD 4.36Å; Y943-M966 HydrophobicContact CE2-CG 3.78Å; Y943-M966 HydrophobicContact CG-CG 4.37Å; Y943-M966 HydrophobicContact CG-SD 4.26Å; A962-M966 WeakPolarHBondContact O-CB 3.44Å; A962-M966 WeakPolarHBondContact O-CG 3.41Å; A962-M966 PolarHBondContact O-N 3.19Å; W963-M966 PolarHBondContact O-N 3.4Å; N964-M966 PolarHBondContact O-N 2.85Å; M966-E969 PolarHBondContact O-N 3.42Å; M966-N970 PolarHBondContact O-N 3.23Å; M966-F971 HydrophobicContact CB-CB 4.42Å; M966-F971 HydrophobicContact CB-CD1 4.33Å; M966-F971 HydrophobicContact CE-CD1 3.59Å; M966-F971 HydrophobicContact CE-CE1 3.74Å; M966-F971 HydrophobicContact CG-CD1 4.09Å; M966-F971 PolarHBondContact O-N 3.32Å; M966-P973 HydrophobicContact CE-CB 3.81Å; M966-L977 HydrophobicContact CE-CD1 3.72Å; M966-F981 HydrophobicContact CE-CE2 4.06Å; M966-F981 HydrophobicContact CE-CZ 4.44Å; M966-F981 HydrophobicContact SD-CE2 3.98Å; M966-F981 HydrophobicContact SD-CZ 3.74Å
967	K	82.4	Confident	81.2	Confident	83 Å²	83	65 Å²	65	36%	0.361	31%	0.307	S	S	.	.	H	α-helix	trans	-65.7	-45.5	172.3	-71.9	-176.1	-68.3	-176.2	0	112.9	W963 N964 R965 E969 N970 D995	W963-K967 HydrophobicContact CZ2-CD 4.23Å; W963-K967 HydrophobicContact CZ2-CG 4.43Å; W963-K967 WeakPolarHBondContact O-CG 3.32Å; W963-K967 PolarHBondContact O-N 3.18Å; N964-K967 WeakPolarHBondContact O-CB 3.4Å; N964-K967 PolarHBondContact O-N 3.44Å; N964-K967 VanDerWaalsContact OD1-CE 3.27Å; N964-K967 WeakPolarHBondContact OD1-CE 3.38Å; N964-K967 PolarHBondContact OD1-NZ 3.13Å; R965-K967 VanDerWaalsContact C-N 3.3Å; R965-K967 PolarHBondContact O-N 3.01Å; K967-E969 PolarHBondContact O-N 3.43Å; K967-N970 PolarHBondContact O-N 3.49Å; K967-D995 WeakPolarHBondContact CD-OD2 3.47Å; K967-D995 WeakPolarHBondContact CE-OD2 3.37Å; K967-D995 IonicContact NZ-OD1 2.77Å; K967-D995 IonicContact NZ-OD2 3.49Å; K967-D995 PolarHBondContact NZ-OD2 2.95Å
968	E	82.5	Confident	81	Confident	155 Å²	155	58.5 Å²	58.5	72%	0.724	28%	0.284	S	S	*	.	H	α-helix	trans	-61	-32.9	175.7	-72.4	173.4	-174.3	0	0	112.7	N964 R965 N970	N964-E968 WeakPolarHBondContact O-CG 3.37Å; N964-E968 PolarHBondContact O-N 3.18Å; R965-E968 PolarHBondContact O-N 3.37Å; E968-N970 VanDerWaalsContact C-N 3.3Å
969	E	80.5	Confident	80.5	Confident	55 Å²	55	57.1 Å²	57.1	26%	0.257	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.9	175.4	-69.5	178.4	-171.9	0	0	113.7	R939 Y943 R965 M966 K967 F971	R939-E969 IonicContact CZ-OE1 2.95Å; R939-E969 IonicContact CZ-OE2 2.75Å; R939-E969 IonicContact NE-OE2 3.86Å; R939-E969 PolarHBondContact NE-OE2 3.42Å; R939-E969 IonicContact NH2-OE1 3.8Å; R939-E969 PolarHBondContact NH2-OE1 3.37Å; R939-E969 IonicContact NH2-OE2 3.91Å; R939-E969 PolarHBondContact NH2-OE2 3.06Å; Y943-E969 VanDerWaalsContact OH-CD 3.32Å; Y943-E969 PolarHBondContact OH-OE1 2.75Å; Y943-E969 PolarHBondContact OH-OE2 3.5Å; R965-E969 WeakPolarHBondContact O-CB 3.47Å; R965-E969 VanDerWaalsContact O-CG 3.29Å; R965-E969 WeakPolarHBondContact O-CG 3.39Å; R965-E969 PolarHBondContact O-N 2.89Å; M966-E969 PolarHBondContact O-N 3.42Å; K967-E969 PolarHBondContact O-N 3.43Å; E969-F971 HydrophobicContact CB-CB 4.31Å; E969-F971 PolarHBondContact O-N 2.91Å
970	N	78	Confident	80.1	Confident	145 Å²	145	57.1 Å²	57.1	78%	0.775	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	33.6	-169.9	-57.9	-77.4	0	0	0	113.3	M966 K967 E968	M966-N970 PolarHBondContact O-N 3.23Å; K967-N970 PolarHBondContact O-N 3.49Å; E968-N970 VanDerWaalsContact C-N 3.3Å
971	F	80.4	Confident	80.1	Confident	50 Å²	50	56.3 Å²	56.3	22%	0.219	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-88.6	116.4	-177.8	179.3	-89.5	0	0	0	111.2	R939 D940 Y943 M966 E969 L977	R939-F971 HydrophobicContact CB-CD2 4.3Å; R939-F971 HydrophobicContact CB-CE2 4.04Å; D940-F971 HydrophobicContact CB-CZ 3.86Å; Y943-F971 HydrophobicContact CD2-CD1 4.49Å; Y943-F971 HydrophobicContact CD2-CE1 4.41Å; M966-F971 HydrophobicContact CB-CB 4.42Å; M966-F971 HydrophobicContact CB-CD1 4.33Å; M966-F971 HydrophobicContact CE-CD1 3.59Å; M966-F971 HydrophobicContact CE-CE1 3.74Å; M966-F971 HydrophobicContact CG-CD1 4.09Å; M966-F971 PolarHBondContact O-N 3.32Å; E969-F971 HydrophobicContact CB-CB 4.31Å; E969-F971 PolarHBondContact O-N 2.91Å; F971-L977 HydrophobicContact CE1-CD1 3.75Å; F971-L977 HydrophobicContact CZ-CD1 4.34Å
972	N	79	Confident	79.7	Confident	143 Å²	143	55.5 Å²	55.5	77%	0.765	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-76	123.7	176	-74.5	-23.4	0	0	0	111
973	P	78.7	Confident	79.2	Confident	28 Å²	28	56.1 Å²	56.1	18%	0.182	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-69.6	138.8	-178.9	32	-39.2	0	0	0	112.1	W963 M966 L977 L978	W963-P973 HydrophobicContact CH2-CG 4.2Å; W963-P973 HydrophobicContact CZ3-CB 4.28Å; W963-P973 HydrophobicContact CZ3-CG 3.81Å; M966-P973 HydrophobicContact CE-CB 3.81Å; P973-L977 HydrophobicContact CB-CB 4.1Å; P973-L978 HydrophobicContact CB-CD2 4.07Å; P973-L978 HydrophobicContact CB-CG 4.08Å; P973-L978 HydrophobicContact CG-CD1 4.42Å; P973-L978 HydrophobicContact CG-CD2 3.66Å; P973-L978 HydrophobicContact CG-CG 3.95Å
974	S	75.8	Confident	79	Confident	36 Å²	36	55.6 Å²	55.6	25%	0.252	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-68.1	159.9	165.7	62.6	0	0	0	0	111.7	D940 R976 L977 L978	D940-S974 WeakPolarHBondContact OD1-CB 3.47Å; D940-S974 PolarHBondContact OD1-OG 3.42Å; D940-S974 PolarHBondContact OD2-OG 3.42Å; S974-R976 PolarHBondContact O-N 2.77Å; S974-R976 VanDerWaalsContact O-N 3.11Å; S974-L977 PolarHBondContact O-N 2.8Å; S974-L977 PolarHBondContact OG-N 3.39Å; S974-L978 PolarHBondContact O-N 2.87Å
975	R	70.7	Confident	78.9	Confident	133 Å²	133	52.7 Å²	52.7	50%	0.502	25%	0.248	S	C	.	.	H	α-helix	trans	-53.6	-32.7	173.6	-170.1	179.6	-173	-161.5	0.3	112.1	L978 L979 F1005	R975-L978 PolarHBondContact O-N 3.05Å; R975-L979 HydrophobicContact CG-CD1 4.37Å; R975-L979 WeakPolarHBondContact O-CB 3.41Å; R975-L979 VanDerWaalsContact O-CG 3.3Å; R975-L979 WeakPolarHBondContact O-CG 3.31Å; R975-L979 PolarHBondContact O-N 2.99Å; R975-F1005 HydrophobicContact CG-CE1 4.42Å; R975-F1005 HydrophobicContact CG-CZ 4.23Å
976	R	69.5	Low	78.6	Confident	47 Å²	47	51.1 Å²	51.1	18%	0.177	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-40.9	176	174.2	172.4	144.6	160.4	-4.7	112.4	C944 S974 L980 S1018 I1019	C944-R976 PolarHBondContact SG-NE 3.21Å; S974-R976 PolarHBondContact O-N 2.77Å; S974-R976 VanDerWaalsContact O-N 3.11Å; R976-L980 WeakPolarHBondContact O-CB 3.46Å; R976-L980 PolarHBondContact O-N 2.74Å; R976-S1018 WeakPolarHBondContact CD-O 3.33Å; R976-S1018 PolarHBondContact NH1-O 3.1Å; R976-I1019 HydrophobicContact CG-CG1 4.27Å; R976-I1019 PolarHBondContact NH2-O 2.93Å
977	L	78.4	Confident	78.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.6	-40.2	171.8	-68	175	0	0	0	111.9	D940 C944 L947 M966 F971 P973 S974 L980 F981	D940-L977 WeakPolarHBondContact OD1-CD1 3.37Å; C944-L977 HydrophobicContact CB-CD2 4.45Å; C944-L977 VanDerWaalsContact SG-CD2 3.55Å; L947-L977 HydrophobicContact CD1-CD2 3.7Å; M966-L977 HydrophobicContact CE-CD1 3.72Å; F971-L977 HydrophobicContact CE1-CD1 3.75Å; F971-L977 HydrophobicContact CZ-CD1 4.34Å; P973-L977 HydrophobicContact CB-CB 4.1Å; S974-L977 PolarHBondContact O-N 2.8Å; S974-L977 PolarHBondContact OG-N 3.39Å; L977-L980 HydrophobicContact CD2-CD1 4.25Å; L977-L980 VanDerWaalsContact O-CB 3.25Å; L977-L980 WeakPolarHBondContact O-CB 3.44Å; L977-L980 PolarHBondContact O-N 3.2Å; L977-F981 WeakPolarHBondContact O-CD2 3.47Å; L977-F981 PolarHBondContact O-N 3.35Å
978	L	80.4	Confident	78.1	Confident	18 Å²	18	51 Å²	51	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-61.9	-46.4	175.4	-70.3	176.3	0	0	0	112.5	P973 S974 R975 L980 F981 Q982 L996 L999 L1000	P973-L978 HydrophobicContact CB-CD2 4.07Å; P973-L978 HydrophobicContact CB-CG 4.08Å; P973-L978 HydrophobicContact CG-CD1 4.42Å; P973-L978 HydrophobicContact CG-CD2 3.66Å; P973-L978 HydrophobicContact CG-CG 3.95Å; S974-L978 PolarHBondContact O-N 2.87Å; R975-L978 PolarHBondContact O-N 3.05Å; L978-L980 VanDerWaalsContact C-N 3.31Å; L978-L980 PolarHBondContact O-N 2.92Å; L978-F981 PolarHBondContact O-N 3.14Å; L978-Q982 WeakPolarHBondContact O-CB 3.42Å; L978-Q982 PolarHBondContact O-N 2.68Å; L978-L996 HydrophobicContact CD2-CD1 3.58Å; L978-L999 HydrophobicContact CD2-CB 4.5Å; L978-L1000 HydrophobicContact CB-CD2 4.26Å
979	L	73.8	Confident	77.8	Confident	16 Å²	16	52.5 Å²	52.5	8%	0.084	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-37.3	173.9	-75.9	171.2	0	0	0	112.2	R975 K983 F1005 L1015	R975-L979 HydrophobicContact CG-CD1 4.37Å; R975-L979 WeakPolarHBondContact O-CB 3.41Å; R975-L979 VanDerWaalsContact O-CG 3.3Å; R975-L979 WeakPolarHBondContact O-CG 3.31Å; R975-L979 PolarHBondContact O-N 2.99Å; L979-K983 WeakPolarHBondContact O-CB 3.44Å; L979-K983 PolarHBondContact O-N 3.49Å; L979-F1005 HydrophobicContact CD1-CE1 4.45Å; L979-F1005 HydrophobicContact CD2-CD1 3.78Å; L979-F1005 HydrophobicContact CD2-CE1 3.34Å; L979-F1005 HydrophobicContact CD2-CE2 4.33Å; L979-F1005 HydrophobicContact CD2-CG 4.47Å; L979-F1005 HydrophobicContact CD2-CZ 3.65Å; L979-F1005 HydrophobicContact CG-CE1 3.88Å; L979-F1005 HydrophobicContact CG-CZ 3.9Å; L979-L1015 HydrophobicContact CB-CD1 3.95Å; L979-L1015 HydrophobicContact CB-CD2 3.72Å; L979-L1015 HydrophobicContact CB-CG 4.22Å; L979-L1015 HydrophobicContact CD2-CD1 4.27Å
980	L	76.4	Confident	77.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-46	171.9	-107.4	168.5	0	0	0	112.2	L947 R976 L977 L978 K983 I984 I1019	L947-L980 HydrophobicContact CB-CD1 3.72Å; L947-L980 HydrophobicContact CB-CD2 3.98Å; L947-L980 HydrophobicContact CB-CG 4.3Å; L947-L980 HydrophobicContact CD1-CB 3.99Å; L947-L980 HydrophobicContact CD1-CD1 4.09Å; R976-L980 WeakPolarHBondContact O-CB 3.46Å; R976-L980 PolarHBondContact O-N 2.74Å; L977-L980 HydrophobicContact CD2-CD1 4.25Å; L977-L980 VanDerWaalsContact O-CB 3.25Å; L977-L980 WeakPolarHBondContact O-CB 3.44Å; L977-L980 PolarHBondContact O-N 3.2Å; L978-L980 VanDerWaalsContact C-N 3.31Å; L978-L980 PolarHBondContact O-N 2.92Å; L980-K983 PolarHBondContact O-N 3.09Å; L980-I984 HydrophobicContact CD2-CD1 4.26Å; L980-I984 WeakPolarHBondContact O-CB 3.39Å; L980-I984 VanDerWaalsContact O-CG1 3.27Å; L980-I984 WeakPolarHBondContact O-CG1 3.09Å; L980-I984 PolarHBondContact O-N 3.13Å; L980-I1019 HydrophobicContact CD1-CB 4.38Å; L980-I1019 HydrophobicContact CD1-CD1 3.84Å; L980-I1019 HydrophobicContact CD1-CG1 3.7Å; L980-I1019 HydrophobicContact CD1-CG2 3.76Å; L980-I1019 HydrophobicContact CD2-CD1 3.47Å; L980-I1019 VanDerWaalsContact CD2-CD1 3.47Å; L980-I1019 HydrophobicContact CD2-CG1 4.3Å; L980-I1019 HydrophobicContact CG-CD1 3.44Å; L980-I1019 VanDerWaalsContact CG-CD1 3.44Å; L980-I1019 HydrophobicContact CG-CG1 3.76Å
981	F	83.7	Confident	77.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-53.4	175.1	-75.8	-58.8	0	0	0	111.2	L947 A959 W963 M966 L977 L978 K983 I984 F985 L996	L947-F981 HydrophobicContact CD1-CD1 4.32Å; L947-F981 HydrophobicContact CD1-CD2 4.45Å; L947-F981 HydrophobicContact CD1-CE1 3.93Å; L947-F981 HydrophobicContact CD1-CE2 4.08Å; L947-F981 HydrophobicContact CD1-CZ 3.81Å; L947-F981 HydrophobicContact CD2-CE1 3.91Å; L947-F981 HydrophobicContact CD2-CZ 4.33Å; A959-F981 HydrophobicContact CB-CD1 4.41Å; A959-F981 HydrophobicContact CB-CE1 4.29Å; A959-F981 WeakPolarHBondContact O-CE1 3.48Å; W963-F981 HydrophobicContact CB-CE1 4.14Å; W963-F981 HydrophobicContact CB-CZ 4.08Å; W963-F981 HydrophobicContact CE3-CD2 4.41Å; W963-F981 AromaticContact CE3-CE2 3.81Å; W963-F981 HydrophobicContact CE3-CE2 3.81Å; W963-F981 HydrophobicContact CE3-CZ 4.13Å; W963-F981 HydrophobicContact CZ3-CE2 4.4Å; M966-F981 HydrophobicContact CE-CE2 4.06Å; M966-F981 HydrophobicContact CE-CZ 4.44Å; M966-F981 HydrophobicContact SD-CE2 3.98Å; M966-F981 HydrophobicContact SD-CZ 3.74Å; L977-F981 WeakPolarHBondContact O-CD2 3.47Å; L977-F981 PolarHBondContact O-N 3.35Å; L978-F981 PolarHBondContact O-N 3.14Å; F981-K983 PolarHBondContact O-N 2.87Å; F981-K983 VanDerWaalsContact O-N 3.12Å; F981-I984 PolarHBondContact O-N 3.21Å; F981-I984 VanDerWaalsContact O-N 3.09Å; F981-F985 HydrophobicContact CB-CD2 4.26Å; F981-F985 HydrophobicContact CB-CE2 4.37Å; F981-F985 HydrophobicContact CD1-CE2 4.13Å; F981-F985 WeakPolarHBondContact O-CD2 3.02Å; F981-F985 PolarHBondContact O-N 3.49Å; F981-L996 HydrophobicContact CB-CD2 3.94Å; F981-L996 HydrophobicContact CD1-CD2 4.46Å; F981-L996 HydrophobicContact CD2-CD1 4.49Å; F981-L996 HydrophobicContact CD2-CD2 4.48Å; F981-L996 HydrophobicContact CG-CD2 4.08Å
982	Q	78	Confident	77.5	Confident	65 Å²	65	54 Å²	54	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-49.5	-42.5	177.6	-170.7	-176.4	8.7	0	0	111.3	L978 S986 L1000	L978-Q982 WeakPolarHBondContact O-CB 3.42Å; L978-Q982 PolarHBondContact O-N 2.68Å; Q982-S986 VanDerWaalsContact O-CB 3.25Å; Q982-S986 WeakPolarHBondContact O-CB 3.47Å; Q982-S986 PolarHBondContact O-N 2.95Å; Q982-S986 PolarHBondContact O-OG 3.04Å; Q982-L1000 HydrophobicContact CB-CD1 4.14Å; Q982-L1000 HydrophobicContact CB-CD2 3.85Å; Q982-L1000 HydrophobicContact CG-CD1 4.31Å; Q982-L1000 HydrophobicContact CG-CD2 4.32Å
983	K	75.3	Confident	77.6	Confident	14 Å²	14	49 Å²	49	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-73.1	-41.2	179.6	-174.5	166.4	175.9	-172.1	0	114.1	L979 L980 F981 S986 E987 E1012 L1015	L979-K983 WeakPolarHBondContact O-CB 3.44Å; L979-K983 PolarHBondContact O-N 3.49Å; L980-K983 PolarHBondContact O-N 3.09Å; F981-K983 PolarHBondContact O-N 2.87Å; F981-K983 VanDerWaalsContact O-N 3.12Å; K983-S986 WeakPolarHBondContact CA-OG 3.27Å; K983-S986 PolarHBondContact O-N 2.87Å; K983-S986 PolarHBondContact O-OG 3.05Å; K983-E987 WeakPolarHBondContact CE-OE1 3.31Å; K983-E987 HydrophobicContact CG-CG 4.33Å; K983-E987 WeakPolarHBondContact CG-OE1 3.38Å; K983-E987 VanDerWaalsContact O-CB 3.24Å; K983-E987 WeakPolarHBondContact O-CB 3.4Å; K983-E987 VanDerWaalsContact O-CG 3.23Å; K983-E987 WeakPolarHBondContact O-CG 3.38Å; K983-E987 PolarHBondContact O-N 3.43Å; K983-E1012 VanDerWaalsContact CE-CG 3.5Å; K983-E1012 PolarHBondContact NZ-O 2.9Å; K983-L1015 HydrophobicContact CB-CD1 4.38Å; K983-L1015 HydrophobicContact CD-CB 3.75Å; K983-L1015 HydrophobicContact CD-CD1 3.81Å; K983-L1015 HydrophobicContact CD-CD2 4.38Å; K983-L1015 HydrophobicContact CD-CG 4.19Å
984	I	81.4	Confident	77.3	Confident	3 Å²	3	54 Å²	54	2%	0.015	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-43.5	173.6	-70	163.9	0	0	0	110.3	L947 R951 W956 A959 L980 F981 C988	L947-I984 HydrophobicContact CB-CD1 4.25Å; L947-I984 HydrophobicContact CD2-CD1 4.12Å; R951-I984 HydrophobicContact CB-CD1 4.27Å; R951-I984 HydrophobicContact CB-CG1 3.97Å; R951-I984 HydrophobicContact CG-CG1 4.19Å; W956-I984 HydrophobicContact CB-CG2 4.05Å; A959-I984 HydrophobicContact CB-CD1 4.13Å; A959-I984 HydrophobicContact CB-CG2 3.88Å; L980-I984 HydrophobicContact CD2-CD1 4.26Å; L980-I984 WeakPolarHBondContact O-CB 3.39Å; L980-I984 VanDerWaalsContact O-CG1 3.27Å; L980-I984 WeakPolarHBondContact O-CG1 3.09Å; L980-I984 PolarHBondContact O-N 3.13Å; F981-I984 PolarHBondContact O-N 3.21Å; F981-I984 VanDerWaalsContact O-N 3.09Å; I984-C988 WeakPolarHBondContact O-CB 3.41Å; I984-C988 PolarHBondContact O-N 2.93Å; I984-C988 PolarHBondContact O-SG 2.76Å
985	F	83.2	Confident	77.5	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	27%	0.271	C	S	.	.	H	α-helix	trans	-68.5	-38.3	177.8	-76.2	-70.8	0	0	0	112.2	W956 A960 F981 C988 K989 Q990 P992 L996	W956-F985 HydrophobicContact CE3-CE1 4.25Å; A960-F985 HydrophobicContact CB-CZ 4.28Å; F981-F985 HydrophobicContact CB-CD2 4.26Å; F981-F985 HydrophobicContact CB-CE2 4.37Å; F981-F985 HydrophobicContact CD1-CE2 4.13Å; F981-F985 WeakPolarHBondContact O-CD2 3.02Å; F981-F985 PolarHBondContact O-N 3.49Å; F985-C988 CarbonylContact O-C 3.56Å; F985-K989 PolarHBondContact O-N 3.05Å; F985-Q990 HydrophobicContact CD1-CB 4.04Å; F985-Q990 PolarHBondContact O-N 3.29Å; F985-P992 HydrophobicContact CB-CB 4.41Å; F985-P992 HydrophobicContact CD1-CB 4.34Å; F985-P992 HydrophobicContact CD2-CB 3.75Å; F985-P992 HydrophobicContact CE2-CB 4.09Å; F985-P992 HydrophobicContact CG-CB 3.92Å; F985-L996 HydrophobicContact CD2-CD2 4.3Å; F985-L996 HydrophobicContact CE2-CD2 3.8Å
986	S	78.7	Confident	77.9	Confident	77 Å²	77	49.1 Å²	49.1	54%	0.538	25%	0.248	S	C	.	.	H	α-helix	trans	-71.4	-43.9	176.7	71.1	0	0	0	0	113.2	Q982 K983 C988 K989	Q982-S986 VanDerWaalsContact O-CB 3.25Å; Q982-S986 WeakPolarHBondContact O-CB 3.47Å; Q982-S986 PolarHBondContact O-N 2.95Å; Q982-S986 PolarHBondContact O-OG 3.04Å; K983-S986 WeakPolarHBondContact CA-OG 3.27Å; K983-S986 PolarHBondContact O-N 2.87Å; K983-S986 PolarHBondContact O-OG 3.05Å; S986-C988 VanDerWaalsContact C-N 3.27Å; S986-C988 PolarHBondContact O-N 2.91Å; S986-K989 PolarHBondContact O-N 3.23Å
987	E	76.8	Confident	78.2	Confident	52 Å²	52	49.8 Å²	49.8	24%	0.243	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-37.8	173.6	-74.3	168.7	-172.6	0	0	111.3	R951 K983 K989	R951-E987 WeakPolarHBondContact CG-OE2 3.47Å; R951-E987 IonicContact CZ-OE1 2.75Å; R951-E987 VanDerWaalsContact CZ-OE1 3.23Å; R951-E987 IonicContact CZ-OE2 2.69Å; R951-E987 IonicContact NE-OE1 3.8Å; R951-E987 PolarHBondContact NE-OE1 2.85Å; R951-E987 IonicContact NE-OE2 3.59Å; R951-E987 PolarHBondContact NE-OE2 3.22Å; R951-E987 IonicContact NH2-OE1 3.62Å; R951-E987 PolarHBondContact NH2-OE1 3.34Å; R951-E987 IonicContact NH2-OE2 3.66Å; R951-E987 PolarHBondContact NH2-OE2 3.04Å; K983-E987 WeakPolarHBondContact CE-OE1 3.31Å; K983-E987 HydrophobicContact CG-CG 4.33Å; K983-E987 WeakPolarHBondContact CG-OE1 3.38Å; K983-E987 VanDerWaalsContact O-CB 3.24Å; K983-E987 WeakPolarHBondContact O-CB 3.4Å; K983-E987 VanDerWaalsContact O-CG 3.23Å; K983-E987 WeakPolarHBondContact O-CG 3.38Å; K983-E987 PolarHBondContact O-N 3.43Å; E987-K989 VanDerWaalsContact C-N 3.33Å
988	C	79.3	Confident	77.9	Confident	28 Å²	28	55.4 Å²	55.4	19%	0.189	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.2	176.3	-68	0	0	0	0	114.5	W956 I984 F985 S986 Q990	W956-C988 HydrophobicContact CB-CB 3.97Å; W956-C988 HydrophobicContact CG-CB 4.16Å; I984-C988 WeakPolarHBondContact O-CB 3.41Å; I984-C988 PolarHBondContact O-N 2.93Å; I984-C988 PolarHBondContact O-SG 2.76Å; F985-C988 CarbonylContact O-C 3.56Å; S986-C988 VanDerWaalsContact C-N 3.27Å; S986-C988 PolarHBondContact O-N 2.91Å; C988-Q990 HydrophobicContact CB-CG 4.39Å; C988-Q990 PolarHBondContact O-N 2.89Å; C988-Q990 PolarHBondContact O-NE2 3.23Å
989	K	76.4	Confident	77.4	Confident	188 Å²	188	58.5 Å²	58.5	82%	0.817	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	38.8	-177.4	-57.3	-179.8	179.9	178.5	0	113.9	F985 S986 E987	F985-K989 PolarHBondContact O-N 3.05Å; S986-K989 PolarHBondContact O-N 3.23Å; E987-K989 VanDerWaalsContact C-N 3.33Å
990	Q	81.7	Confident	77.3	Confident	91 Å²	91	58.2 Å²	58.2	43%	0.425	30%	0.297	S	S	.	.			trans	-111	148.9	176.5	-65.6	-52.7	-59.2	0	0	110.1	W956 F985 C988	W956-Q990 HydrophobicContact CD2-CG 4.14Å; W956-Q990 HydrophobicContact CG-CG 4.35Å; W956-Q990 HydrophobicContact CZ2-CG 4.42Å; F985-Q990 HydrophobicContact CD1-CB 4.04Å; F985-Q990 PolarHBondContact O-N 3.29Å; C988-Q990 HydrophobicContact CB-CG 4.39Å; C988-Q990 PolarHBondContact O-N 2.89Å; C988-Q990 PolarHBondContact O-NE2 3.23Å
991	Q	71.5	Confident	76.7	Confident	175 Å²	175	63.2 Å²	63.2	82%	0.818	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-72.7	134.7	166.1	-72.6	-175.5	-49.9	0	0	109.3
992	P	79.2	Confident	75.6	Confident	15 Å²	15	66.7 Å²	66.7	10%	0.097	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-67.9	160.2	168.2	31	-33.6	0	0	0	110	F985 L996 Q997 L1000	F985-P992 HydrophobicContact CB-CB 4.41Å; F985-P992 HydrophobicContact CD1-CB 4.34Å; F985-P992 HydrophobicContact CD2-CB 3.75Å; F985-P992 HydrophobicContact CE2-CB 4.09Å; F985-P992 HydrophobicContact CG-CB 3.92Å; P992-L996 HydrophobicContact CB-CB 4.31Å; P992-L996 HydrophobicContact CB-CD2 3.94Å; P992-L996 HydrophobicContact CB-CG 4.12Å; P992-Q997 VanDerWaalsContact CD-OE1 3.3Å; P992-Q997 HydrophobicContact CG-CB 4.19Å; P992-L1000 HydrophobicContact CB-CD1 4.34Å; P992-L1000 HydrophobicContact CG-CD1 3.92Å
993	P	80.2	Confident	74.7	Confident	39 Å²	39	65.4 Å²	65.4	25%	0.253	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-52.9	145.4	173.5	-28.4	37.3	0	0	0	112.8	D995 L996 Q997	P993-D995 WeakPolarHBondContact CB-OD1 3.23Å; P993-D995 PolarHBondContact O-N 2.86Å; P993-D995 VanDerWaalsContact O-N 3.15Å; P993-L996 HydrophobicContact CB-CB 4.38Å; P993-L996 CarbonylContact O-C 3.55Å; P993-L996 WeakPolarHBondContact O-CA 3.44Å; P993-L996 WeakPolarHBondContact O-CB 3.34Å; P993-L996 PolarHBondContact O-N 3.28Å; P993-Q997 PolarHBondContact O-N 3.41Å
994	D	72.7	Confident	73.6	Confident	133 Å²	133	67.4 Å²	67.4	71%	0.711	38%	0.383	S	S	*	.	H	α-helix	trans	-54	-38.8	-175.7	-60.8	-28.6	0	0	0	113.1	L996 Q997 N998	D994-L996 VanDerWaalsContact C-N 3.28Å; D994-L996 PolarHBondContact O-N 3.12Å; D994-Q997 PolarHBondContact O-N 2.78Å; D994-N998 PolarHBondContact O-N 3.06Å; D994-N998 PolarHBondContact O-ND2 3.42Å
995	D	79.3	Confident	72.3	Confident	65 Å²	65	68.2 Å²	68.2	35%	0.348	39%	0.386	S	S	.	.	H	α-helix	trans	-61.7	-34.6	174.9	53.5	-48.3	0	0	0	112.7	W963 K967 P993	W963-D995 PolarHBondContact NE1-OD2 3.25Å; K967-D995 WeakPolarHBondContact CD-OD2 3.47Å; K967-D995 WeakPolarHBondContact CE-OD2 3.37Å; K967-D995 IonicContact NZ-OD1 2.77Å; K967-D995 IonicContact NZ-OD2 3.49Å; K967-D995 PolarHBondContact NZ-OD2 2.95Å; P993-D995 WeakPolarHBondContact CB-OD1 3.23Å; P993-D995 PolarHBondContact O-N 2.86Å; P993-D995 VanDerWaalsContact O-N 3.15Å
996	L	80.5	Confident	70.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-82.5	-36.7	175.2	-175.6	57.9	0	0	0	112.1	W963 L978 F981 F985 P992 P993 D994 L999 L1000	W963-L996 HydrophobicContact CD2-CD1 4.43Å; W963-L996 HydrophobicContact CD2-CD2 4.33Å; W963-L996 HydrophobicContact CE3-CD1 4.32Å; W963-L996 HydrophobicContact CG-CD2 4.47Å; W963-L996 HydrophobicContact CH2-CD1 3.96Å; W963-L996 HydrophobicContact CZ2-CB 4.08Å; W963-L996 HydrophobicContact CZ2-CD1 4.05Å; W963-L996 HydrophobicContact CZ3-CD1 4.11Å; L978-L996 HydrophobicContact CD2-CD1 3.58Å; F981-L996 HydrophobicContact CB-CD2 3.94Å; F981-L996 HydrophobicContact CD1-CD2 4.46Å; F981-L996 HydrophobicContact CD2-CD1 4.49Å; F981-L996 HydrophobicContact CD2-CD2 4.48Å; F981-L996 HydrophobicContact CG-CD2 4.08Å; F985-L996 HydrophobicContact CD2-CD2 4.3Å; F985-L996 HydrophobicContact CE2-CD2 3.8Å; P992-L996 HydrophobicContact CB-CB 4.31Å; P992-L996 HydrophobicContact CB-CD2 3.94Å; P992-L996 HydrophobicContact CB-CG 4.12Å; P993-L996 HydrophobicContact CB-CB 4.38Å; P993-L996 CarbonylContact O-C 3.55Å; P993-L996 WeakPolarHBondContact O-CA 3.44Å; P993-L996 WeakPolarHBondContact O-CB 3.34Å; P993-L996 PolarHBondContact O-N 3.28Å; D994-L996 VanDerWaalsContact C-N 3.28Å; D994-L996 PolarHBondContact O-N 3.12Å; L996-L999 WeakPolarHBondContact O-CB 3.48Å; L996-L999 PolarHBondContact O-N 2.93Å; L996-L1000 HydrophobicContact CG-CD1 4.27Å; L996-L1000 WeakPolarHBondContact O-CG 3.48Å; L996-L1000 PolarHBondContact O-N 2.7Å
997	Q	75.3	Confident	68.8	Low	62 Å²	62	76.8 Å²	76.8	29%	0.29	44%	0.44	S	S	.	.	H	α-helix	trans	-61	-45.6	176.7	-173.7	63.8	52.1	0	0	111.3	P992 P993 D994 L999 L1000 D1001	P992-Q997 VanDerWaalsContact CD-OE1 3.3Å; P992-Q997 HydrophobicContact CG-CB 4.19Å; P993-Q997 PolarHBondContact O-N 3.41Å; D994-Q997 PolarHBondContact O-N 2.78Å; Q997-L999 PolarHBondContact O-N 2.77Å; Q997-L1000 WeakPolarHBondContact O-CA 3.04Å; Q997-L1000 PolarHBondContact O-N 3.43Å; Q997-D1001 PolarHBondContact NE2-OD1 3.22Å; Q997-D1001 PolarHBondContact NE2-OD2 3.13Å; Q997-D1001 PolarHBondContact O-N 3.4Å
998	N	71.7	Confident	67.2	Low	118 Å²	118	76 Å²	76	63%	0.631	44%	0.441	S	S	*	.	H	α-helix	trans	-57.3	-36.2	175.2	-74.6	-61.2	0	0	0	112.8	D994 G1002	D994-N998 PolarHBondContact O-N 3.06Å; D994-N998 PolarHBondContact O-ND2 3.42Å; N998-G1002 PolarHBondContact O-N 2.71Å
999	L	71.3	Confident	65.4	Low	83 Å²	83	82.1 Å²	82.1	44%	0.435	47%	0.47	S	S	.	.	H	α-helix	trans	-71.3	-32.3	175.2	-80.5	163.8	0	0	0	112.8	W963 L978 L996 Q997 S1003	W963-L999 HydrophobicContact CH2-CD1 3.88Å; W963-L999 HydrophobicContact CZ2-CD1 4.25Å; L978-L999 HydrophobicContact CD2-CB 4.5Å; L996-L999 WeakPolarHBondContact O-CB 3.48Å; L996-L999 PolarHBondContact O-N 2.93Å; Q997-L999 PolarHBondContact O-N 2.77Å; L999-S1003 PolarHBondContact O-OG 3.36Å
1000	L	70.8	Confident	64	Low	9 Å²	9	74.5 Å²	74.5	5%	0.047	44%	0.438	C	S	.	.	H	α-helix	trans	-77.3	-36.6	177.2	-67.2	173.2	0	0	0	112.7	L978 Q982 P992 L996 Q997 S1003 F1005	L978-L1000 HydrophobicContact CB-CD2 4.26Å; Q982-L1000 HydrophobicContact CB-CD1 4.14Å; Q982-L1000 HydrophobicContact CB-CD2 3.85Å; Q982-L1000 HydrophobicContact CG-CD1 4.31Å; Q982-L1000 HydrophobicContact CG-CD2 4.32Å; P992-L1000 HydrophobicContact CB-CD1 4.34Å; P992-L1000 HydrophobicContact CG-CD1 3.92Å; L996-L1000 HydrophobicContact CG-CD1 4.27Å; L996-L1000 WeakPolarHBondContact O-CG 3.48Å; L996-L1000 PolarHBondContact O-N 2.7Å; Q997-L1000 WeakPolarHBondContact O-CA 3.04Å; Q997-L1000 PolarHBondContact O-N 3.43Å; L1000-S1003 WeakPolarHBondContact CA-OG 2.97Å; L1000-S1003 PolarHBondContact O-OG 3.46Å; L1000-F1005 HydrophobicContact CD2-CD2 4.32Å; L1000-F1005 HydrophobicContact CD2-CE2 3.89Å; L1000-F1005 WeakPolarHBondContact O-CD2 3.45Å
1001	D	64.2	Low	62.2	Low	105 Å²	105	71.6 Å²	71.6	56%	0.561	43%	0.428	S	S	*	.	H	α-helix	trans	-69.7	-40.8	179	-67.1	-24.3	0	0	0	111.6	Q997 S1003	Q997-D1001 PolarHBondContact NE2-OD1 3.22Å; Q997-D1001 PolarHBondContact NE2-OD2 3.13Å; Q997-D1001 PolarHBondContact O-N 3.4Å; D1001-S1003 PolarHBondContact O-N 3Å
1002	G	59	Low	60.7	Low	73 Å²	73	69 Å²	69	75%	0.753	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-9	179.6	0	0	0	0	0	115.4	N998	N998-G1002 PolarHBondContact O-N 2.71Å
1003	S	60.1	Low	58.8	Low	38 Å²	38	70.2 Å²	70.2	27%	0.266	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	8	-171.7	31.9	0	0	0	0	115.2	L999 L1000 D1001 F1005	L999-S1003 PolarHBondContact O-OG 3.36Å; L1000-S1003 WeakPolarHBondContact CA-OG 2.97Å; L1000-S1003 PolarHBondContact O-OG 3.46Å; D1001-S1003 PolarHBondContact O-N 3Å; S1003-F1005 VanDerWaalsContact C-N 3.35Å; S1003-F1005 PolarHBondContact O-N 3.14Å; S1003-F1005 VanDerWaalsContact OG-CD2 3.29Å; S1003-F1005 WeakPolarHBondContact OG-CD2 3.4Å; S1003-F1005 WeakPolarHBondContact OG-CE2 3.27Å
1004	G	51.4	Low	57.2	Low	56 Å²	56	68.5 Å²	68.5	58%	0.577	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	24.9	168.6	0	0	0	0	0	114.7	A1006	G1004-A1006 PolarHBondContact O-N 2.91Å
1005	F	55.4	Low	55.9	Low	21 Å²	21	62.7 Å²	62.7	9%	0.092	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-73.1	-0.1	-175.8	-64.7	-51.5	0	0	0	115.3	R975 L979 L1000 S1003 D1007	R975-F1005 HydrophobicContact CG-CE1 4.42Å; R975-F1005 HydrophobicContact CG-CZ 4.23Å; L979-F1005 HydrophobicContact CD1-CE1 4.45Å; L979-F1005 HydrophobicContact CD2-CD1 3.78Å; L979-F1005 HydrophobicContact CD2-CE1 3.34Å; L979-F1005 HydrophobicContact CD2-CE2 4.33Å; L979-F1005 HydrophobicContact CD2-CG 4.47Å; L979-F1005 HydrophobicContact CD2-CZ 3.65Å; L979-F1005 HydrophobicContact CG-CE1 3.88Å; L979-F1005 HydrophobicContact CG-CZ 3.9Å; L1000-F1005 HydrophobicContact CD2-CD2 4.32Å; L1000-F1005 HydrophobicContact CD2-CE2 3.89Å; L1000-F1005 WeakPolarHBondContact O-CD2 3.45Å; S1003-F1005 VanDerWaalsContact C-N 3.35Å; S1003-F1005 PolarHBondContact O-N 3.14Å; S1003-F1005 VanDerWaalsContact OG-CD2 3.29Å; S1003-F1005 WeakPolarHBondContact OG-CD2 3.4Å; S1003-F1005 WeakPolarHBondContact OG-CE2 3.27Å; F1005-D1007 VanDerWaalsContact C-N 3.33Å; F1005-D1007 PolarHBondContact O-N 2.97Å
1006	A	45	Very low	54.3	Low	100 Å²	100	61.1 Å²	61.1	83%	0.826	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-66.1	-28.5	-174.6	0	0	0	0	0	114.5	G1004	G1004-A1006 PolarHBondContact O-N 2.91Å
1007	D	42.5	Very low	52.6	Low	161 Å²	161	61.7 Å²	61.7	86%	0.861	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-103.4	-2.8	-173.9	-65	-40.6	0	0	0	114.3	F1005	F1005-D1007 VanDerWaalsContact C-N 3.33Å; F1005-D1007 PolarHBondContact O-N 2.97Å
1008	S	43.4	Very low	51.2	Low	37 Å²	37	59.5 Å²	59.5	26%	0.259	38%	0.376	S	S	.	.			trans	-109.7	96.5	-175.4	67.5	0	0	0	0	113	L1010	S1008-L1010 PolarHBondContact O-N 3.18Å
1009	I	41.3	Very low	50	Low	156 Å²	156	53.9 Å²	53.9	80%	0.8	35%	0.346	S	S	*	.			trans	-73.6	72	167.1	-52.1	175.7	0	0	0	108.7	S1011	I1009-S1011 PolarHBondContact O-N 3.17Å
1010	L	47.4	Very low	48.7	Very low	27 Å²	27	53.6 Å²	53.6	14%	0.141	34%	0.339	C	S	.	.			trans	-74.8	106.3	172.4	-92.4	158.8	0	0	0	109	S1008 D1014 A1030 N1033 Q1034	S1008-L1010 PolarHBondContact O-N 3.18Å; L1010-D1014 HydrophobicContact CD2-CB 4.31Å; L1010-A1030 HydrophobicContact CD2-CB 4.25Å; L1010-A1030 WeakPolarHBondContact CD2-O 3.47Å; L1010-N1033 HydrophobicContact CD2-CB 4.18Å; L1010-Q1034 HydrophobicContact CD1-CG 4.12Å; L1010-Q1034 HydrophobicContact CD2-CG 4.22Å; L1010-Q1034 HydrophobicContact CG-CG 4.31Å
1011	S	44.3	Very low	47.5	Very low	31 Å²	31	53.3 Å²	53.3	22%	0.217	34%	0.338	C	S	.	.			trans	-55.7	158.2	-173.5	100.8	0	0	0	0	113.1	I1009 G1013 D1014 L1015	I1009-S1011 PolarHBondContact O-N 3.17Å; S1011-G1013 PolarHBondContact O-N 2.97Å; S1011-G1013 PolarHBondContact OG-N 3.23Å; S1011-D1014 WeakPolarHBondContact CB-OD2 3.38Å; S1011-D1014 PolarHBondContact O-N 3.46Å; S1011-D1014 PolarHBondContact OG-N 3.44Å; S1011-D1014 PolarHBondContact OG-OD2 3.2Å; S1011-L1015 PolarHBondContact O-N 3.24Å; S1011-L1015 VanDerWaalsContact O-N 3.13Å
1012	E	39.1	Very low	46.6	Very low	120 Å²	120	49.9 Å²	49.9	56%	0.561	32%	0.323	S	S	*	.	H	α-helix	trans	-58	-37.7	178.2	-159.6	-170.3	135.7	0	0	111.9	R951 K983 D1014 L1016	R951-E1012 IonicContact CZ-OE1 2.81Å; R951-E1012 VanDerWaalsContact NH2-CG 3.26Å; R951-E1012 IonicContact NH2-OE1 2.74Å; R951-E1012 PolarHBondContact NH2-OE1 3.5Å; K983-E1012 VanDerWaalsContact CE-CG 3.5Å; K983-E1012 PolarHBondContact NZ-O 2.9Å; E1012-D1014 VanDerWaalsContact C-N 3.31Å; E1012-D1014 PolarHBondContact O-N 3.18Å; E1012-L1016 WeakPolarHBondContact O-CB 3.43Å; E1012-L1016 PolarHBondContact O-N 3.4Å
1013	G	41.3	Very low	46.2	Very low	41 Å²	41	49.1 Å²	49.1	42%	0.423	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-34.8	175.9	0	0	0	0	0	112.7	S1011 S1017	S1011-G1013 PolarHBondContact O-N 2.97Å; S1011-G1013 PolarHBondContact OG-N 3.23Å; G1013-S1017 WeakPolarHBondContact O-CB 3.45Å; G1013-S1017 PolarHBondContact O-N 3.43Å; G1013-S1017 PolarHBondContact O-OG 3.15Å
1014	D	46	Very low	45.8	Very low	2 Å²	2	48.2 Å²	48.2	1%	0.011	29%	0.294	C	S	.	.	H	α-helix	trans	-83.9	-28.8	-171.9	-70.7	-78	0	0	0	114	L1010 S1011 E1012 S1017 S1018 N1029 N1033 R1061	L1010-D1014 HydrophobicContact CD2-CB 4.31Å; S1011-D1014 WeakPolarHBondContact CB-OD2 3.38Å; S1011-D1014 PolarHBondContact O-N 3.46Å; S1011-D1014 PolarHBondContact OG-N 3.44Å; S1011-D1014 PolarHBondContact OG-OD2 3.2Å; E1012-D1014 VanDerWaalsContact C-N 3.31Å; E1012-D1014 PolarHBondContact O-N 3.18Å; D1014-S1017 VanDerWaalsContact CA-OG 3.3Å; D1014-S1017 WeakPolarHBondContact CA-OG 3.34Å; D1014-S1017 PolarHBondContact O-OG 3.11Å; D1014-S1018 VanDerWaalsContact O-CB 3.3Å; D1014-S1018 WeakPolarHBondContact O-CB 3.36Å; D1014-S1018 PolarHBondContact O-N 3.01Å; D1014-N1029 WeakPolarHBondContact OD1-CA 3.3Å; D1014-N1029 WeakPolarHBondContact OD1-CB 3.34Å; D1014-N1029 PolarHBondContact OD1-ND2 3.32Å; D1014-N1029 VanDerWaalsContact OD1-O 3.14Å; D1014-N1029 PolarHBondContact OD1-OD1 3.34Å; D1014-N1033 WeakPolarHBondContact CB-ND2 3.12Å; D1014-N1033 VanDerWaalsContact CG-CG 3.42Å; D1014-N1033 PolarHBondContact OD1-ND2 3.5Å; D1014-N1033 PolarHBondContact OD2-ND2 2.69Å; D1014-N1033 PolarHBondContact OD2-OD1 3.27Å; D1014-R1061 IonicContact OD1-NH1 3.02Å; D1014-R1061 PolarHBondContact OD1-NH1 2.94Å; D1014-R1061 IonicContact OD2-CZ 3.78Å; D1014-R1061 IonicContact OD2-NH1 3.32Å; D1014-R1061 PolarHBondContact OD2-NH1 3.14Å; D1014-R1061 IonicContact OD2-NH2 2.78Å
1015	L	45	Very low	45.9	Very low	11 Å²	11	46.1 Å²	46.1	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-74.2	-44	169.3	-126.3	156.8	0	0	0	110.8	L979 K983 S1011 S1017 S1018 I1019	L979-L1015 HydrophobicContact CB-CD1 3.95Å; L979-L1015 HydrophobicContact CB-CD2 3.72Å; L979-L1015 HydrophobicContact CB-CG 4.22Å; L979-L1015 HydrophobicContact CD2-CD1 4.27Å; K983-L1015 HydrophobicContact CB-CD1 4.38Å; K983-L1015 HydrophobicContact CD-CB 3.75Å; K983-L1015 HydrophobicContact CD-CD1 3.81Å; K983-L1015 HydrophobicContact CD-CD2 4.38Å; K983-L1015 HydrophobicContact CD-CG 4.19Å; S1011-L1015 PolarHBondContact O-N 3.24Å; S1011-L1015 VanDerWaalsContact O-N 3.13Å; L1015-S1017 VanDerWaalsContact C-N 3.32Å; L1015-S1017 PolarHBondContact O-N 3.14Å; L1015-S1018 WeakPolarHBondContact O-CB 3.28Å; L1015-S1018 PolarHBondContact O-N 3.04Å; L1015-S1018 VanDerWaalsContact O-N 3.09Å; L1015-S1018 PolarHBondContact O-OG 3.02Å; L1015-I1019 HydrophobicContact CD2-CD1 4.15Å; L1015-I1019 HydrophobicContact CD2-CG1 4.47Å; L1015-I1019 WeakPolarHBondContact O-CD1 3.38Å; L1015-I1019 VanDerWaalsContact O-CG1 3.27Å; L1015-I1019 WeakPolarHBondContact O-CG1 3.35Å; L1015-I1019 PolarHBondContact O-N 2.98Å
1016	L	44.7	Very low	45.8	Very low	33 Å²	33	45.8 Å²	45.8	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-47.4	173	-89.5	-178	0	0	0	110.9	E1012 S1018 I1019 Y1020	E1012-L1016 WeakPolarHBondContact O-CB 3.43Å; E1012-L1016 PolarHBondContact O-N 3.4Å; L1016-S1018 PolarHBondContact O-N 3.44Å; L1016-I1019 PolarHBondContact O-N 3.36Å; L1016-Y1020 HydrophobicContact CB-CD2 4.31Å; L1016-Y1020 HydrophobicContact CB-CE2 4.33Å; L1016-Y1020 HydrophobicContact CD2-CE2 3.92Å; L1016-Y1020 WeakPolarHBondContact O-CB 3.37Å; L1016-Y1020 WeakPolarHBondContact O-CD2 3.29Å; L1016-Y1020 PolarHBondContact O-N 3.25Å
1017	S	46.4	Very low	46.5	Very low	12 Å²	12	43.2 Å²	43.2	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-54	-56.3	171.2	82.9	0	0	0	0	108.1	G1013 D1014 L1015 I1019 Y1020 A1021 C1026	G1013-S1017 WeakPolarHBondContact O-CB 3.45Å; G1013-S1017 PolarHBondContact O-N 3.43Å; G1013-S1017 PolarHBondContact O-OG 3.15Å; D1014-S1017 VanDerWaalsContact CA-OG 3.3Å; D1014-S1017 WeakPolarHBondContact CA-OG 3.34Å; D1014-S1017 PolarHBondContact O-OG 3.11Å; L1015-S1017 VanDerWaalsContact C-N 3.32Å; L1015-S1017 PolarHBondContact O-N 3.14Å; S1017-I1019 PolarHBondContact O-N 2.9Å; S1017-Y1020 CarbonylContact O-C 3.53Å; S1017-Y1020 VanDerWaalsContact O-C 3.25Å; S1017-Y1020 WeakPolarHBondContact O-CA 3.24Å; S1017-Y1020 PolarHBondContact O-N 3.34Å; S1017-A1021 WeakPolarHBondContact O-CA 3.3Å; S1017-A1021 WeakPolarHBondContact O-CB 3.41Å; S1017-A1021 PolarHBondContact O-N 2.87Å; S1017-C1026 VanDerWaalsContact CB-SG 3.56Å; S1017-C1026 WeakPolarHBondContact O-CB 3.48Å; S1017-C1026 PolarHBondContact OG-O 2.98Å
1018	S	45.9	Very low	47.7	Very low	16 Å²	16	35.5 Å²	35.5	11%	0.112	20%	0.2	C	C	.	.	H	α-helix	trans	-51.5	-20.9	-176.5	84	0	0	0	0	115.6	R976 D1014 L1015 L1016 A1021	R976-S1018 WeakPolarHBondContact CD-O 3.33Å; R976-S1018 PolarHBondContact NH1-O 3.1Å; D1014-S1018 VanDerWaalsContact O-CB 3.3Å; D1014-S1018 WeakPolarHBondContact O-CB 3.36Å; D1014-S1018 PolarHBondContact O-N 3.01Å; L1015-S1018 WeakPolarHBondContact O-CB 3.28Å; L1015-S1018 PolarHBondContact O-N 3.04Å; L1015-S1018 VanDerWaalsContact O-N 3.09Å; L1015-S1018 PolarHBondContact O-OG 3.02Å; L1016-S1018 PolarHBondContact O-N 3.44Å; S1018-A1021 VanDerWaalsContact C-CB 3.47Å; S1018-A1021 WeakPolarHBondContact O-CB 3.46Å
1019	I	45.3	Very low	48.7	Very low	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-101.6	-39	178	-37.6	132.4	0	0	0	112.2	C944 I948 R976 L980 L1015 L1016 S1017 A1021	C944-I1019 HydrophobicContact CB-CG2 3.62Å; I948-I1019 HydrophobicContact CD1-CB 3.75Å; I948-I1019 HydrophobicContact CD1-CG2 3.36Å; I948-I1019 HydrophobicContact CG1-CB 3.86Å; I948-I1019 HydrophobicContact CG1-CD1 4.33Å; I948-I1019 HydrophobicContact CG1-CG2 3.57Å; R976-I1019 HydrophobicContact CG-CG1 4.27Å; R976-I1019 PolarHBondContact NH2-O 2.93Å; L980-I1019 HydrophobicContact CD1-CB 4.38Å; L980-I1019 HydrophobicContact CD1-CD1 3.84Å; L980-I1019 HydrophobicContact CD1-CG1 3.7Å; L980-I1019 HydrophobicContact CD1-CG2 3.76Å; L980-I1019 HydrophobicContact CD2-CD1 3.47Å; L980-I1019 VanDerWaalsContact CD2-CD1 3.47Å; L980-I1019 HydrophobicContact CD2-CG1 4.3Å; L980-I1019 HydrophobicContact CG-CD1 3.44Å; L980-I1019 VanDerWaalsContact CG-CD1 3.44Å; L980-I1019 HydrophobicContact CG-CG1 3.76Å; L1015-I1019 HydrophobicContact CD2-CD1 4.15Å; L1015-I1019 HydrophobicContact CD2-CG1 4.47Å; L1015-I1019 WeakPolarHBondContact O-CD1 3.38Å; L1015-I1019 VanDerWaalsContact O-CG1 3.27Å; L1015-I1019 WeakPolarHBondContact O-CG1 3.35Å; L1015-I1019 PolarHBondContact O-N 2.98Å; L1016-I1019 PolarHBondContact O-N 3.36Å; S1017-I1019 PolarHBondContact O-N 2.9Å; I1019-A1021 PolarHBondContact O-N 3.16Å; I1019-A1021 VanDerWaalsContact O-N 3.07Å
1020	Y	45.2	Very low	49.8	Very low	76 Å²	76	28.2 Å²	28.2	30%	0.298	16%	0.162	S	C	.	.	H	α-helix	trans	-57.4	-12.6	157.6	-67.4	-57.6	0	0	0	111.3	V916 I948 N952 L1016 S1017 S1022 L1023	V916-Y1020 HydrophobicContact CG1-CE1 4.18Å; I948-Y1020 HydrophobicContact CD1-CD1 4.2Å; I948-Y1020 HydrophobicContact CD1-CE1 4.2Å; I948-Y1020 HydrophobicContact CG2-CE1 3.94Å; I948-Y1020 WeakPolarHBondContact CG2-OH 3.32Å; N952-Y1020 PolarHBondContact ND2-OH 3.16Å; L1016-Y1020 HydrophobicContact CB-CD2 4.31Å; L1016-Y1020 HydrophobicContact CB-CE2 4.33Å; L1016-Y1020 HydrophobicContact CD2-CE2 3.92Å; L1016-Y1020 WeakPolarHBondContact O-CB 3.37Å; L1016-Y1020 WeakPolarHBondContact O-CD2 3.29Å; L1016-Y1020 PolarHBondContact O-N 3.25Å; S1017-Y1020 CarbonylContact O-C 3.53Å; S1017-Y1020 VanDerWaalsContact O-C 3.25Å; S1017-Y1020 WeakPolarHBondContact O-CA 3.24Å; S1017-Y1020 PolarHBondContact O-N 3.34Å; Y1020-S1022 PolarHBondContact O-N 3.36Å; Y1020-S1022 PolarHBondContact O-OG 3.26Å; Y1020-L1023 WeakPolarHBondContact O-CA 3.46Å; Y1020-L1023 VanDerWaalsContact O-CB 3.3Å; Y1020-L1023 WeakPolarHBondContact O-CB 3.43Å; Y1020-L1023 WeakPolarHBondContact O-CD1 3.32Å; Y1020-L1023 PolarHBondContact O-N 3.09Å
1021	A	44.3	Very low	51	Low	4 Å²	4	28.6 Å²	28.6	3%	0.033	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	9.4	-178.6	0	0	0	0	0	116.7	S1017 S1018 I1019 L1023 C1026 E1027	S1017-A1021 WeakPolarHBondContact O-CA 3.3Å; S1017-A1021 WeakPolarHBondContact O-CB 3.41Å; S1017-A1021 PolarHBondContact O-N 2.87Å; S1018-A1021 VanDerWaalsContact C-CB 3.47Å; S1018-A1021 WeakPolarHBondContact O-CB 3.46Å; I1019-A1021 PolarHBondContact O-N 3.16Å; I1019-A1021 VanDerWaalsContact O-N 3.07Å; A1021-L1023 VanDerWaalsContact CA-O 3.3Å; A1021-L1023 WeakPolarHBondContact CA-O 3.26Å; A1021-L1023 CarbonylContact O-C 3.47Å; A1021-L1023 PolarHBondContact O-N 2.95Å; A1021-C1026 HydrophobicContact CB-CB 3.36Å; A1021-E1027 HydrophobicContact CB-CG 3.76Å
1022	S	46.5	Very low	52.4	Low	33 Å²	33	28 Å²	28	23%	0.231	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.1	144	65.7	0	0	0	0	111.6	R913 Y945 Y1020 P1024	R913-S1022 PolarHBondContact NH2-O 3.22Å; R913-S1022 PolarHBondContact NH2-OG 3.48Å; R913-S1022 VanDerWaalsContact NH2-OG 3.13Å; Y945-S1022 WeakPolarHBondContact OH-CB 3.41Å; Y945-S1022 PolarHBondContact OH-OG 3.5Å; Y1020-S1022 PolarHBondContact O-N 3.36Å; Y1020-S1022 PolarHBondContact O-OG 3.26Å; S1022-P1024 VanDerWaalsContact C-CD 3.49Å; S1022-P1024 VanDerWaalsContact O-CD 3.24Å; S1022-P1024 WeakPolarHBondContact O-CD 3.45Å
1023	L	49.9	Very low	53.8	Low	57 Å²	57	23.8 Å²	23.8	30%	0.298	14%	0.139	S	C	.	.	S	Bend	trans	-90.7	89.1	152.9	-69.1	95.5	0	0	0	109.5	Y1020 A1021 S1025 C1026	Y1020-L1023 WeakPolarHBondContact O-CA 3.46Å; Y1020-L1023 VanDerWaalsContact O-CB 3.3Å; Y1020-L1023 WeakPolarHBondContact O-CB 3.43Å; Y1020-L1023 WeakPolarHBondContact O-CD1 3.32Å; Y1020-L1023 PolarHBondContact O-N 3.09Å; A1021-L1023 VanDerWaalsContact CA-O 3.3Å; A1021-L1023 WeakPolarHBondContact CA-O 3.26Å; A1021-L1023 CarbonylContact O-C 3.47Å; A1021-L1023 PolarHBondContact O-N 2.95Å; L1023-S1025 VanDerWaalsContact C-N 3.26Å; L1023-S1025 PolarHBondContact O-N 3.41Å; L1023-S1025 PolarHBondContact O-OG 3.42Å; L1023-C1026 WeakPolarHBondContact O-CB 3.43Å
1024	P	51.6	Low	55.3	Low	18 Å²	18	25.5 Å²	25.5	12%	0.117	14%	0.136	C	C	.	.	S	Bend	trans	18.4	-68.2	147.4	-52.7	38.7	0	0	0	121.7	S1022 C1026 E1027 L1047	S1022-P1024 VanDerWaalsContact C-CD 3.49Å; S1022-P1024 VanDerWaalsContact O-CD 3.24Å; S1022-P1024 WeakPolarHBondContact O-CD 3.45Å; P1024-C1026 PolarHBondContact O-N 2.92Å; P1024-E1027 PolarHBondContact O-N 3.45Å; P1024-L1047 HydrophobicContact CB-CB 4.01Å; P1024-L1047 HydrophobicContact CB-CD1 3.57Å; P1024-L1047 HydrophobicContact CB-CD2 3.25Å; P1024-L1047 HydrophobicContact CB-CG 3.67Å; P1024-L1047 HydrophobicContact CG-CD2 3.37Å; P1024-L1047 HydrophobicContact CG-CG 4.35Å; P1024-L1047 WeakPolarHBondContact O-CD1 3.12Å
1025	S	53.7	Low	56.7	Low	13 Å²	13	28 Å²	28	9%	0.091	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	6.7	-175.1	48	0	0	0	0	118.7	L1023 L1058	L1023-S1025 VanDerWaalsContact C-N 3.26Å; L1023-S1025 PolarHBondContact O-N 3.41Å; L1023-S1025 PolarHBondContact O-OG 3.42Å; S1025-L1058 WeakPolarHBondContact O-CD1 3.24Å; S1025-L1058 WeakPolarHBondContact O-CD2 2.91Å
1026	C	54.3	Low	58.3	Low	14 Å²	14	31 Å²	31	10%	0.095	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137	-29.2	-154.3	-72.1	0	0	0	0	112.9	S1017 A1021 L1023 P1024 V1028 N1029 A1030	S1017-C1026 VanDerWaalsContact CB-SG 3.56Å; S1017-C1026 WeakPolarHBondContact O-CB 3.48Å; S1017-C1026 PolarHBondContact OG-O 2.98Å; A1021-C1026 HydrophobicContact CB-CB 3.36Å; L1023-C1026 WeakPolarHBondContact O-CB 3.43Å; P1024-C1026 PolarHBondContact O-N 2.92Å; C1026-V1028 VanDerWaalsContact C-N 3.32Å; C1026-N1029 PolarHBondContact O-N 3.01Å; C1026-A1030 PolarHBondContact O-N 3.32Å; C1026-A1030 VanDerWaalsContact O-N 3.14Å
1027	E	59.4	Low	60.1	Low	45 Å²	45	31.3 Å²	31.3	21%	0.21	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-38.6	163.7	-74.3	150.5	150.9	0	0	110.2	A1021 P1024 N1029 A1030 L1031 R1043	A1021-E1027 HydrophobicContact CB-CG 3.76Å; P1024-E1027 PolarHBondContact O-N 3.45Å; E1027-N1029 VanDerWaalsContact C-N 3.28Å; E1027-N1029 PolarHBondContact O-N 3.23Å; E1027-A1030 PolarHBondContact O-N 2.93Å; E1027-L1031 WeakPolarHBondContact O-CB 3.33Å; E1027-L1031 WeakPolarHBondContact O-CD1 3.49Å; E1027-L1031 VanDerWaalsContact O-CG 3.23Å; E1027-L1031 WeakPolarHBondContact O-CG 3.32Å; E1027-L1031 PolarHBondContact O-N 3.47Å; E1027-R1043 HydrophobicContact CB-CG 3.96Å; E1027-R1043 IonicContact OE1-NH2 3.78Å; E1027-R1043 IonicContact OE2-CZ 3.63Å; E1027-R1043 IonicContact OE2-NE 2.61Å; E1027-R1043 PolarHBondContact OE2-NE 3.47Å; E1027-R1043 IonicContact OE2-NH2 2.69Å; E1027-R1043 PolarHBondContact OE2-NH2 3.49Å
1028	V	67.6	Low	61.8	Low	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-52	-49.6	170.1	178.4	0	0	0	0	111.1	C1026 L1031 L1032 A1040 R1043 Y1044 L1047 M1054 L1058 L1062	C1026-V1028 VanDerWaalsContact C-N 3.32Å; V1028-L1031 PolarHBondContact O-N 2.99Å; V1028-L1032 HydrophobicContact CG1-CD1 4.4Å; V1028-L1032 WeakPolarHBondContact O-CG 3.49Å; V1028-L1032 PolarHBondContact O-N 2.98Å; V1028-L1032 VanDerWaalsContact O-N 3.09Å; V1028-A1040 HydrophobicContact CG1-CB 4.38Å; V1028-R1043 HydrophobicContact CG2-CB 4.05Å; V1028-R1043 HydrophobicContact CG2-CG 3.98Å; V1028-Y1044 HydrophobicContact CG1-CD2 4.08Å; V1028-L1047 HydrophobicContact CG2-CD1 3.73Å; V1028-M1054 HydrophobicContact CG2-CE 4.12Å; V1028-L1058 HydrophobicContact CB-CD1 3.9Å; V1028-L1058 HydrophobicContact CB-CD2 4.07Å; V1028-L1058 HydrophobicContact CB-CG 4.31Å; V1028-L1058 HydrophobicContact CG1-CD1 3.72Å; V1028-L1058 HydrophobicContact CG1-CD2 4.12Å; V1028-L1058 HydrophobicContact CG1-CG 3.96Å; V1028-L1058 HydrophobicContact CG2-CD2 4.39Å; V1028-L1062 HydrophobicContact CG1-CD2 4.31Å
1029	N	63.4	Low	63.4	Low	30 Å²	30	35.4 Å²	35.4	16%	0.16	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-49.5	-177.1	-134.6	14.6	0	0	0	109.3	D1014 C1026 E1027 L1031 L1032 N1033 L1058 R1061	D1014-N1029 WeakPolarHBondContact OD1-CA 3.3Å; D1014-N1029 WeakPolarHBondContact OD1-CB 3.34Å; D1014-N1029 PolarHBondContact OD1-ND2 3.32Å; D1014-N1029 VanDerWaalsContact OD1-O 3.14Å; D1014-N1029 PolarHBondContact OD1-OD1 3.34Å; C1026-N1029 PolarHBondContact O-N 3.01Å; E1027-N1029 VanDerWaalsContact C-N 3.28Å; E1027-N1029 PolarHBondContact O-N 3.23Å; N1029-L1031 VanDerWaalsContact C-N 3.31Å; N1029-L1031 PolarHBondContact O-N 3.11Å; N1029-L1032 WeakPolarHBondContact O-CB 3.28Å; N1029-L1032 PolarHBondContact O-N 2.85Å; N1029-N1033 PolarHBondContact O-N 3.37Å; N1029-N1033 PolarHBondContact O-ND2 2.99Å; N1029-L1058 HydrophobicContact CB-CD1 3.56Å; N1029-L1058 VanDerWaalsContact CG-CD1 3.5Å; N1029-L1058 WeakPolarHBondContact OD1-CD1 3.21Å; N1029-R1061 PolarHBondContact OD1-NH1 3.21Å
1030	A	64.7	Low	65.1	Low	10 Å²	10	35.4 Å²	35.4	8%	0.083	20%	0.204	C	C	.	.	H	α-helix	trans	-55.1	-40.5	174.7	0	0	0	0	0	113.8	L1010 C1026 E1027 L1032 N1033 Q1034	L1010-A1030 HydrophobicContact CD2-CB 4.25Å; L1010-A1030 WeakPolarHBondContact CD2-O 3.47Å; C1026-A1030 PolarHBondContact O-N 3.32Å; C1026-A1030 VanDerWaalsContact O-N 3.14Å; E1027-A1030 PolarHBondContact O-N 2.93Å; A1030-L1032 VanDerWaalsContact C-N 3.34Å; A1030-N1033 PolarHBondContact O-ND2 3.34Å; A1030-Q1034 WeakPolarHBondContact O-CG 3.45Å; A1030-Q1034 PolarHBondContact O-N 3.37Å; A1030-Q1034 PolarHBondContact O-NE2 3.07Å
1031	L	72.9	Confident	66.9	Low	34 Å²	34	31.8 Å²	31.8	18%	0.178	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-30.8	178.4	-69.6	164	0	0	0	112.5	E1027 V1028 N1029 Q1034 N1036 A1039 A1040 R1043	E1027-L1031 WeakPolarHBondContact O-CB 3.33Å; E1027-L1031 WeakPolarHBondContact O-CD1 3.49Å; E1027-L1031 VanDerWaalsContact O-CG 3.23Å; E1027-L1031 WeakPolarHBondContact O-CG 3.32Å; E1027-L1031 PolarHBondContact O-N 3.47Å; V1028-L1031 PolarHBondContact O-N 2.99Å; N1029-L1031 VanDerWaalsContact C-N 3.31Å; N1029-L1031 PolarHBondContact O-N 3.11Å; L1031-Q1034 PolarHBondContact O-N 3.07Å; L1031-N1036 PolarHBondContact O-N 3.43Å; L1031-A1039 HydrophobicContact CD1-CB 4.15Å; L1031-A1039 WeakPolarHBondContact CD1-O 3.33Å; L1031-A1039 HydrophobicContact CD2-CB 3.97Å; L1031-A1040 HydrophobicContact CB-CB 3.63Å; L1031-R1043 HydrophobicContact CD1-CB 3.97Å
1032	L	72.4	Confident	68.8	Low	19 Å²	19	36.8 Å²	36.8	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-44.8	175.3	-69.5	169.4	0	0	0	112.9	V1028 N1029 A1030 Q1034 G1035 A1040 R1061 L1062 A1065	V1028-L1032 HydrophobicContact CG1-CD1 4.4Å; V1028-L1032 WeakPolarHBondContact O-CG 3.49Å; V1028-L1032 PolarHBondContact O-N 2.98Å; V1028-L1032 VanDerWaalsContact O-N 3.09Å; N1029-L1032 WeakPolarHBondContact O-CB 3.28Å; N1029-L1032 PolarHBondContact O-N 2.85Å; A1030-L1032 VanDerWaalsContact C-N 3.34Å; L1032-Q1034 VanDerWaalsContact C-N 3.27Å; L1032-Q1034 PolarHBondContact O-N 2.71Å; L1032-G1035 PolarHBondContact O-N 2.81Å; L1032-A1040 HydrophobicContact CD2-CB 3.63Å; L1032-A1040 HydrophobicContact CG-CB 3.71Å; L1032-R1061 HydrophobicContact CD1-CB 3.76Å; L1032-L1062 HydrophobicContact CD1-CB 4.08Å; L1032-L1062 HydrophobicContact CD2-CB 4.46Å; L1032-L1062 HydrophobicContact CD2-CD1 3.82Å; L1032-A1065 HydrophobicContact CD2-CB 3.75Å
1033	N	70.4	Confident	70.3	Confident	32 Å²	32	38 Å²	38	17%	0.171	22%	0.215	C	C	.	.	H	α-helix	trans	-75.7	-16.5	178.2	-23.1	-86.8	0	0	0	113	L1010 D1014 N1029 A1030 G1035 R1061	L1010-N1033 HydrophobicContact CD2-CB 4.18Å; D1014-N1033 WeakPolarHBondContact CB-ND2 3.12Å; D1014-N1033 VanDerWaalsContact CG-CG 3.42Å; D1014-N1033 PolarHBondContact OD1-ND2 3.5Å; D1014-N1033 PolarHBondContact OD2-ND2 2.69Å; D1014-N1033 PolarHBondContact OD2-OD1 3.27Å; N1029-N1033 PolarHBondContact O-N 3.37Å; N1029-N1033 PolarHBondContact O-ND2 2.99Å; A1030-N1033 PolarHBondContact O-ND2 3.34Å; N1033-G1035 PolarHBondContact O-N 3.25Å; N1033-R1061 PolarHBondContact OD1-NH1 3.16Å; N1033-R1061 VanDerWaalsContact OD1-NH1 3.13Å; N1033-R1061 PolarHBondContact OD1-NH2 3.18Å
1034	Q	72.6	Confident	71.8	Confident	77 Å²	77	35.3 Å²	35.3	36%	0.36	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	1.6	167.1	-70.2	172	40.1	0	0	112	L1010 A1030 L1031 L1032 N1036	L1010-Q1034 HydrophobicContact CD1-CG 4.12Å; L1010-Q1034 HydrophobicContact CD2-CG 4.22Å; L1010-Q1034 HydrophobicContact CG-CG 4.31Å; A1030-Q1034 WeakPolarHBondContact O-CG 3.45Å; A1030-Q1034 PolarHBondContact O-N 3.37Å; A1030-Q1034 PolarHBondContact O-NE2 3.07Å; L1031-Q1034 PolarHBondContact O-N 3.07Å; L1032-Q1034 VanDerWaalsContact C-N 3.27Å; L1032-Q1034 PolarHBondContact O-N 2.71Å; Q1034-N1036 HydrophobicContact CB-CB 4.44Å; Q1034-N1036 PolarHBondContact O-N 2.74Å; Q1034-N1036 VanDerWaalsContact O-N 3.15Å
1035	G	74.8	Confident	73.3	Confident	55 Å²	55	35.4 Å²	35.4	57%	0.567	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	8.4	-173.2	0	0	0	0	0	113.5	L1032 N1033 I1037	L1032-G1035 PolarHBondContact O-N 2.81Å; N1033-G1035 PolarHBondContact O-N 3.25Å; G1035-I1037 VanDerWaalsContact C-N 3.3Å; G1035-I1037 PolarHBondContact O-N 3.03Å; G1035-I1037 VanDerWaalsContact O-N 3.09Å
1036	N	79.3	Confident	74.5	Confident	73 Å²	73	38.4 Å²	38.4	39%	0.39	21%	0.212	S	C	.	.			trans	-91.9	69.7	-175.6	-165.1	-13.1	0	0	0	109.9	L1031 Q1034 D1038 A1039 A1040	L1031-N1036 PolarHBondContact O-N 3.43Å; Q1034-N1036 HydrophobicContact CB-CB 4.44Å; Q1034-N1036 PolarHBondContact O-N 2.74Å; Q1034-N1036 VanDerWaalsContact O-N 3.15Å; N1036-D1038 VanDerWaalsContact C-N 3.3Å; N1036-D1038 PolarHBondContact O-N 2.95Å; N1036-A1039 HydrophobicContact CB-CB 4.32Å; N1036-A1039 VanDerWaalsContact CG-CB 3.4Å; N1036-A1039 WeakPolarHBondContact ND2-CB 3.29Å; N1036-A1039 PolarHBondContact O-N 3.5Å; N1036-A1039 VanDerWaalsContact OD1-CB 3.25Å; N1036-A1039 WeakPolarHBondContact OD1-CB 3.37Å; N1036-A1039 PolarHBondContact OD1-N 2.95Å; N1036-A1040 WeakPolarHBondContact O-CB 3.46Å; N1036-A1040 PolarHBondContact O-N 3.26Å
1037	I	82.6	Confident	75.3	Confident	39 Å²	39	38 Å²	38	20%	0.2	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-39.9	-172.4	-53.5	175.7	0	0	0	111.1	G1035 A1040 A1041 A1065 L1066 A1069	G1035-I1037 VanDerWaalsContact C-N 3.3Å; G1035-I1037 PolarHBondContact O-N 3.03Å; G1035-I1037 VanDerWaalsContact O-N 3.09Å; I1037-A1040 PolarHBondContact O-N 2.82Å; I1037-A1041 WeakPolarHBondContact O-CB 3.23Å; I1037-A1041 PolarHBondContact O-N 3.01Å; I1037-A1065 HydrophobicContact CD1-CB 4.1Å; I1037-A1065 HydrophobicContact CG1-CB 4.06Å; I1037-A1065 HydrophobicContact CG2-CB 3.99Å; I1037-L1066 HydrophobicContact CG2-CB 4.4Å; I1037-L1066 HydrophobicContact CG2-CD2 3.49Å; I1037-L1066 VanDerWaalsContact CG2-CD2 3.49Å; I1037-L1066 HydrophobicContact CG2-CG 3.68Å; I1037-A1069 HydrophobicContact CD1-CB 3.87Å
1038	D	80.8	Confident	75.8	Confident	85 Å²	85	36.6 Å²	36.6	46%	0.455	21%	0.206	S	C	.	.	H	α-helix	trans	-69.6	-44.3	179.6	-63.5	-45.2	0	0	0	111.9	N1036 A1040 A1041 D1042 N1071	N1036-D1038 VanDerWaalsContact C-N 3.3Å; N1036-D1038 PolarHBondContact O-N 2.95Å; D1038-A1040 VanDerWaalsContact C-N 3.33Å; D1038-A1040 PolarHBondContact O-N 3.39Å; D1038-A1041 WeakPolarHBondContact O-CB 3.34Å; D1038-A1041 PolarHBondContact O-N 3.35Å; D1038-D1042 PolarHBondContact O-N 3.39Å; D1038-N1071 PolarHBondContact OD1-ND2 2.83Å
1039	A	79.4	Confident	76.1	Confident	29 Å²	29	38.8 Å²	38.8	24%	0.24	22%	0.216	C	C	.	.	H	α-helix	trans	-66.6	-35.6	175	0	0	0	0	0	112.3	L1031 N1036 A1041 D1042 R1043	L1031-A1039 HydrophobicContact CD1-CB 4.15Å; L1031-A1039 WeakPolarHBondContact CD1-O 3.33Å; L1031-A1039 HydrophobicContact CD2-CB 3.97Å; N1036-A1039 HydrophobicContact CB-CB 4.32Å; N1036-A1039 VanDerWaalsContact CG-CB 3.4Å; N1036-A1039 WeakPolarHBondContact ND2-CB 3.29Å; N1036-A1039 PolarHBondContact O-N 3.5Å; N1036-A1039 VanDerWaalsContact OD1-CB 3.25Å; N1036-A1039 WeakPolarHBondContact OD1-CB 3.37Å; N1036-A1039 PolarHBondContact OD1-N 2.95Å; A1039-A1041 VanDerWaalsContact C-N 3.3Å; A1039-A1041 PolarHBondContact O-N 3.34Å; A1039-D1042 PolarHBondContact O-N 3.04Å; A1039-R1043 WeakPolarHBondContact O-CB 3.45Å; A1039-R1043 PolarHBondContact O-N 3.23Å
1040	A	80.9	Confident	76.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-40.9	172.7	0	0	0	0	0	111.5	V1028 L1031 L1032 N1036 I1037 D1038 Y1044 L1062	V1028-A1040 HydrophobicContact CG1-CB 4.38Å; L1031-A1040 HydrophobicContact CB-CB 3.63Å; L1032-A1040 HydrophobicContact CD2-CB 3.63Å; L1032-A1040 HydrophobicContact CG-CB 3.71Å; N1036-A1040 WeakPolarHBondContact O-CB 3.46Å; N1036-A1040 PolarHBondContact O-N 3.26Å; I1037-A1040 PolarHBondContact O-N 2.82Å; D1038-A1040 VanDerWaalsContact C-N 3.33Å; D1038-A1040 PolarHBondContact O-N 3.39Å; A1040-Y1044 WeakPolarHBondContact O-CB 3.14Å; A1040-Y1044 PolarHBondContact O-N 3.15Å; A1040-L1062 HydrophobicContact CB-CD1 4.09Å
1041	A	84.1	Confident	76	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-48.7	176	0	0	0	0	0	112.9	I1037 D1038 A1039 R1043 Y1044 Y1045 L1062 L1066 T1074 I1078	I1037-A1041 WeakPolarHBondContact O-CB 3.23Å; I1037-A1041 PolarHBondContact O-N 3.01Å; D1038-A1041 WeakPolarHBondContact O-CB 3.34Å; D1038-A1041 PolarHBondContact O-N 3.35Å; A1039-A1041 VanDerWaalsContact C-N 3.3Å; A1039-A1041 PolarHBondContact O-N 3.34Å; A1041-R1043 VanDerWaalsContact C-N 3.34Å; A1041-R1043 PolarHBondContact O-N 3.13Å; A1041-Y1044 PolarHBondContact O-N 2.95Å; A1041-Y1045 WeakPolarHBondContact O-CB 3.28Å; A1041-Y1045 PolarHBondContact O-N 3.19Å; A1041-L1062 HydrophobicContact CB-CD1 4.18Å; A1041-L1066 HydrophobicContact CB-CD1 4.44Å; A1041-L1066 HydrophobicContact CB-CD2 4.36Å; A1041-T1074 HydrophobicContact CB-CG2 3.25Å; A1041-I1078 HydrophobicContact CB-CD1 3.68Å
1042	D	82.9	Confident	75.3	Confident	108 Å²	108	45 Å²	45	58%	0.578	27%	0.268	S	S	*	.	H	α-helix	trans	-59.8	-45.6	176.7	-73.8	-20.3	0	0	0	110.7	D1038 A1039 Y1045 E1046	D1038-D1042 PolarHBondContact O-N 3.39Å; A1039-D1042 PolarHBondContact O-N 3.04Å; D1042-Y1045 WeakPolarHBondContact O-CB 3.36Å; D1042-Y1045 PolarHBondContact O-N 3.44Å; D1042-E1046 PolarHBondContact O-N 2.92Å
1043	R	78.4	Confident	74.6	Confident	58 Å²	58	48.5 Å²	48.5	22%	0.219	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-43.8	175.9	-169	53.1	169.3	-179.9	-3.6	111	E1027 V1028 L1031 A1039 A1041 Y1045 E1046 L1047	E1027-R1043 HydrophobicContact CB-CG 3.96Å; E1027-R1043 IonicContact OE1-NH2 3.78Å; E1027-R1043 IonicContact OE2-CZ 3.63Å; E1027-R1043 IonicContact OE2-NE 2.61Å; E1027-R1043 PolarHBondContact OE2-NE 3.47Å; E1027-R1043 IonicContact OE2-NH2 2.69Å; E1027-R1043 PolarHBondContact OE2-NH2 3.49Å; V1028-R1043 HydrophobicContact CG2-CB 4.05Å; V1028-R1043 HydrophobicContact CG2-CG 3.98Å; L1031-R1043 HydrophobicContact CD1-CB 3.97Å; A1039-R1043 WeakPolarHBondContact O-CB 3.45Å; A1039-R1043 PolarHBondContact O-N 3.23Å; A1041-R1043 VanDerWaalsContact C-N 3.34Å; A1041-R1043 PolarHBondContact O-N 3.13Å; R1043-Y1045 PolarHBondContact O-N 3.18Å; R1043-E1046 VanDerWaalsContact CD-OE2 3.31Å; R1043-E1046 WeakPolarHBondContact CD-OE2 3.37Å; R1043-E1046 IonicContact CZ-OE2 3.3Å; R1043-E1046 IonicContact NE-OE2 3.35Å; R1043-E1046 IonicContact NH1-OE2 3.21Å; R1043-E1046 PolarHBondContact NH1-OE2 3.23Å; R1043-E1046 PolarHBondContact O-N 3.42Å; R1043-L1047 HydrophobicContact CG-CD1 4.06Å; R1043-L1047 VanDerWaalsContact O-CD1 3.32Å; R1043-L1047 WeakPolarHBondContact O-CD1 3.33Å; R1043-L1047 WeakPolarHBondContact O-CG 3.39Å; R1043-L1047 PolarHBondContact O-N 2.94Å
1044	Y	82.5	Confident	74.5	Confident	2 Å²	2	48 Å²	48	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-40.8	177.1	-173.9	-67	0	0	0	111	V1028 A1040 A1041 L1047 G1048 M1054 L1058 S1059 L1062 I1078 V1082	V1028-Y1044 HydrophobicContact CG1-CD2 4.08Å; A1040-Y1044 WeakPolarHBondContact O-CB 3.14Å; A1040-Y1044 PolarHBondContact O-N 3.15Å; A1041-Y1044 PolarHBondContact O-N 2.95Å; Y1044-L1047 PolarHBondContact O-N 3.41Å; Y1044-G1048 PolarHBondContact O-N 3.11Å; Y1044-G1048 VanDerWaalsContact O-N 3.09Å; Y1044-M1054 HydrophobicContact CD1-CE 4.13Å; Y1044-M1054 HydrophobicContact CD2-CE 3.41Å; Y1044-M1054 VanDerWaalsContact CD2-CE 3.41Å; Y1044-M1054 HydrophobicContact CE1-CB 4.48Å; Y1044-M1054 HydrophobicContact CE1-CE 4.34Å; Y1044-M1054 HydrophobicContact CE1-CG 4.19Å; Y1044-M1054 HydrophobicContact CE2-CB 3.98Å; Y1044-M1054 HydrophobicContact CE2-CE 3.68Å; Y1044-M1054 HydrophobicContact CE2-CG 4.23Å; Y1044-M1054 HydrophobicContact CG-CE 3.64Å; Y1044-M1054 WeakPolarHBondContact OH-CB 3.48Å; Y1044-L1058 HydrophobicContact CD2-CD2 3.94Å; Y1044-L1058 HydrophobicContact CD2-CG 4.26Å; Y1044-L1058 HydrophobicContact CE2-CD2 4.05Å; Y1044-L1058 HydrophobicContact CE2-CG 4.33Å; Y1044-S1059 PolarHBondContact OH-OG 3.01Å; Y1044-L1062 HydrophobicContact CD1-CD2 4.16Å; Y1044-L1062 HydrophobicContact CD2-CD2 3.36Å; Y1044-L1062 HydrophobicContact CE2-CD2 4.24Å; Y1044-L1062 HydrophobicContact CG-CD2 3.34Å; Y1044-I1078 HydrophobicContact CD1-CG2 3.29Å; Y1044-I1078 HydrophobicContact CE1-CG2 3.39Å; Y1044-I1078 HydrophobicContact CG-CG2 4.06Å; Y1044-V1082 HydrophobicContact CE1-CG2 4.39Å
1045	Y	82.3	Confident	74.2	Confident	20 Å²	20	46.7 Å²	46.7	8%	0.078	30%	0.295	C	S	.	.	H	α-helix	trans	-57.8	-52	177.9	-170.8	-63.6	0	0	0	111.3	E309 A1041 D1042 R1043 L1047 G1048 K1049 K1077 Y1081	E309-Y1045 HydrophobicContact CG-CD1 3.83Å; E309-Y1045 HydrophobicContact CG-CE1 3.26Å; E309-Y1045 HydrophobicContact CG-CE2 4.48Å; E309-Y1045 WeakPolarHBondContact OE1-CD1 3.47Å; E309-Y1045 WeakPolarHBondContact OE1-CE1 3.41Å; A1041-Y1045 WeakPolarHBondContact O-CB 3.28Å; A1041-Y1045 PolarHBondContact O-N 3.19Å; D1042-Y1045 WeakPolarHBondContact O-CB 3.36Å; D1042-Y1045 PolarHBondContact O-N 3.44Å; R1043-Y1045 PolarHBondContact O-N 3.18Å; Y1045-L1047 PolarHBondContact O-N 2.86Å; Y1045-L1047 VanDerWaalsContact O-N 3.11Å; Y1045-G1048 PolarHBondContact O-N 3.36Å; Y1045-K1049 HydrophobicContact CE1-CD 4.44Å; Y1045-K1049 HydrophobicContact CE1-CG 4.4Å; Y1045-K1049 PolarHBondContact O-N 3.37Å; Y1045-K1077 HydrophobicContact CD2-CB 4.35Å; Y1045-K1077 HydrophobicContact CE2-CB 4.24Å; Y1045-Y1081 AromaticContact CD1-CE2 3.97Å; Y1045-Y1081 HydrophobicContact CD1-CE2 3.97Å; Y1045-Y1081 HydrophobicContact CD2-CD2 4.43Å; Y1045-Y1081 AromaticContact CD2-CE2 3.71Å; Y1045-Y1081 HydrophobicContact CD2-CE2 3.71Å; Y1045-Y1081 AromaticContact CE1-CE2 3.79Å; Y1045-Y1081 HydrophobicContact CE1-CE2 3.79Å; Y1045-Y1081 AromaticContact CE1-CZ 3.73Å; Y1045-Y1081 WeakPolarHBondContact CE1-OH 3.29Å; Y1045-Y1081 AromaticContact CE2-CE2 3.6Å; Y1045-Y1081 HydrophobicContact CE2-CE2 3.6Å; Y1045-Y1081 AromaticContact CG-CE2 3.9Å; Y1045-Y1081 HydrophobicContact CG-CE2 3.9Å; Y1045-Y1081 AromaticContact CZ-CE2 3.65Å; Y1045-Y1081 AromaticContact CZ-CZ 3.78Å; Y1045-Y1081 PolarHBondContact OH-OH 3.45Å; Y1045-Y1081 VanDerWaalsContact OH-OH 3.09Å
1046	E	78.3	Confident	74	Confident	75 Å²	75	45.9 Å²	45.9	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-54.3	-33.4	179.8	-73.5	-172.4	142.8	0	0	113	D1042 R1043 K1049 S1050	D1042-E1046 PolarHBondContact O-N 2.92Å; R1043-E1046 VanDerWaalsContact CD-OE2 3.31Å; R1043-E1046 WeakPolarHBondContact CD-OE2 3.37Å; R1043-E1046 IonicContact CZ-OE2 3.3Å; R1043-E1046 IonicContact NE-OE2 3.35Å; R1043-E1046 IonicContact NH1-OE2 3.21Å; R1043-E1046 PolarHBondContact NH1-OE2 3.23Å; R1043-E1046 PolarHBondContact O-N 3.42Å; E1046-K1049 WeakPolarHBondContact O-CB 3.43Å; E1046-K1049 PolarHBondContact O-N 3.33Å; E1046-S1050 PolarHBondContact O-N 3.04Å; E1046-S1050 VanDerWaalsContact O-N 3.15Å
1047	L	71.2	Confident	73.5	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-85.1	-34.5	-173.4	-54.1	168.3	0	0	0	112	P1024 V1028 R1043 Y1044 Y1045 K1049 S1050 Q1052 M1054	P1024-L1047 HydrophobicContact CB-CB 4.01Å; P1024-L1047 HydrophobicContact CB-CD1 3.57Å; P1024-L1047 HydrophobicContact CB-CD2 3.25Å; P1024-L1047 HydrophobicContact CB-CG 3.67Å; P1024-L1047 HydrophobicContact CG-CD2 3.37Å; P1024-L1047 HydrophobicContact CG-CG 4.35Å; P1024-L1047 WeakPolarHBondContact O-CD1 3.12Å; V1028-L1047 HydrophobicContact CG2-CD1 3.73Å; R1043-L1047 HydrophobicContact CG-CD1 4.06Å; R1043-L1047 VanDerWaalsContact O-CD1 3.32Å; R1043-L1047 WeakPolarHBondContact O-CD1 3.33Å; R1043-L1047 WeakPolarHBondContact O-CG 3.39Å; R1043-L1047 PolarHBondContact O-N 2.94Å; Y1044-L1047 PolarHBondContact O-N 3.41Å; Y1045-L1047 PolarHBondContact O-N 2.86Å; Y1045-L1047 VanDerWaalsContact O-N 3.11Å; L1047-K1049 PolarHBondContact O-N 3.17Å; L1047-S1050 PolarHBondContact O-N 3.1Å; L1047-S1050 PolarHBondContact O-OG 3.09Å; L1047-Q1052 PolarHBondContact O-N 2.66Å; L1047-M1054 HydrophobicContact CB-CE 3.79Å; L1047-M1054 HydrophobicContact CB-SD 3.65Å; L1047-M1054 HydrophobicContact CD1-CE 3.67Å; L1047-M1054 HydrophobicContact CD1-SD 4.2Å; L1047-M1054 HydrophobicContact CG-CE 4.39Å
1048	G	69.8	Low	73	Confident	15 Å²	15	45.6 Å²	45.6	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-35.8	165	0	0	0	0	0	112.1	Y1044 Y1045 G1051 Y1081	Y1044-G1048 PolarHBondContact O-N 3.11Å; Y1044-G1048 VanDerWaalsContact O-N 3.09Å; Y1045-G1048 PolarHBondContact O-N 3.36Å; G1048-G1051 PolarHBondContact O-N 3.18Å; G1048-Y1081 WeakPolarHBondContact O-CD1 3.46Å
1049	K	74.3	Confident	73	Confident	46 Å²	46	41.6 Å²	41.6	20%	0.2	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-42	175.8	-133.6	-167.5	-158.2	-179.8	0	113.1	G306 H307 E309 Y1045 E1046 L1047 G1051	G306-K1049 WeakPolarHBondContact O-CD 3.28Å; G306-K1049 WeakPolarHBondContact O-CE 3.01Å; G306-K1049 VanDerWaalsContact O-CG 3.23Å; G306-K1049 WeakPolarHBondContact O-CG 2.93Å; H307-K1049 PolarHBondContact CE1-NZ 3.38Å; E309-K1049 VanDerWaalsContact CD-CE 3.42Å; E309-K1049 WeakPolarHBondContact OE1-CD 3.47Å; E309-K1049 WeakPolarHBondContact OE1-CE 3.49Å; E309-K1049 IonicContact OE1-NZ 2.65Å; E309-K1049 PolarHBondContact OE1-NZ 2.7Å; E309-K1049 IonicContact OE2-NZ 2.67Å; E309-K1049 PolarHBondContact OE2-NZ 2.66Å; Y1045-K1049 HydrophobicContact CE1-CD 4.44Å; Y1045-K1049 HydrophobicContact CE1-CG 4.4Å; Y1045-K1049 PolarHBondContact O-N 3.37Å; E1046-K1049 WeakPolarHBondContact O-CB 3.43Å; E1046-K1049 PolarHBondContact O-N 3.33Å; L1047-K1049 PolarHBondContact O-N 3.17Å; K1049-G1051 PolarHBondContact O-N 3Å; K1049-G1051 VanDerWaalsContact O-N 3.12Å
1050	S	62.9	Low	72.9	Confident	71 Å²	71	41.5 Å²	41.5	50%	0.497	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	0.9	-177.8	71.7	0	0	0	0	114.4	E1046 L1047 Q1052	E1046-S1050 PolarHBondContact O-N 3.04Å; E1046-S1050 VanDerWaalsContact O-N 3.15Å; L1047-S1050 PolarHBondContact O-N 3.1Å; L1047-S1050 PolarHBondContact O-OG 3.09Å; S1050-Q1052 PolarHBondContact O-N 2.99Å
1051	G	62.8	Low	72.9	Confident	70 Å²	70	44.8 Å²	44.8	72%	0.722	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	9.4	-177.2	0	0	0	0	0	113.8	G1048 K1049	G1048-G1051 PolarHBondContact O-N 3.18Å; K1049-G1051 PolarHBondContact O-N 3Å; K1049-G1051 VanDerWaalsContact O-N 3.12Å
1052	Q	59.1	Low	72.9	Confident	64 Å²	64	44.7 Å²	44.7	30%	0.299	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-80.1	125.5	177.1	-174.4	160.7	-24.8	0	0	110.7	L1047 S1050 M1054	L1047-Q1052 PolarHBondContact O-N 2.66Å; S1050-Q1052 PolarHBondContact O-N 2.99Å; Q1052-M1054 PolarHBondContact O-N 3.22Å
1053	A	57.9	Low	72.9	Confident	93 Å²	93	39.6 Å²	39.6	77%	0.769	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-64.7	127.4	175.5	0	0	0	0	0	110.6
1054	M	66.9	Low	73.1	Confident	22 Å²	22	37.6 Å²	37.6	11%	0.108	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-95	139.9	-176.6	-66.7	-65.5	-91.3	0	0	111.3	V1028 Y1044 L1047 Q1052 L1058	V1028-M1054 HydrophobicContact CG2-CE 4.12Å; Y1044-M1054 HydrophobicContact CD1-CE 4.13Å; Y1044-M1054 HydrophobicContact CD2-CE 3.41Å; Y1044-M1054 VanDerWaalsContact CD2-CE 3.41Å; Y1044-M1054 HydrophobicContact CE1-CB 4.48Å; Y1044-M1054 HydrophobicContact CE1-CE 4.34Å; Y1044-M1054 HydrophobicContact CE1-CG 4.19Å; Y1044-M1054 HydrophobicContact CE2-CB 3.98Å; Y1044-M1054 HydrophobicContact CE2-CE 3.68Å; Y1044-M1054 HydrophobicContact CE2-CG 4.23Å; Y1044-M1054 HydrophobicContact CG-CE 3.64Å; Y1044-M1054 WeakPolarHBondContact OH-CB 3.48Å; L1047-M1054 HydrophobicContact CB-CE 3.79Å; L1047-M1054 HydrophobicContact CB-SD 3.65Å; L1047-M1054 HydrophobicContact CD1-CE 3.67Å; L1047-M1054 HydrophobicContact CD1-SD 4.2Å; L1047-M1054 HydrophobicContact CG-CE 4.39Å; Q1052-M1054 PolarHBondContact O-N 3.22Å; M1054-L1058 HydrophobicContact CE-CD2 3.56Å; M1054-L1058 HydrophobicContact SD-CD2 4.49Å
1055	P	67	Low	73.1	Confident	49 Å²	49	38.6 Å²	38.6	32%	0.318	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-61.4	143.5	176.1	-25	35	0	0	0	113.4	L1058 S1059	P1055-L1058 HydrophobicContact CB-CB 4.17Å; P1055-L1058 WeakPolarHBondContact O-CB 3.36Å; P1055-L1058 PolarHBondContact O-N 2.82Å; P1055-S1059 PolarHBondContact O-N 3.46Å; P1055-S1059 PolarHBondContact O-OG 2.77Å
1056	V	70.4	Confident	73.2	Confident	38 Å²	38	37.6 Å²	37.6	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-41.1	-178.9	-178.4	0	0	0	0	111.5	L1058 S1059 R1060 D1086 Y1089 L1090	V1056-L1058 VanDerWaalsContact C-N 3.35Å; V1056-L1058 PolarHBondContact O-N 2.97Å; V1056-S1059 WeakPolarHBondContact O-CB 3.18Å; V1056-S1059 PolarHBondContact O-N 2.85Å; V1056-R1060 PolarHBondContact O-N 3.33Å; V1056-D1086 HydrophobicContact CG2-CB 4.13Å; V1056-D1086 WeakPolarHBondContact CG2-OD1 3.41Å; V1056-Y1089 HydrophobicContact CG1-CD1 3.46Å; V1056-Y1089 VanDerWaalsContact CG1-CD1 3.46Å; V1056-Y1089 HydrophobicContact CG1-CE1 3.7Å; V1056-L1090 HydrophobicContact CG1-CD1 4Å; V1056-L1090 HydrophobicContact CG1-CD2 3.86Å; V1056-L1090 HydrophobicContact CG1-CG 3.96Å
1057	Q	69.1	Low	73.2	Confident	100 Å²	100	37.6 Å²	37.6	47%	0.467	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-40.2	176.6	-64.9	123.5	-52.7	0	0	112.6	S1059 R1060 R1061 E1286	Q1057-S1059 VanDerWaalsContact C-N 3.31Å; Q1057-S1059 PolarHBondContact O-N 3.41Å; Q1057-R1060 VanDerWaalsContact O-CB 3.31Å; Q1057-R1060 WeakPolarHBondContact O-CB 3.26Å; Q1057-R1060 PolarHBondContact O-N 3.41Å; Q1057-R1061 PolarHBondContact O-N 3.49Å; Q1057-R1061 VanDerWaalsContact O-N 3.09Å; Q1057-E1286 PolarHBondContact NE2-OE1 2.88Å
1058	L	72.6	Confident	73.3	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-43.7	176.7	-178	73.5	0	0	0	111.4	S1025 V1028 N1029 Y1044 M1054 P1055 V1056 R1060 R1061 L1062	S1025-L1058 WeakPolarHBondContact O-CD1 3.24Å; S1025-L1058 WeakPolarHBondContact O-CD2 2.91Å; V1028-L1058 HydrophobicContact CB-CD1 3.9Å; V1028-L1058 HydrophobicContact CB-CD2 4.07Å; V1028-L1058 HydrophobicContact CB-CG 4.31Å; V1028-L1058 HydrophobicContact CG1-CD1 3.72Å; V1028-L1058 HydrophobicContact CG1-CD2 4.12Å; V1028-L1058 HydrophobicContact CG1-CG 3.96Å; V1028-L1058 HydrophobicContact CG2-CD2 4.39Å; N1029-L1058 HydrophobicContact CB-CD1 3.56Å; N1029-L1058 VanDerWaalsContact CG-CD1 3.5Å; N1029-L1058 WeakPolarHBondContact OD1-CD1 3.21Å; Y1044-L1058 HydrophobicContact CD2-CD2 3.94Å; Y1044-L1058 HydrophobicContact CD2-CG 4.26Å; Y1044-L1058 HydrophobicContact CE2-CD2 4.05Å; Y1044-L1058 HydrophobicContact CE2-CG 4.33Å; M1054-L1058 HydrophobicContact CE-CD2 3.56Å; M1054-L1058 HydrophobicContact SD-CD2 4.49Å; P1055-L1058 HydrophobicContact CB-CB 4.17Å; P1055-L1058 WeakPolarHBondContact O-CB 3.36Å; P1055-L1058 PolarHBondContact O-N 2.82Å; V1056-L1058 VanDerWaalsContact C-N 3.35Å; V1056-L1058 PolarHBondContact O-N 2.97Å; L1058-R1060 VanDerWaalsContact C-N 3.31Å; L1058-R1060 PolarHBondContact O-N 2.75Å; L1058-R1061 PolarHBondContact O-N 3.11Å; L1058-L1062 PolarHBondContact O-N 2.88Å
1059	S	80.4	Confident	73.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-40.6	176	-49.3	0	0	0	0	111	Y1044 P1055 V1056 Q1057 F1063 L1090	Y1044-S1059 PolarHBondContact OH-OG 3.01Å; P1055-S1059 PolarHBondContact O-N 3.46Å; P1055-S1059 PolarHBondContact O-OG 2.77Å; V1056-S1059 WeakPolarHBondContact O-CB 3.18Å; V1056-S1059 PolarHBondContact O-N 2.85Å; Q1057-S1059 VanDerWaalsContact C-N 3.31Å; Q1057-S1059 PolarHBondContact O-N 3.41Å; S1059-F1063 VanDerWaalsContact O-CD2 3.26Å; S1059-F1063 WeakPolarHBondContact O-CD2 3.29Å; S1059-F1063 PolarHBondContact O-N 3.38Å; S1059-L1090 VanDerWaalsContact CB-CD1 3.41Å
1060	R	77.7	Confident	73.5	Confident	27 Å²	27	44 Å²	44	10%	0.102	28%	0.276	C	S	.	.	H	α-helix	trans	-57.8	-54	174.1	-165.5	175.2	-85.5	148.4	-4.9	111.7	V1056 Q1057 L1058 L1062 F1063 G1064 Y1089 L1090 N1285 E1288	V1056-R1060 PolarHBondContact O-N 3.33Å; Q1057-R1060 VanDerWaalsContact O-CB 3.31Å; Q1057-R1060 WeakPolarHBondContact O-CB 3.26Å; Q1057-R1060 PolarHBondContact O-N 3.41Å; L1058-R1060 VanDerWaalsContact C-N 3.31Å; L1058-R1060 PolarHBondContact O-N 2.75Å; R1060-L1062 PolarHBondContact O-N 3.46Å; R1060-F1063 PolarHBondContact O-N 3.5Å; R1060-G1064 PolarHBondContact O-N 3.05Å; R1060-Y1089 PolarHBondContact NH2-OH 3.15Å; R1060-L1090 HydrophobicContact CB-CD2 3.58Å; R1060-L1090 HydrophobicContact CG-CD2 3.9Å; R1060-N1285 VanDerWaalsContact CD-O 3.29Å; R1060-N1285 WeakPolarHBondContact CD-O 3.21Å; R1060-N1285 PolarHBondContact NH1-O 3.4Å; R1060-E1288 PolarHBondContact NH2-O 3.45Å
1061	R	79.5	Confident	74.2	Confident	69 Å²	69	42.5 Å²	42.5	26%	0.26	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-43.5	-177.6	-64.7	-175.3	83.3	-161.1	10.8	112.2	D1014 N1029 L1032 N1033 Q1057 L1058 G1064 A1065	D1014-R1061 IonicContact OD1-NH1 3.02Å; D1014-R1061 PolarHBondContact OD1-NH1 2.94Å; D1014-R1061 IonicContact OD2-CZ 3.78Å; D1014-R1061 IonicContact OD2-NH1 3.32Å; D1014-R1061 PolarHBondContact OD2-NH1 3.14Å; D1014-R1061 IonicContact OD2-NH2 2.78Å; N1029-R1061 PolarHBondContact OD1-NH1 3.21Å; L1032-R1061 HydrophobicContact CD1-CB 3.76Å; N1033-R1061 PolarHBondContact OD1-NH1 3.16Å; N1033-R1061 VanDerWaalsContact OD1-NH1 3.13Å; N1033-R1061 PolarHBondContact OD1-NH2 3.18Å; Q1057-R1061 PolarHBondContact O-N 3.49Å; Q1057-R1061 VanDerWaalsContact O-N 3.09Å; L1058-R1061 PolarHBondContact O-N 3.11Å; R1061-G1064 PolarHBondContact O-N 3.27Å; R1061-A1065 PolarHBondContact O-N 3.18Å
1062	L	85	Confident	74.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-46.3	-179.3	178	57.1	0	0	0	112.6	V1028 L1032 A1040 A1041 Y1044 L1058 R1060 G1064 A1065 L1066 I1078	V1028-L1062 HydrophobicContact CG1-CD2 4.31Å; L1032-L1062 HydrophobicContact CD1-CB 4.08Å; L1032-L1062 HydrophobicContact CD2-CB 4.46Å; L1032-L1062 HydrophobicContact CD2-CD1 3.82Å; A1040-L1062 HydrophobicContact CB-CD1 4.09Å; A1041-L1062 HydrophobicContact CB-CD1 4.18Å; Y1044-L1062 HydrophobicContact CD1-CD2 4.16Å; Y1044-L1062 HydrophobicContact CD2-CD2 3.36Å; Y1044-L1062 HydrophobicContact CE2-CD2 4.24Å; Y1044-L1062 HydrophobicContact CG-CD2 3.34Å; L1058-L1062 PolarHBondContact O-N 2.88Å; R1060-L1062 PolarHBondContact O-N 3.46Å; L1062-G1064 VanDerWaalsContact C-N 3.35Å; L1062-A1065 PolarHBondContact O-N 3.06Å; L1062-L1066 HydrophobicContact CD1-CD1 3.8Å; L1062-L1066 HydrophobicContact CD1-CG 4.18Å; L1062-L1066 HydrophobicContact CG-CD1 3.88Å; L1062-L1066 WeakPolarHBondContact O-CB 3.46Å; L1062-L1066 WeakPolarHBondContact O-CD1 3.49Å; L1062-L1066 VanDerWaalsContact O-CG 3.32Å; L1062-L1066 WeakPolarHBondContact O-CG 3.46Å; L1062-L1066 PolarHBondContact O-N 3.1Å; L1062-I1078 HydrophobicContact CD1-CD1 4.35Å; L1062-I1078 HydrophobicContact CD2-CD1 3.68Å; L1062-I1078 HydrophobicContact CD2-CG1 4.46Å; L1062-I1078 HydrophobicContact CD2-CG2 4.2Å; L1062-I1078 HydrophobicContact CG-CD1 4.01Å
1063	F	83.8	Confident	75.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-70.1	-32	177.3	-81.1	-106.1	0	0	0	112.4	S1059 R1060 R1067 M1075 I1078 R1079 V1082 L1092 M1095 I1096	S1059-F1063 VanDerWaalsContact O-CD2 3.26Å; S1059-F1063 WeakPolarHBondContact O-CD2 3.29Å; S1059-F1063 PolarHBondContact O-N 3.38Å; R1060-F1063 PolarHBondContact O-N 3.5Å; F1063-R1067 VanDerWaalsContact O-CB 3.32Å; F1063-R1067 WeakPolarHBondContact O-CB 3.39Å; F1063-R1067 PolarHBondContact O-N 2.76Å; F1063-M1075 HydrophobicContact CB-CE 4.21Å; F1063-M1075 HydrophobicContact CD1-CB 3.84Å; F1063-M1075 HydrophobicContact CD1-CE 3.72Å; F1063-M1075 HydrophobicContact CD1-CG 4.02Å; F1063-M1075 HydrophobicContact CE1-CB 3.71Å; F1063-M1075 HydrophobicContact CE1-CG 4.36Å; F1063-M1075 VanDerWaalsContact CE1-O 3.27Å; F1063-M1075 WeakPolarHBondContact CE1-O 3.4Å; F1063-M1075 HydrophobicContact CG-CE 4.41Å; F1063-M1075 WeakPolarHBondContact CZ-O 3.24Å; F1063-M1075 WeakPolarHBondContact O-CE 3.48Å; F1063-I1078 HydrophobicContact CE2-CB 4.06Å; F1063-I1078 HydrophobicContact CE2-CG2 3.55Å; F1063-I1078 HydrophobicContact CZ-CB 3.93Å; F1063-I1078 HydrophobicContact CZ-CG2 3.87Å; F1063-R1079 HydrophobicContact CE1-CB 4.17Å; F1063-R1079 HydrophobicContact CZ-CB 3.97Å; F1063-V1082 HydrophobicContact CE2-CG2 4.1Å; F1063-V1082 HydrophobicContact CZ-CG2 4.38Å; F1063-L1092 HydrophobicContact CB-CD2 3.67Å; F1063-L1092 HydrophobicContact CD1-CB 4.07Å; F1063-L1092 HydrophobicContact CD1-CD1 4.18Å; F1063-L1092 HydrophobicContact CD1-CD2 3.68Å; F1063-L1092 HydrophobicContact CD1-CG 4.19Å; F1063-L1092 HydrophobicContact CD2-CD1 4.14Å; F1063-L1092 HydrophobicContact CD2-CD2 3.92Å; F1063-L1092 HydrophobicContact CE1-CB 4.1Å; F1063-L1092 HydrophobicContact CE1-CD1 3.92Å; F1063-L1092 HydrophobicContact CE1-CD2 4.27Å; F1063-L1092 HydrophobicContact CE1-CG 4.32Å; F1063-L1092 HydrophobicContact CE2-CD1 3.86Å; F1063-L1092 HydrophobicContact CE2-CD2 4.47Å; F1063-L1092 HydrophobicContact CG-CD1 4.29Å; F1063-L1092 HydrophobicContact CG-CD2 3.48Å; F1063-L1092 VanDerWaalsContact CG-CD2 3.48Å; F1063-L1092 HydrophobicContact CG-CG 4.36Å; F1063-L1092 HydrophobicContact CZ-CD1 3.76Å; F1063-M1095 HydrophobicContact CB-CE 4.19Å; F1063-M1095 HydrophobicContact CB-SD 4.23Å; F1063-I1096 HydrophobicContact CE1-CD1 4.28Å
1064	G	81.2	Confident	77.1	Confident	17 Å²	17	38.9 Å²	38.9	18%	0.175	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-49.1	171.1	0	0	0	0	0	112.3	R1060 R1061 L1062 R1067 N1068	R1060-G1064 PolarHBondContact O-N 3.05Å; R1061-G1064 PolarHBondContact O-N 3.27Å; L1062-G1064 VanDerWaalsContact C-N 3.35Å; G1064-R1067 PolarHBondContact O-N 3.41Å; G1064-N1068 VanDerWaalsContact O-CG 3.22Å; G1064-N1068 PolarHBondContact O-N 2.78Å; G1064-N1068 VanDerWaalsContact O-N 3.15Å; G1064-N1068 PolarHBondContact O-OD1 3.18Å
1065	A	82.8	Confident	77.9	Confident	22 Å²	22	37.8 Å²	37.8	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-47.6	177.2	0	0	0	0	0	112.1	L1032 I1037 R1061 L1062 R1067 N1068 A1069	L1032-A1065 HydrophobicContact CD2-CB 3.75Å; I1037-A1065 HydrophobicContact CD1-CB 4.1Å; I1037-A1065 HydrophobicContact CG1-CB 4.06Å; I1037-A1065 HydrophobicContact CG2-CB 3.99Å; R1061-A1065 PolarHBondContact O-N 3.18Å; L1062-A1065 PolarHBondContact O-N 3.06Å; A1065-R1067 VanDerWaalsContact C-N 3.33Å; A1065-R1067 PolarHBondContact O-N 2.8Å; A1065-N1068 PolarHBondContact O-N 3.16Å; A1065-A1069 PolarHBondContact O-N 2.93Å
1066	L	83.6	Confident	78.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-35.3	179.1	-73.4	163.9	0	0	0	113.5	I1037 A1041 L1062 A1069 G1070 N1071 T1074 M1075 I1078	I1037-L1066 HydrophobicContact CG2-CB 4.4Å; I1037-L1066 HydrophobicContact CG2-CD2 3.49Å; I1037-L1066 VanDerWaalsContact CG2-CD2 3.49Å; I1037-L1066 HydrophobicContact CG2-CG 3.68Å; A1041-L1066 HydrophobicContact CB-CD1 4.44Å; A1041-L1066 HydrophobicContact CB-CD2 4.36Å; L1062-L1066 HydrophobicContact CD1-CD1 3.8Å; L1062-L1066 HydrophobicContact CD1-CG 4.18Å; L1062-L1066 HydrophobicContact CG-CD1 3.88Å; L1062-L1066 WeakPolarHBondContact O-CB 3.46Å; L1062-L1066 WeakPolarHBondContact O-CD1 3.49Å; L1062-L1066 VanDerWaalsContact O-CG 3.32Å; L1062-L1066 WeakPolarHBondContact O-CG 3.46Å; L1062-L1066 PolarHBondContact O-N 3.1Å; L1066-A1069 PolarHBondContact O-N 3.03Å; L1066-G1070 PolarHBondContact O-N 2.95Å; L1066-N1071 HydrophobicContact CD2-CB 3.95Å; L1066-N1071 PolarHBondContact O-N 2.64Å; L1066-T1074 HydrophobicContact CD1-CG2 4.04Å; L1066-T1074 HydrophobicContact CD2-CG2 3.54Å; L1066-T1074 HydrophobicContact CG-CG2 4.48Å; L1066-M1075 HydrophobicContact CB-CG 3.31Å; L1066-M1075 HydrophobicContact CB-SD 3.93Å; L1066-M1075 HydrophobicContact CD1-CG 3.85Å; L1066-M1075 HydrophobicContact CG-CG 4.17Å; L1066-I1078 HydrophobicContact CD1-CD1 3.37Å
1067	R	78.3	Confident	79.1	Confident	74 Å²	74	40.2 Å²	40.2	28%	0.279	22%	0.215	S	C	.	.	H	α-helix	trans	-61.1	-51.4	172.7	-177.1	-165.1	59.2	173.9	-0.7	110.2	F1063 G1064 A1065 A1069 G1070 M1075 M1095 E1098 A1099	F1063-R1067 VanDerWaalsContact O-CB 3.32Å; F1063-R1067 WeakPolarHBondContact O-CB 3.39Å; F1063-R1067 PolarHBondContact O-N 2.76Å; G1064-R1067 PolarHBondContact O-N 3.41Å; A1065-R1067 VanDerWaalsContact C-N 3.33Å; A1065-R1067 PolarHBondContact O-N 2.8Å; R1067-A1069 PolarHBondContact O-N 3.48Å; R1067-G1070 WeakPolarHBondContact O-CA 3.41Å; R1067-G1070 PolarHBondContact O-N 2.82Å; R1067-M1075 HydrophobicContact CB-CE 3.88Å; R1067-M1075 HydrophobicContact CB-SD 4.23Å; R1067-M1095 HydrophobicContact CB-CE 4.27Å; R1067-E1098 WeakPolarHBondContact CD-OE2 3.07Å; R1067-E1098 IonicContact CZ-OE2 2.76Å; R1067-E1098 IonicContact NE-OE2 2.69Å; R1067-E1098 IonicContact NH1-OE2 2.81Å; R1067-E1098 PolarHBondContact NH1-OE2 2.93Å; R1067-A1099 HydrophobicContact CG-CB 4.32Å
1068	N	74.6	Confident	79.8	Confident	122 Å²	122	35.5 Å²	35.5	65%	0.652	19%	0.193	S	C	*	.	H	α-helix	trans	-63.5	-23.8	-179.2	-62.3	0.6	0	0	0	112.3	G1064 A1065 G1070	G1064-N1068 VanDerWaalsContact O-CG 3.22Å; G1064-N1068 PolarHBondContact O-N 2.78Å; G1064-N1068 VanDerWaalsContact O-N 3.15Å; G1064-N1068 PolarHBondContact O-OD1 3.18Å; A1065-N1068 PolarHBondContact O-N 3.16Å; N1068-G1070 VanDerWaalsContact C-N 3.35Å
1069	A	76.6	Confident	80.1	Confident	58 Å²	58	36.4 Å²	36.4	48%	0.479	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.5	171.4	0	0	0	0	0	114.4	I1037 A1065 L1066 R1067 N1071	I1037-A1069 HydrophobicContact CD1-CB 3.87Å; A1065-A1069 PolarHBondContact O-N 2.93Å; L1066-A1069 PolarHBondContact O-N 3.03Å; R1067-A1069 PolarHBondContact O-N 3.48Å; A1069-N1071 HydrophobicContact CB-CB 4.39Å; A1069-N1071 PolarHBondContact O-N 2.97Å; A1069-N1071 VanDerWaalsContact O-N 3.16Å
1070	G	71.1	Confident	80.2	Confident	22 Å²	22	40 Å²	40	23%	0.227	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	8.6	-173.1	0	0	0	0	0	114.6	L1066 R1067 N1068 Y1072	L1066-G1070 PolarHBondContact O-N 2.95Å; R1067-G1070 WeakPolarHBondContact O-CA 3.41Å; R1067-G1070 PolarHBondContact O-N 2.82Å; N1068-G1070 VanDerWaalsContact C-N 3.35Å; G1070-Y1072 PolarHBondContact O-N 3.35Å
1071	N	77.2	Confident	80.3	Confident	40 Å²	40	41.2 Å²	41.2	21%	0.214	21%	0.214	C	C	.	.			trans	-84.4	59.6	-170.5	-163	-12.4	0	0	0	112	D1038 L1066 A1069 E1073 T1074 M1075	D1038-N1071 PolarHBondContact OD1-ND2 2.83Å; L1066-N1071 HydrophobicContact CD2-CB 3.95Å; L1066-N1071 PolarHBondContact O-N 2.64Å; A1069-N1071 HydrophobicContact CB-CB 4.39Å; A1069-N1071 PolarHBondContact O-N 2.97Å; A1069-N1071 VanDerWaalsContact O-N 3.16Å; N1071-E1073 PolarHBondContact O-N 3.42Å; N1071-T1074 PolarHBondContact ND2-OG1 2.87Å; N1071-T1074 PolarHBondContact O-N 3.01Å; N1071-T1074 WeakPolarHBondContact OD1-CB 3.33Å; N1071-T1074 PolarHBondContact OD1-N 3.48Å; N1071-T1074 PolarHBondContact OD1-OG1 3.46Å; N1071-T1074 VanDerWaalsContact OD1-OG1 3.14Å; N1071-M1075 WeakPolarHBondContact O-CG 3.47Å; N1071-M1075 PolarHBondContact O-N 3.19Å; N1071-M1075 VanDerWaalsContact O-N 3.16Å
1072	Y	78.9	Confident	80	Confident	32 Å²	32	38.3 Å²	38.3	13%	0.125	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-28.1	-180	71.6	-95.5	0	0	0	112.6	G1070 A1076 M1100 N1105	G1070-Y1072 PolarHBondContact O-N 3.35Å; Y1072-A1076 VanDerWaalsContact O-CB 3.31Å; Y1072-A1076 WeakPolarHBondContact O-CB 3.5Å; Y1072-A1076 PolarHBondContact O-N 3.44Å; Y1072-M1100 HydrophobicContact CD1-CG 4.16Å; Y1072-M1100 HydrophobicContact CD2-CE 3.54Å; Y1072-M1100 HydrophobicContact CD2-CG 3.63Å; Y1072-M1100 HydrophobicContact CD2-SD 4.48Å; Y1072-M1100 HydrophobicContact CE2-CE 4.14Å; Y1072-M1100 HydrophobicContact CE2-CG 4.28Å; Y1072-M1100 HydrophobicContact CG-CE 4.34Å; Y1072-M1100 HydrophobicContact CG-CG 3.6Å; Y1072-N1105 PolarHBondContact OH-ND2 3.34Å
1073	E	79.9	Confident	79.5	Confident	102 Å²	102	41 Å²	41	48%	0.477	22%	0.223	S	C	.	.	H	α-helix	trans	-67.2	-46	179.1	-62.4	-167.6	176.8	0	0	111.4	N1071 A1076 K1077	N1071-E1073 PolarHBondContact O-N 3.42Å; E1073-A1076 PolarHBondContact O-N 3.03Å; E1073-K1077 WeakPolarHBondContact O-CG 3.36Å; E1073-K1077 PolarHBondContact O-N 2.84Å
1074	T	82.9	Confident	78.8	Confident	16 Å²	16	41.6 Å²	41.6	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-69.9	-36.8	177.4	-67.9	0	0	0	0	111.6	A1041 L1066 N1071 A1076 K1077 I1078	A1041-T1074 HydrophobicContact CB-CG2 3.25Å; L1066-T1074 HydrophobicContact CD1-CG2 4.04Å; L1066-T1074 HydrophobicContact CD2-CG2 3.54Å; L1066-T1074 HydrophobicContact CG-CG2 4.48Å; N1071-T1074 PolarHBondContact ND2-OG1 2.87Å; N1071-T1074 PolarHBondContact O-N 3.01Å; N1071-T1074 WeakPolarHBondContact OD1-CB 3.33Å; N1071-T1074 PolarHBondContact OD1-N 3.48Å; N1071-T1074 PolarHBondContact OD1-OG1 3.46Å; N1071-T1074 VanDerWaalsContact OD1-OG1 3.14Å; T1074-A1076 VanDerWaalsContact C-N 3.33Å; T1074-A1076 PolarHBondContact O-N 3.34Å; T1074-K1077 WeakPolarHBondContact O-CB 3.28Å; T1074-K1077 PolarHBondContact O-N 3.31Å; T1074-I1078 HydrophobicContact CG2-CD1 3.88Å; T1074-I1078 WeakPolarHBondContact O-CD1 3.26Å; T1074-I1078 WeakPolarHBondContact O-CG1 3.43Å; T1074-I1078 PolarHBondContact O-N 3.09Å
1075	M	82.4	Confident	78	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-46.7	168.7	-61.4	169.8	80.1	0	0	111.4	F1063 L1066 R1067 N1071 K1077 I1078 R1079 M1095 I1096 A1099	F1063-M1075 HydrophobicContact CB-CE 4.21Å; F1063-M1075 HydrophobicContact CD1-CB 3.84Å; F1063-M1075 HydrophobicContact CD1-CE 3.72Å; F1063-M1075 HydrophobicContact CD1-CG 4.02Å; F1063-M1075 HydrophobicContact CE1-CB 3.71Å; F1063-M1075 HydrophobicContact CE1-CG 4.36Å; F1063-M1075 VanDerWaalsContact CE1-O 3.27Å; F1063-M1075 WeakPolarHBondContact CE1-O 3.4Å; F1063-M1075 HydrophobicContact CG-CE 4.41Å; F1063-M1075 WeakPolarHBondContact CZ-O 3.24Å; F1063-M1075 WeakPolarHBondContact O-CE 3.48Å; L1066-M1075 HydrophobicContact CB-CG 3.31Å; L1066-M1075 HydrophobicContact CB-SD 3.93Å; L1066-M1075 HydrophobicContact CD1-CG 3.85Å; L1066-M1075 HydrophobicContact CG-CG 4.17Å; R1067-M1075 HydrophobicContact CB-CE 3.88Å; R1067-M1075 HydrophobicContact CB-SD 4.23Å; N1071-M1075 WeakPolarHBondContact O-CG 3.47Å; N1071-M1075 PolarHBondContact O-N 3.19Å; N1071-M1075 VanDerWaalsContact O-N 3.16Å; M1075-K1077 VanDerWaalsContact C-N 3.31Å; M1075-K1077 PolarHBondContact O-N 2.98Å; M1075-I1078 PolarHBondContact O-N 3.24Å; M1075-R1079 WeakPolarHBondContact O-CB 3.32Å; M1075-R1079 PolarHBondContact O-N 2.7Å; M1075-M1095 HydrophobicContact CE-CB 3.57Å; M1075-I1096 HydrophobicContact CB-CD1 4.24Å; M1075-I1096 HydrophobicContact CB-CG1 3.64Å; M1075-I1096 HydrophobicContact CE-CG1 4.05Å; M1075-I1096 HydrophobicContact SD-CG1 4.41Å; M1075-A1099 HydrophobicContact SD-CB 4.3Å
1076	A	80.5	Confident	77.3	Confident	37 Å²	37	46.5 Å²	46.5	31%	0.306	25%	0.25	S	C	.	.	H	α-helix	trans	-67.5	-26.8	178.9	0	0	0	0	0	113.7	Y1072 E1073 T1074	Y1072-A1076 VanDerWaalsContact O-CB 3.31Å; Y1072-A1076 WeakPolarHBondContact O-CB 3.5Å; Y1072-A1076 PolarHBondContact O-N 3.44Å; E1073-A1076 PolarHBondContact O-N 3.03Å; T1074-A1076 VanDerWaalsContact C-N 3.33Å; T1074-A1076 PolarHBondContact O-N 3.34Å
1077	K	82.9	Confident	76.7	Confident	100 Å²	100	46.7 Å²	46.7	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-69.5	-54.5	170.2	-70.8	169.6	-166.7	164.7	0	111	Y1045 E1073 T1074 M1075 R1079 R1080	Y1045-K1077 HydrophobicContact CD2-CB 4.35Å; Y1045-K1077 HydrophobicContact CE2-CB 4.24Å; E1073-K1077 WeakPolarHBondContact O-CG 3.36Å; E1073-K1077 PolarHBondContact O-N 2.84Å; T1074-K1077 WeakPolarHBondContact O-CB 3.28Å; T1074-K1077 PolarHBondContact O-N 3.31Å; M1075-K1077 VanDerWaalsContact C-N 3.31Å; M1075-K1077 PolarHBondContact O-N 2.98Å; K1077-R1079 VanDerWaalsContact C-N 3.31Å; K1077-R1079 PolarHBondContact O-N 3.31Å; K1077-R1080 WeakPolarHBondContact O-CB 3.13Å; K1077-R1080 WeakPolarHBondContact O-CD 3.49Å; K1077-R1080 VanDerWaalsContact O-CG 3.3Å; K1077-R1080 WeakPolarHBondContact O-CG 3.49Å; K1077-R1080 PolarHBondContact O-N 3.35Å
1078	I	83.4	Confident	75.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-36.7	-176.6	-65.8	154.5	0	0	0	112.1	A1041 Y1044 L1062 F1063 L1066 T1074 M1075 R1080 Y1081 V1082	A1041-I1078 HydrophobicContact CB-CD1 3.68Å; Y1044-I1078 HydrophobicContact CD1-CG2 3.29Å; Y1044-I1078 HydrophobicContact CE1-CG2 3.39Å; Y1044-I1078 HydrophobicContact CG-CG2 4.06Å; L1062-I1078 HydrophobicContact CD1-CD1 4.35Å; L1062-I1078 HydrophobicContact CD2-CD1 3.68Å; L1062-I1078 HydrophobicContact CD2-CG1 4.46Å; L1062-I1078 HydrophobicContact CD2-CG2 4.2Å; L1062-I1078 HydrophobicContact CG-CD1 4.01Å; F1063-I1078 HydrophobicContact CE2-CB 4.06Å; F1063-I1078 HydrophobicContact CE2-CG2 3.55Å; F1063-I1078 HydrophobicContact CZ-CB 3.93Å; F1063-I1078 HydrophobicContact CZ-CG2 3.87Å; L1066-I1078 HydrophobicContact CD1-CD1 3.37Å; T1074-I1078 HydrophobicContact CG2-CD1 3.88Å; T1074-I1078 WeakPolarHBondContact O-CD1 3.26Å; T1074-I1078 WeakPolarHBondContact O-CG1 3.43Å; T1074-I1078 PolarHBondContact O-N 3.09Å; M1075-I1078 PolarHBondContact O-N 3.24Å; I1078-R1080 PolarHBondContact O-N 2.92Å; I1078-Y1081 PolarHBondContact O-N 2.83Å; I1078-V1082 HydrophobicContact CG2-CG2 4.43Å
1079	R	80.1	Confident	75.2	Confident	24 Å²	24	45.8 Å²	45.8	9%	0.091	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-23.9	-177	171.8	61	-170.4	93	-1.6	113.4	F1063 M1075 K1077 V1082 A1087 N1093 I1096	F1063-R1079 HydrophobicContact CE1-CB 4.17Å; F1063-R1079 HydrophobicContact CZ-CB 3.97Å; M1075-R1079 WeakPolarHBondContact O-CB 3.32Å; M1075-R1079 PolarHBondContact O-N 2.7Å; K1077-R1079 VanDerWaalsContact C-N 3.31Å; K1077-R1079 PolarHBondContact O-N 3.31Å; R1079-V1082 PolarHBondContact NH1-O 3.07Å; R1079-A1087 VanDerWaalsContact NH1-CB 3.26Å; R1079-N1093 PolarHBondContact NE-OD1 3.43Å; R1079-I1096 HydrophobicContact CB-CD1 4.32Å; R1079-I1096 HydrophobicContact CG-CD1 4.33Å
1080	R	81.6	Confident	74.7	Confident	76 Å²	76	43.5 Å²	43.5	29%	0.287	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-26	179.6	-55.8	174.2	177.9	-140.8	-11.3	113.9	E342 K1077 I1078	E342-R1080 VanDerWaalsContact CD-NH1 3.26Å; E342-R1080 WeakPolarHBondContact OE1-CD 3.45Å; E342-R1080 VanDerWaalsContact OE1-CG 3.31Å; E342-R1080 WeakPolarHBondContact OE1-CG 3.35Å; E342-R1080 IonicContact OE1-CZ 2.96Å; E342-R1080 IonicContact OE1-NE 3.09Å; E342-R1080 IonicContact OE1-NH1 3.41Å; E342-R1080 IonicContact OE2-CZ 2.7Å; E342-R1080 IonicContact OE2-NE 2.81Å; E342-R1080 IonicContact OE2-NH1 3.36Å; E342-R1080 PolarHBondContact OE2-NH1 3.38Å; E342-R1080 IonicContact OE2-NH2 3.73Å; K1077-R1080 WeakPolarHBondContact O-CB 3.13Å; K1077-R1080 WeakPolarHBondContact O-CD 3.49Å; K1077-R1080 VanDerWaalsContact O-CG 3.3Å; K1077-R1080 WeakPolarHBondContact O-CG 3.49Å; K1077-R1080 PolarHBondContact O-N 3.35Å; I1078-R1080 PolarHBondContact O-N 2.92Å
1081	Y	79.1	Confident	74.6	Confident	54 Å²	54	44.5 Å²	44.5	21%	0.212	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-15.7	179.8	-58	-75.4	0	0	0	113.5	Y1045 G1048 I1078	Y1045-Y1081 AromaticContact CD1-CE2 3.97Å; Y1045-Y1081 HydrophobicContact CD1-CE2 3.97Å; Y1045-Y1081 HydrophobicContact CD2-CD2 4.43Å; Y1045-Y1081 AromaticContact CD2-CE2 3.71Å; Y1045-Y1081 HydrophobicContact CD2-CE2 3.71Å; Y1045-Y1081 AromaticContact CE1-CE2 3.79Å; Y1045-Y1081 HydrophobicContact CE1-CE2 3.79Å; Y1045-Y1081 AromaticContact CE1-CZ 3.73Å; Y1045-Y1081 WeakPolarHBondContact CE1-OH 3.29Å; Y1045-Y1081 AromaticContact CE2-CE2 3.6Å; Y1045-Y1081 HydrophobicContact CE2-CE2 3.6Å; Y1045-Y1081 AromaticContact CG-CE2 3.9Å; Y1045-Y1081 HydrophobicContact CG-CE2 3.9Å; Y1045-Y1081 AromaticContact CZ-CE2 3.65Å; Y1045-Y1081 AromaticContact CZ-CZ 3.78Å; Y1045-Y1081 PolarHBondContact OH-OH 3.45Å; Y1045-Y1081 VanDerWaalsContact OH-OH 3.09Å; G1048-Y1081 WeakPolarHBondContact O-CD1 3.46Å; I1078-Y1081 PolarHBondContact O-N 2.83Å
1082	V	75.1	Confident	74.6	Confident	8 Å²	8	42.7 Å²	42.7	5%	0.048	21%	0.209	C	C	.	.	S	Bend	trans	-74.4	129.1	172.2	-169.3	0	0	0	0	108.5	Y1044 F1063 I1078 R1079 D1086 A1087 L1092	Y1044-V1082 HydrophobicContact CE1-CG2 4.39Å; F1063-V1082 HydrophobicContact CE2-CG2 4.1Å; F1063-V1082 HydrophobicContact CZ-CG2 4.38Å; I1078-V1082 HydrophobicContact CG2-CG2 4.43Å; R1079-V1082 PolarHBondContact NH1-O 3.07Å; V1082-D1086 HydrophobicContact CG1-CB 3.79Å; V1082-A1087 HydrophobicContact CB-CB 4.22Å; V1082-A1087 HydrophobicContact CG1-CB 3.79Å; V1082-L1092 HydrophobicContact CB-CD1 4.3Å; V1082-L1092 HydrophobicContact CG1-CD1 4.04Å; V1082-L1092 HydrophobicContact CG2-CD1 4.05Å
1083	S	73	Confident	74.4	Confident	55 Å²	55	44.5 Å²	44.5	39%	0.385	22%	0.221	S	C	.	.			trans	-59.5	150.4	175.8	96.1	0	0	0	0	110	V1085 D1086 A1087	S1083-V1085 PolarHBondContact O-N 2.95Å; S1083-V1085 PolarHBondContact OG-N 3.09Å; S1083-D1086 WeakPolarHBondContact CB-OD2 3.23Å; S1083-D1086 PolarHBondContact O-N 2.85Å; S1083-D1086 VanDerWaalsContact O-N 3.17Å; S1083-D1086 PolarHBondContact OG-N 2.65Å; S1083-D1086 PolarHBondContact OG-OD2 2.94Å; S1083-A1087 WeakPolarHBondContact O-CB 3.44Å; S1083-A1087 PolarHBondContact O-N 3.01Å
1084	S	69.1	Low	74.2	Confident	13 Å²	13	40.9 Å²	40.9	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-69.8	-18.7	-175.7	85.2	0	0	0	0	113.2	P386 E388 R1088	P386-S1084 WeakPolarHBondContact CB-OG 3.38Å; P386-S1084 WeakPolarHBondContact CG-OG 3.45Å; E388-S1084 WeakPolarHBondContact OE2-CB 3.5Å; E388-S1084 PolarHBondContact OE2-OG 3.38Å; S1084-R1088 WeakPolarHBondContact O-CG 3.29Å; S1084-R1088 PolarHBondContact O-N 3.29Å; S1084-R1088 PolarHBondContact O-NE 3.32Å
1085	V	65.9	Low	73.8	Confident	98 Å²	98	41.4 Å²	41.4	59%	0.594	21%	0.205	S	C	*	.	H	α-helix	trans	-68.5	-53.8	170	-178.9	0	0	0	0	108.9	S1083 A1087 R1088 Y1089	S1083-V1085 PolarHBondContact O-N 2.95Å; S1083-V1085 PolarHBondContact OG-N 3.09Å; V1085-A1087 PolarHBondContact O-N 2.85Å; V1085-R1088 PolarHBondContact O-N 3.19Å; V1085-Y1089 WeakPolarHBondContact O-CB 3.44Å; V1085-Y1089 PolarHBondContact O-N 3.07Å
1086	D	67.1	Low	73.7	Confident	45 Å²	45	42.1 Å²	42.1	24%	0.241	21%	0.209	C	C	.	.	H	α-helix	trans	-66	-38.6	-177.6	-50.5	-45.3	0	0	0	111.5	V1056 V1082 S1083 R1088 Y1089 L1090	V1056-D1086 HydrophobicContact CG2-CB 4.13Å; V1056-D1086 WeakPolarHBondContact CG2-OD1 3.41Å; V1082-D1086 HydrophobicContact CG1-CB 3.79Å; S1083-D1086 WeakPolarHBondContact CB-OD2 3.23Å; S1083-D1086 PolarHBondContact O-N 2.85Å; S1083-D1086 VanDerWaalsContact O-N 3.17Å; S1083-D1086 PolarHBondContact OG-N 2.65Å; S1083-D1086 PolarHBondContact OG-OD2 2.94Å; D1086-R1088 PolarHBondContact O-N 3.44Å; D1086-Y1089 WeakPolarHBondContact O-CB 3.39Å; D1086-Y1089 PolarHBondContact O-N 3.21Å; D1086-L1090 WeakPolarHBondContact O-CB 3.13Å; D1086-L1090 WeakPolarHBondContact O-CG 3.06Å; D1086-L1090 PolarHBondContact O-N 3.46Å
1087	A	70.4	Confident	73.5	Confident	3 Å²	3	41.5 Å²	41.5	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-27.3	-178.9	0	0	0	0	0	114.2	R1079 V1082 S1083 V1085 N1091 L1092	R1079-A1087 VanDerWaalsContact NH1-CB 3.26Å; V1082-A1087 HydrophobicContact CB-CB 4.22Å; V1082-A1087 HydrophobicContact CG1-CB 3.79Å; S1083-A1087 WeakPolarHBondContact O-CB 3.44Å; S1083-A1087 PolarHBondContact O-N 3.01Å; V1085-A1087 PolarHBondContact O-N 2.85Å; A1087-N1091 PolarHBondContact O-N 2.84Å; A1087-L1092 HydrophobicContact CB-CD1 3.79Å; A1087-L1092 HydrophobicContact CB-CG 4.32Å; A1087-L1092 PolarHBondContact O-N 3.04Å
1088	R	61.6	Low	73.2	Confident	102 Å²	102	38 Å²	38	39%	0.385	19%	0.187	S	C	.	.	H	α-helix	trans	-71.7	-47.2	167.5	-80.7	-173.4	-77	169.8	-9.8	110.2	E388 S1084 V1085 D1086 L1090 N1091 V1292	E388-R1088 IonicContact OE1-CZ 2.68Å; E388-R1088 IonicContact OE1-NH2 2.63Å; E388-R1088 PolarHBondContact OE1-NH2 3.23Å; E388-R1088 IonicContact OE2-CZ 3.24Å; E388-R1088 IonicContact OE2-NE 3.17Å; E388-R1088 PolarHBondContact OE2-NE 2.81Å; E388-R1088 IonicContact OE2-NH2 2.66Å; E388-R1088 PolarHBondContact OE2-NH2 3.37Å; S1084-R1088 WeakPolarHBondContact O-CG 3.29Å; S1084-R1088 PolarHBondContact O-N 3.29Å; S1084-R1088 PolarHBondContact O-NE 3.32Å; V1085-R1088 PolarHBondContact O-N 3.19Å; D1086-R1088 PolarHBondContact O-N 3.44Å; R1088-L1090 PolarHBondContact O-N 3.45Å; R1088-L1090 VanDerWaalsContact O-N 3.11Å; R1088-N1091 PolarHBondContact O-N 2.91Å; R1088-V1292 HydrophobicContact CB-CG1 3.83Å; R1088-V1292 HydrophobicContact CB-CG2 3.88Å; R1088-V1292 HydrophobicContact CG-CG1 4.47Å; R1088-V1292 VanDerWaalsContact O-CG2 3.3Å; R1088-V1292 WeakPolarHBondContact O-CG2 3.3Å
1089	Y	61	Low	72.9	Confident	76 Å²	76	37.9 Å²	37.9	30%	0.298	19%	0.187	S	C	.	.	H	α-helix	trans	-55.8	-27.9	176.5	179.7	-98.6	0	0	0	113.2	V1056 R1060 V1085 D1086 D1289	V1056-Y1089 HydrophobicContact CG1-CD1 3.46Å; V1056-Y1089 VanDerWaalsContact CG1-CD1 3.46Å; V1056-Y1089 HydrophobicContact CG1-CE1 3.7Å; R1060-Y1089 PolarHBondContact NH2-OH 3.15Å; V1085-Y1089 WeakPolarHBondContact O-CB 3.44Å; V1085-Y1089 PolarHBondContact O-N 3.07Å; D1086-Y1089 WeakPolarHBondContact O-CB 3.39Å; D1086-Y1089 PolarHBondContact O-N 3.21Å; Y1089-D1289 VanDerWaalsContact CE2-OD1 3.24Å; Y1089-D1289 WeakPolarHBondContact CE2-OD1 3.27Å; Y1089-D1289 PolarHBondContact OH-OD1 3.31Å
1090	L	65	Low	72.9	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.052	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	3.6	178.9	-65	173.9	0	0	0	115.1	V1056 S1059 R1060 D1086 R1088 L1092	V1056-L1090 HydrophobicContact CG1-CD1 4Å; V1056-L1090 HydrophobicContact CG1-CD2 3.86Å; V1056-L1090 HydrophobicContact CG1-CG 3.96Å; S1059-L1090 VanDerWaalsContact CB-CD1 3.41Å; R1060-L1090 HydrophobicContact CB-CD2 3.58Å; R1060-L1090 HydrophobicContact CG-CD2 3.9Å; D1086-L1090 WeakPolarHBondContact O-CB 3.13Å; D1086-L1090 WeakPolarHBondContact O-CG 3.06Å; D1086-L1090 PolarHBondContact O-N 3.46Å; R1088-L1090 PolarHBondContact O-N 3.45Å; R1088-L1090 VanDerWaalsContact O-N 3.11Å; L1090-L1092 HydrophobicContact CB-CD1 4.4Å; L1090-L1092 HydrophobicContact CB-CD2 3.47Å; L1090-L1092 VanDerWaalsContact CB-CD2 3.47Å; L1090-L1092 HydrophobicContact CB-CG 3.71Å; L1090-L1092 HydrophobicContact CD1-CD2 4.31Å; L1090-L1092 PolarHBondContact O-N 3.02Å
1091	N	69.8	Low	72.8	Confident	43 Å²	43	35 Å²	35	23%	0.23	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	25.6	-179.1	-105.9	-44.9	0	0	0	115.3	A1087 R1088 N1093 F1094 M1095	A1087-N1091 PolarHBondContact O-N 2.84Å; R1088-N1091 PolarHBondContact O-N 2.91Å; N1091-N1093 PolarHBondContact O-N 2.82Å; N1091-F1094 WeakPolarHBondContact O-CB 3.36Å; N1091-F1094 PolarHBondContact O-N 2.91Å; N1091-M1095 PolarHBondContact O-N 3.16Å
1092	L	76.5	Confident	72.6	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-56.2	-34.1	-166.9	-58.3	-174.5	0	0	0	113.8	F1063 V1082 A1087 L1090 F1094 M1095 I1096	F1063-L1092 HydrophobicContact CB-CD2 3.67Å; F1063-L1092 HydrophobicContact CD1-CB 4.07Å; F1063-L1092 HydrophobicContact CD1-CD1 4.18Å; F1063-L1092 HydrophobicContact CD1-CD2 3.68Å; F1063-L1092 HydrophobicContact CD1-CG 4.19Å; F1063-L1092 HydrophobicContact CD2-CD1 4.14Å; F1063-L1092 HydrophobicContact CD2-CD2 3.92Å; F1063-L1092 HydrophobicContact CE1-CB 4.1Å; F1063-L1092 HydrophobicContact CE1-CD1 3.92Å; F1063-L1092 HydrophobicContact CE1-CD2 4.27Å; F1063-L1092 HydrophobicContact CE1-CG 4.32Å; F1063-L1092 HydrophobicContact CE2-CD1 3.86Å; F1063-L1092 HydrophobicContact CE2-CD2 4.47Å; F1063-L1092 HydrophobicContact CG-CD1 4.29Å; F1063-L1092 HydrophobicContact CG-CD2 3.48Å; F1063-L1092 VanDerWaalsContact CG-CD2 3.48Å; F1063-L1092 HydrophobicContact CG-CG 4.36Å; F1063-L1092 HydrophobicContact CZ-CD1 3.76Å; V1082-L1092 HydrophobicContact CB-CD1 4.3Å; V1082-L1092 HydrophobicContact CG1-CD1 4.04Å; V1082-L1092 HydrophobicContact CG2-CD1 4.05Å; A1087-L1092 HydrophobicContact CB-CD1 3.79Å; A1087-L1092 HydrophobicContact CB-CG 4.32Å; A1087-L1092 PolarHBondContact O-N 3.04Å; L1090-L1092 HydrophobicContact CB-CD1 4.4Å; L1090-L1092 HydrophobicContact CB-CD2 3.47Å; L1090-L1092 VanDerWaalsContact CB-CD2 3.47Å; L1090-L1092 HydrophobicContact CB-CG 3.71Å; L1090-L1092 HydrophobicContact CD1-CD2 4.31Å; L1090-L1092 PolarHBondContact O-N 3.02Å; L1092-F1094 VanDerWaalsContact C-N 3.33Å; L1092-F1094 PolarHBondContact O-N 3.46Å; L1092-M1095 HydrophobicContact CD2-SD 4.24Å; L1092-M1095 PolarHBondContact O-N 3.26Å; L1092-I1096 VanDerWaalsContact O-CG1 3.24Å; L1092-I1096 WeakPolarHBondContact O-CG1 3.44Å; L1092-I1096 PolarHBondContact O-N 3.15Å
1093	N	75.6	Confident	72.5	Confident	71 Å²	71	39.9 Å²	39.9	38%	0.38	21%	0.209	S	C	.	.	H	α-helix	trans	-67	-32.2	179.4	-66.2	-0.8	0	0	0	112.9	R1079 N1091 S1097	R1079-N1093 PolarHBondContact NE-OD1 3.43Å; N1091-N1093 PolarHBondContact O-N 2.82Å; N1093-S1097 PolarHBondContact O-N 3.04Å; N1093-S1097 PolarHBondContact O-OG 3.47Å
1094	F	75.7	Confident	72.5	Confident	25 Å²	25	39.5 Å²	39.5	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-67.6	-48.5	173.9	179.9	-86.7	0	0	0	109.8	N1091 L1092 I1096 S1097 E1098 L1125	N1091-F1094 WeakPolarHBondContact O-CB 3.36Å; N1091-F1094 PolarHBondContact O-N 2.91Å; L1092-F1094 VanDerWaalsContact C-N 3.33Å; L1092-F1094 PolarHBondContact O-N 3.46Å; F1094-I1096 VanDerWaalsContact C-N 3.3Å; F1094-I1096 PolarHBondContact O-N 2.7Å; F1094-S1097 PolarHBondContact O-N 2.92Å; F1094-E1098 HydrophobicContact CE1-CB 4.48Å; F1094-E1098 WeakPolarHBondContact O-CB 3.49Å; F1094-E1098 PolarHBondContact O-N 3.36Å; F1094-L1125 HydrophobicContact CD2-CD1 3.61Å; F1094-L1125 HydrophobicContact CD2-CD2 4.33Å; F1094-L1125 HydrophobicContact CD2-CG 3.82Å; F1094-L1125 HydrophobicContact CE2-CD1 3.95Å; F1094-L1125 HydrophobicContact CE2-CD2 4.06Å; F1094-L1125 HydrophobicContact CE2-CG 3.59Å; F1094-L1125 HydrophobicContact CG-CD1 4.36Å; F1094-L1125 HydrophobicContact CZ-CD2 4.35Å; F1094-L1125 HydrophobicContact CZ-CG 4.33Å
1095	M	74.1	Confident	72.6	Confident	27 Å²	27	41.9 Å²	41.9	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-37.8	179.2	-53.7	175.3	73.2	0	0	112.4	F1063 R1067 M1075 N1091 L1092 A1099	F1063-M1095 HydrophobicContact CB-CE 4.19Å; F1063-M1095 HydrophobicContact CB-SD 4.23Å; R1067-M1095 HydrophobicContact CB-CE 4.27Å; M1075-M1095 HydrophobicContact CE-CB 3.57Å; N1091-M1095 PolarHBondContact O-N 3.16Å; L1092-M1095 HydrophobicContact CD2-SD 4.24Å; L1092-M1095 PolarHBondContact O-N 3.26Å; M1095-A1099 WeakPolarHBondContact O-CB 3.45Å; M1095-A1099 PolarHBondContact O-N 3.11Å; M1095-A1099 VanDerWaalsContact O-N 3.09Å
1096	I	80.3	Confident	73.2	Confident	16 Å²	16	37.4 Å²	37.4	8%	0.082	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-43.5	173.3	-69.2	166.1	0	0	0	110.8	F1063 M1075 R1079 L1092 F1094 M1100	F1063-I1096 HydrophobicContact CE1-CD1 4.28Å; M1075-I1096 HydrophobicContact CB-CD1 4.24Å; M1075-I1096 HydrophobicContact CB-CG1 3.64Å; M1075-I1096 HydrophobicContact CE-CG1 4.05Å; M1075-I1096 HydrophobicContact SD-CG1 4.41Å; R1079-I1096 HydrophobicContact CB-CD1 4.32Å; R1079-I1096 HydrophobicContact CG-CD1 4.33Å; L1092-I1096 VanDerWaalsContact O-CG1 3.24Å; L1092-I1096 WeakPolarHBondContact O-CG1 3.44Å; L1092-I1096 PolarHBondContact O-N 3.15Å; F1094-I1096 VanDerWaalsContact C-N 3.3Å; F1094-I1096 PolarHBondContact O-N 2.7Å; I1096-M1100 HydrophobicContact CG2-CE 3.64Å; I1096-M1100 HydrophobicContact CG2-SD 4.15Å; I1096-M1100 VanDerWaalsContact O-CG 3.29Å; I1096-M1100 WeakPolarHBondContact O-CG 3.48Å; I1096-M1100 PolarHBondContact O-N 3.43Å
1097	S	77.1	Confident	73.7	Confident	23 Å²	23	38.8 Å²	38.8	16%	0.161	20%	0.203	C	C	.	.	H	α-helix	trans	-72.7	-35.9	-178.1	-62.2	0	0	0	0	112.7	N1093 F1094 M1100 I1101	N1093-S1097 PolarHBondContact O-N 3.04Å; N1093-S1097 PolarHBondContact O-OG 3.47Å; F1094-S1097 PolarHBondContact O-N 2.92Å; S1097-M1100 PolarHBondContact O-N 3.39Å; S1097-I1101 WeakPolarHBondContact O-CG1 3.39Å; S1097-I1101 PolarHBondContact O-N 3.36Å; S1097-I1101 VanDerWaalsContact O-N 3.09Å
1098	E	75	Confident	73.8	Confident	26 Å²	26	40.3 Å²	40.3	12%	0.121	22%	0.216	C	C	.	.	H	α-helix	trans	-57.9	-53	171.3	-169.8	168.4	-129.3	0	0	109.5	R1067 F1094 M1100 I1101 E1102 L1125 F1128	R1067-E1098 WeakPolarHBondContact CD-OE2 3.07Å; R1067-E1098 IonicContact CZ-OE2 2.76Å; R1067-E1098 IonicContact NE-OE2 2.69Å; R1067-E1098 IonicContact NH1-OE2 2.81Å; R1067-E1098 PolarHBondContact NH1-OE2 2.93Å; F1094-E1098 HydrophobicContact CE1-CB 4.48Å; F1094-E1098 WeakPolarHBondContact O-CB 3.49Å; F1094-E1098 PolarHBondContact O-N 3.36Å; E1098-M1100 VanDerWaalsContact C-N 3.32Å; E1098-M1100 PolarHBondContact O-N 2.95Å; E1098-I1101 PolarHBondContact O-N 2.83Å; E1098-I1101 VanDerWaalsContact O-N 3.1Å; E1098-E1102 WeakPolarHBondContact O-CG 3.4Å; E1098-E1102 PolarHBondContact O-N 2.76Å; E1098-L1125 HydrophobicContact CB-CD2 4.32Å; E1098-F1128 HydrophobicContact CG-CE1 3.98Å; E1098-F1128 HydrophobicContact CG-CZ 4.32Å
1099	A	78.3	Confident	74.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-30.1	175.6	0	0	0	0	0	114.3	R1067 M1075 M1095 S1103	R1067-A1099 HydrophobicContact CG-CB 4.32Å; M1075-A1099 HydrophobicContact SD-CB 4.3Å; M1095-A1099 WeakPolarHBondContact O-CB 3.45Å; M1095-A1099 PolarHBondContact O-N 3.11Å; M1095-A1099 VanDerWaalsContact O-N 3.09Å; A1099-S1103 VanDerWaalsContact O-CB 3.27Å; A1099-S1103 WeakPolarHBondContact O-CB 3.24Å; A1099-S1103 PolarHBondContact O-N 2.9Å; A1099-S1103 PolarHBondContact O-OG 2.97Å
1100	M	79.3	Confident	75.6	Confident	36 Å²	36	32.3 Å²	32.3	18%	0.177	19%	0.185	C	C	.	.	H	α-helix	trans	-68.8	-34.4	172.9	-77	172.6	175.7	0	0	113	Y1072 I1096 S1097 E1098 S1103 N1105	Y1072-M1100 HydrophobicContact CD1-CG 4.16Å; Y1072-M1100 HydrophobicContact CD2-CE 3.54Å; Y1072-M1100 HydrophobicContact CD2-CG 3.63Å; Y1072-M1100 HydrophobicContact CD2-SD 4.48Å; Y1072-M1100 HydrophobicContact CE2-CE 4.14Å; Y1072-M1100 HydrophobicContact CE2-CG 4.28Å; Y1072-M1100 HydrophobicContact CG-CE 4.34Å; Y1072-M1100 HydrophobicContact CG-CG 3.6Å; I1096-M1100 HydrophobicContact CG2-CE 3.64Å; I1096-M1100 HydrophobicContact CG2-SD 4.15Å; I1096-M1100 VanDerWaalsContact O-CG 3.29Å; I1096-M1100 WeakPolarHBondContact O-CG 3.48Å; I1096-M1100 PolarHBondContact O-N 3.43Å; S1097-M1100 PolarHBondContact O-N 3.39Å; E1098-M1100 VanDerWaalsContact C-N 3.32Å; E1098-M1100 PolarHBondContact O-N 2.95Å; M1100-S1103 PolarHBondContact O-OG 2.84Å; M1100-N1105 CarbonylContact O-C 3.58Å; M1100-N1105 PolarHBondContact O-N 3.21Å
1101	I	79	Confident	76.3	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-76.5	-45.1	177.2	-66.6	164.3	0	0	0	109.9	S1097 E1098 S1103 G1104 V1106 F1109 L1125 F1128 L1129 C1132	S1097-I1101 WeakPolarHBondContact O-CG1 3.39Å; S1097-I1101 PolarHBondContact O-N 3.36Å; S1097-I1101 VanDerWaalsContact O-N 3.09Å; E1098-I1101 PolarHBondContact O-N 2.83Å; E1098-I1101 VanDerWaalsContact O-N 3.1Å; I1101-S1103 PolarHBondContact O-N 3.19Å; I1101-G1104 PolarHBondContact O-N 3.34Å; I1101-G1104 VanDerWaalsContact O-N 3.11Å; I1101-V1106 HydrophobicContact CG2-CG2 4.44Å; I1101-F1109 HydrophobicContact CD1-CD1 3.95Å; I1101-F1109 HydrophobicContact CD1-CD2 4.04Å; I1101-F1109 HydrophobicContact CD1-CE1 3.92Å; I1101-F1109 HydrophobicContact CD1-CE2 4.01Å; I1101-F1109 HydrophobicContact CD1-CG 4.02Å; I1101-F1109 HydrophobicContact CD1-CZ 3.95Å; I1101-F1109 HydrophobicContact CG1-CB 4.12Å; I1101-F1109 HydrophobicContact CG1-CD1 3.96Å; I1101-F1109 HydrophobicContact CG1-CD2 4.12Å; I1101-F1109 HydrophobicContact CG1-CE1 4.45Å; I1101-F1109 HydrophobicContact CG1-CG 3.79Å; I1101-L1125 HydrophobicContact CD1-CB 4.38Å; I1101-L1125 HydrophobicContact CD1-CD2 3.89Å; I1101-F1128 HydrophobicContact CB-CD1 3.98Å; I1101-F1128 HydrophobicContact CB-CE1 3.93Å; I1101-F1128 HydrophobicContact CD1-CD1 3.93Å; I1101-F1128 HydrophobicContact CG2-CD1 3.7Å; I1101-F1128 HydrophobicContact CG2-CE1 3.78Å; I1101-L1129 HydrophobicContact CD1-CB 4.17Å; I1101-C1132 HydrophobicContact CG2-CB 4.07Å
1102	E	75.1	Confident	76.6	Confident	109 Å²	109	36.1 Å²	36.1	51%	0.509	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-38.9	178.8	-71.6	-174.2	146.9	0	0	113.3	E1098 G1104 F1128	E1098-E1102 WeakPolarHBondContact O-CG 3.4Å; E1098-E1102 PolarHBondContact O-N 2.76Å; E1102-G1104 PolarHBondContact O-N 2.75Å; E1102-F1128 HydrophobicContact CG-CE1 3.8Å; E1102-F1128 HydrophobicContact CG-CZ 3.5Å
1103	S	73.4	Confident	76.7	Confident	56 Å²	56	36.3 Å²	36.3	39%	0.392	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	4.8	175.9	55.9	0	0	0	0	114	A1099 M1100 I1101 N1105	A1099-S1103 VanDerWaalsContact O-CB 3.27Å; A1099-S1103 WeakPolarHBondContact O-CB 3.24Å; A1099-S1103 PolarHBondContact O-N 2.9Å; A1099-S1103 PolarHBondContact O-OG 2.97Å; M1100-S1103 PolarHBondContact O-OG 2.84Å; I1101-S1103 PolarHBondContact O-N 3.19Å; S1103-N1105 PolarHBondContact O-N 3.37Å; S1103-N1105 VanDerWaalsContact O-N 3.11Å
1104	G	73.2	Confident	76.8	Confident	46 Å²	46	34.9 Å²	34.9	47%	0.474	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	0.9	-179	0	0	0	0	0	113.7	I1101 E1102 V1106	I1101-G1104 PolarHBondContact O-N 3.34Å; I1101-G1104 VanDerWaalsContact O-N 3.11Å; E1102-G1104 PolarHBondContact O-N 2.75Å; G1104-V1106 PolarHBondContact O-N 2.97Å
1105	N	72.1	Confident	76.9	Confident	63 Å²	63	38.2 Å²	38.2	34%	0.337	21%	0.213	S	C	.	.			trans	-81.2	47.3	-179.8	-149.3	-7.3	0	0	0	110.9	Y1072 M1100 S1103 E1107 A1108 F1109	Y1072-N1105 PolarHBondContact OH-ND2 3.34Å; M1100-N1105 CarbonylContact O-C 3.58Å; M1100-N1105 PolarHBondContact O-N 3.21Å; S1103-N1105 PolarHBondContact O-N 3.37Å; S1103-N1105 VanDerWaalsContact O-N 3.11Å; N1105-E1107 PolarHBondContact O-N 2.79Å; N1105-A1108 HydrophobicContact CB-CB 4.26Å; N1105-A1108 WeakPolarHBondContact O-CA 3.45Å; N1105-A1108 VanDerWaalsContact O-CB 3.23Å; N1105-A1108 WeakPolarHBondContact O-CB 3.29Å; N1105-A1108 PolarHBondContact O-N 2.69Å; N1105-F1109 PolarHBondContact O-N 3.25Å
1106	V	76.8	Confident	77.1	Confident	4 Å²	4	38 Å²	38	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-26.2	-175.8	165.6	0	0	0	0	112.1	I1101 G1104 A1108 F1109 L1110 L1129 Q1133 L1136	I1101-V1106 HydrophobicContact CG2-CG2 4.44Å; G1104-V1106 PolarHBondContact O-N 2.97Å; V1106-A1108 VanDerWaalsContact C-N 3.31Å; V1106-A1108 PolarHBondContact O-N 3.05Å; V1106-F1109 PolarHBondContact O-N 3.16Å; V1106-L1110 HydrophobicContact CG1-CD1 3.98Å; V1106-L1110 HydrophobicContact CG1-CG 4.15Å; V1106-L1110 WeakPolarHBondContact O-CB 3.39Å; V1106-L1110 PolarHBondContact O-N 3.15Å; V1106-L1129 HydrophobicContact CB-CD1 4.25Å; V1106-L1129 HydrophobicContact CG1-CD1 3.37Å; V1106-L1129 HydrophobicContact CG2-CD1 3.83Å; V1106-Q1133 HydrophobicContact CG2-CG 4.48Å; V1106-L1136 HydrophobicContact CG1-CD1 3.52Å
1107	E	79.2	Confident	76.8	Confident	75 Å²	75	37.4 Å²	37.4	35%	0.35	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-36.7	167.1	-81	-70.5	130.7	0	0	112.1	N1105 F1109 K1111 R1139	N1105-E1107 PolarHBondContact O-N 2.79Å; E1107-F1109 VanDerWaalsContact C-N 3.26Å; E1107-F1109 PolarHBondContact O-N 3.3Å; E1107-K1111 WeakPolarHBondContact O-CB 3.26Å; E1107-K1111 PolarHBondContact O-N 2.84Å; E1107-K1111 IonicContact OE2-NZ 2.7Å; E1107-K1111 PolarHBondContact OE2-NZ 3.25Å; E1107-R1139 IonicContact OE1-CZ 2.74Å; E1107-R1139 IonicContact OE1-NH1 2.67Å; E1107-R1139 PolarHBondContact OE1-NH1 3.03Å; E1107-R1139 IonicContact OE1-NH2 3.17Å; E1107-R1139 PolarHBondContact OE1-NH2 3.23Å; E1107-R1139 IonicContact OE2-NH2 3.59Å
1108	A	72.6	Confident	76.4	Confident	35 Å²	35	37.2 Å²	37.2	29%	0.289	21%	0.209	S	C	.	.	H	α-helix	trans	-69.8	-21.9	174.3	0	0	0	0	0	113	N1105 V1106 P1112	N1105-A1108 HydrophobicContact CB-CB 4.26Å; N1105-A1108 WeakPolarHBondContact O-CA 3.45Å; N1105-A1108 VanDerWaalsContact O-CB 3.23Å; N1105-A1108 WeakPolarHBondContact O-CB 3.29Å; N1105-A1108 PolarHBondContact O-N 2.69Å; V1106-A1108 VanDerWaalsContact C-N 3.31Å; V1106-A1108 PolarHBondContact O-N 3.05Å; A1108-P1112 VanDerWaalsContact O-CD 3.28Å; A1108-P1112 WeakPolarHBondContact O-CD 3.32Å; A1108-P1112 VanDerWaalsContact O-CG 3.23Å; A1108-P1112 WeakPolarHBondContact O-CG 3.1Å
1109	F	79.9	Confident	76.1	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-85.5	-57.8	171.4	178.1	-103.1	0	0	0	112.4	I1101 N1105 V1106 E1107 P1112 L1113 V1121 L1125 F1126 L1129	I1101-F1109 HydrophobicContact CD1-CD1 3.95Å; I1101-F1109 HydrophobicContact CD1-CD2 4.04Å; I1101-F1109 HydrophobicContact CD1-CE1 3.92Å; I1101-F1109 HydrophobicContact CD1-CE2 4.01Å; I1101-F1109 HydrophobicContact CD1-CG 4.02Å; I1101-F1109 HydrophobicContact CD1-CZ 3.95Å; I1101-F1109 HydrophobicContact CG1-CB 4.12Å; I1101-F1109 HydrophobicContact CG1-CD1 3.96Å; I1101-F1109 HydrophobicContact CG1-CD2 4.12Å; I1101-F1109 HydrophobicContact CG1-CE1 4.45Å; I1101-F1109 HydrophobicContact CG1-CG 3.79Å; N1105-F1109 PolarHBondContact O-N 3.25Å; V1106-F1109 PolarHBondContact O-N 3.16Å; E1107-F1109 VanDerWaalsContact C-N 3.26Å; E1107-F1109 PolarHBondContact O-N 3.3Å; F1109-P1112 WeakPolarHBondContact O-CD 3.39Å; F1109-L1113 HydrophobicContact CD1-CD1 4.13Å; F1109-L1113 HydrophobicContact CD2-CD1 4.36Å; F1109-L1113 HydrophobicContact CE1-CD1 3.7Å; F1109-L1113 HydrophobicContact CE2-CD1 3.95Å; F1109-L1113 HydrophobicContact CG-CD1 4.43Å; F1109-L1113 HydrophobicContact CZ-CD1 3.6Å; F1109-L1113 WeakPolarHBondContact O-CD1 3.45Å; F1109-L1113 WeakPolarHBondContact O-CG 3.38Å; F1109-V1121 HydrophobicContact CE2-CG1 3.89Å; F1109-V1121 HydrophobicContact CZ-CG1 3.89Å; F1109-L1125 HydrophobicContact CE2-CB 4.23Å; F1109-L1125 HydrophobicContact CE2-CD1 4.47Å; F1109-L1125 HydrophobicContact CZ-CB 3.87Å; F1109-F1126 HydrophobicContact CE1-CE1 4.37Å; F1109-L1129 HydrophobicContact CD1-CD1 4.47Å; F1109-L1129 HydrophobicContact CD1-CD2 4.13Å; F1109-L1129 HydrophobicContact CE1-CB 4.38Å; F1109-L1129 HydrophobicContact CE1-CD2 3.94Å
1110	L	80.1	Confident	75.6	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-71.5	-38.3	-174.7	-84.9	-175.1	0	0	0	114	V1106 L1113 E1114 L1129 L1136	V1106-L1110 HydrophobicContact CG1-CD1 3.98Å; V1106-L1110 HydrophobicContact CG1-CG 4.15Å; V1106-L1110 WeakPolarHBondContact O-CB 3.39Å; V1106-L1110 PolarHBondContact O-N 3.15Å; L1110-L1113 CarbonylContact O-C 3.48Å; L1110-L1113 WeakPolarHBondContact O-CA 3.42Å; L1110-L1113 WeakPolarHBondContact O-CB 3.45Å; L1110-L1113 PolarHBondContact O-N 2.91Å; L1110-E1114 WeakPolarHBondContact O-CG 3.44Å; L1110-E1114 PolarHBondContact O-N 3.28Å; L1110-L1129 HydrophobicContact CD1-CD2 3.99Å; L1110-L1129 HydrophobicContact CD2-CD2 3.53Å; L1110-L1129 HydrophobicContact CG-CD2 3.74Å; L1110-L1136 HydrophobicContact CD1-CD1 3.82Å
1111	K	79.1	Confident	75.3	Confident	107 Å²	107	36.8 Å²	36.8	47%	0.465	21%	0.211	S	C	.	.	H	α-helix	trans	-66.2	-40.6	-172.6	-162.5	-168.7	-139.2	109.1	0	112.7	E1107 L1113 N1115	E1107-K1111 WeakPolarHBondContact O-CB 3.26Å; E1107-K1111 PolarHBondContact O-N 2.84Å; E1107-K1111 IonicContact OE2-NZ 2.7Å; E1107-K1111 PolarHBondContact OE2-NZ 3.25Å; K1111-L1113 VanDerWaalsContact C-N 3.29Å; K1111-L1113 PolarHBondContact O-N 3.22Å; K1111-N1115 VanDerWaalsContact O-CB 3.31Å; K1111-N1115 WeakPolarHBondContact O-CB 3.5Å; K1111-N1115 PolarHBondContact O-N 2.8Å; K1111-N1115 PolarHBondContact O-ND2 3.08Å
1112	P	77.1	Confident	75	Confident	26 Å²	26	37.1 Å²	37.1	17%	0.169	21%	0.213	C	C	.	.	H	α-helix	trans	-49.7	-46.5	163.8	-35.6	42.6	0	0	0	114	N399 A1108 F1109 N1115 N1116	N399-P1112 HydrophobicContact CB-CB 4.47Å; N399-P1112 HydrophobicContact CB-CG 4.41Å; N399-P1112 WeakPolarHBondContact OD1-CB 3.13Å; A1108-P1112 VanDerWaalsContact O-CD 3.28Å; A1108-P1112 WeakPolarHBondContact O-CD 3.32Å; A1108-P1112 VanDerWaalsContact O-CG 3.23Å; A1108-P1112 WeakPolarHBondContact O-CG 3.1Å; F1109-P1112 WeakPolarHBondContact O-CD 3.39Å; P1112-N1115 PolarHBondContact O-N 3.4Å; P1112-N1116 PolarHBondContact O-N 3.05Å
1113	L	77.1	Confident	75	Confident	6 Å²	6	32 Å²	32	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-73.1	-40.6	-175.6	-58.1	173	0	0	0	111.9	F1109 L1110 K1111 N1115 N1116 P1117 V1121 F1126 Y1143	F1109-L1113 HydrophobicContact CD1-CD1 4.13Å; F1109-L1113 HydrophobicContact CD2-CD1 4.36Å; F1109-L1113 HydrophobicContact CE1-CD1 3.7Å; F1109-L1113 HydrophobicContact CE2-CD1 3.95Å; F1109-L1113 HydrophobicContact CG-CD1 4.43Å; F1109-L1113 HydrophobicContact CZ-CD1 3.6Å; F1109-L1113 WeakPolarHBondContact O-CD1 3.45Å; F1109-L1113 WeakPolarHBondContact O-CG 3.38Å; L1110-L1113 CarbonylContact O-C 3.48Å; L1110-L1113 WeakPolarHBondContact O-CA 3.42Å; L1110-L1113 WeakPolarHBondContact O-CB 3.45Å; L1110-L1113 PolarHBondContact O-N 2.91Å; K1111-L1113 VanDerWaalsContact C-N 3.29Å; K1111-L1113 PolarHBondContact O-N 3.22Å; L1113-N1115 VanDerWaalsContact C-N 3.29Å; L1113-N1115 PolarHBondContact O-N 3.17Å; L1113-N1116 CarbonylContact O-C 3.1Å; L1113-N1116 PolarHBondContact O-N 3.18Å; L1113-P1117 WeakPolarHBondContact O-CA 3.48Å; L1113-P1117 VanDerWaalsContact O-CD 3.26Å; L1113-P1117 WeakPolarHBondContact O-CD 3.27Å; L1113-V1121 HydrophobicContact CD1-CG2 3.97Å; L1113-V1121 HydrophobicContact CD2-CG2 3.4Å; L1113-V1121 HydrophobicContact CG-CG2 4.31Å; L1113-F1126 HydrophobicContact CD1-CE1 4.03Å; L1113-F1126 HydrophobicContact CD1-CZ 3.89Å; L1113-Y1143 HydrophobicContact CB-CE1 4.47Å; L1113-Y1143 HydrophobicContact CB-CE2 4.25Å; L1113-Y1143 WeakPolarHBondContact O-CE2 3.4Å
1114	E	79.2	Confident	75.1	Confident	40 Å²	40	29.3 Å²	29.3	19%	0.187	17%	0.171	C	C	.	.	H	α-helix	trans	-66.4	-30.7	173.4	-69.5	-166.5	118.6	0	0	112.9	L1110 P1117 R1139 Y1143 R1146	L1110-E1114 WeakPolarHBondContact O-CG 3.44Å; L1110-E1114 PolarHBondContact O-N 3.28Å; E1114-P1117 WeakPolarHBondContact O-CD 3.37Å; E1114-R1139 IonicContact OE1-NE 2.93Å; E1114-R1139 PolarHBondContact OE1-NE 3.46Å; E1114-R1139 IonicContact OE2-CZ 2.71Å; E1114-R1139 VanDerWaalsContact OE2-CZ 3.3Å; E1114-R1139 IonicContact OE2-NE 2.84Å; E1114-R1139 PolarHBondContact OE2-NE 3.22Å; E1114-R1139 VanDerWaalsContact OE2-NE 3.09Å; E1114-R1139 IonicContact OE2-NH2 3.96Å; E1114-R1139 PolarHBondContact OE2-NH2 3.39Å; E1114-Y1143 HydrophobicContact CG-CD2 4.05Å; E1114-R1146 IonicContact OE1-CZ 3.87Å; E1114-R1146 IonicContact OE1-NH1 3.43Å; E1114-R1146 PolarHBondContact OE1-NH1 3.11Å; E1114-R1146 IonicContact OE1-NH2 3.06Å; E1114-R1146 PolarHBondContact OE1-NH2 2.88Å
1115	N	77.8	Confident	75.4	Confident	96 Å²	96	27.2 Å²	27.2	51%	0.513	15%	0.149	S	C	.	.	H	α-helix	trans	-73.1	-42.4	173.1	-74.6	-24.5	0	0	0	111.8	K1111 P1112 L1113	K1111-N1115 VanDerWaalsContact O-CB 3.31Å; K1111-N1115 WeakPolarHBondContact O-CB 3.5Å; K1111-N1115 PolarHBondContact O-N 2.8Å; K1111-N1115 PolarHBondContact O-ND2 3.08Å; P1112-N1115 PolarHBondContact O-N 3.4Å; L1113-N1115 VanDerWaalsContact C-N 3.29Å; L1113-N1115 PolarHBondContact O-N 3.17Å
1116	N	76.9	Confident	75.9	Confident	21 Å²	21	24.2 Å²	24.2	11%	0.112	13%	0.133	C	C	.	.			trans	-122.7	83.6	172.1	-171.5	0.8	0	0	0	112.7	E398 P1112 L1113 A1118 S1119	E398-N1116 PolarHBondContact OE2-ND2 3.35Å; P1112-N1116 PolarHBondContact O-N 3.05Å; L1113-N1116 CarbonylContact O-C 3.1Å; L1113-N1116 PolarHBondContact O-N 3.18Å; N1116-A1118 PolarHBondContact O-N 2.67Å; N1116-A1118 WeakPolarHBondContact OD1-CA 3.33Å; N1116-A1118 WeakPolarHBondContact OD1-CB 3.23Å; N1116-A1118 PolarHBondContact OD1-N 3.43Å; N1116-S1119 VanDerWaalsContact O-CB 3.24Å; N1116-S1119 WeakPolarHBondContact O-CB 3.34Å; N1116-S1119 PolarHBondContact O-N 2.92Å; N1116-S1119 PolarHBondContact OD1-N 3.44Å
1117	P	75.2	Confident	76.1	Confident	4 Å²	4	24 Å²	24	3%	0.026	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	10.5	171.9	-15.4	22.5	0	0	0	115.2	L1113 E1114 Y1143 A1147 K1150 N1152	L1113-P1117 WeakPolarHBondContact O-CA 3.48Å; L1113-P1117 VanDerWaalsContact O-CD 3.26Å; L1113-P1117 WeakPolarHBondContact O-CD 3.27Å; E1114-P1117 WeakPolarHBondContact O-CD 3.37Å; P1117-Y1143 HydrophobicContact CB-CE2 3.75Å; P1117-Y1143 HydrophobicContact CG-CE2 4.04Å; P1117-A1147 HydrophobicContact CB-CB 4.28Å; P1117-K1150 HydrophobicContact CB-CD 4.04Å; P1117-K1150 HydrophobicContact CG-CD 4.35Å; P1117-N1152 WeakPolarHBondContact O-CB 3.19Å
1118	A	68.8	Low	76.2	Confident	19 Å²	19	21.8 Å²	21.8	16%	0.157	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	19.1	165.4	0	0	0	0	0	111.2	D437 N1116	D437-A1118 HydrophobicContact CB-CB 4.44Å; D437-A1118 WeakPolarHBondContact OD2-CA 3.33Å; N1116-A1118 PolarHBondContact O-N 2.67Å; N1116-A1118 WeakPolarHBondContact OD1-CA 3.33Å; N1116-A1118 WeakPolarHBondContact OD1-CB 3.23Å; N1116-A1118 PolarHBondContact OD1-N 3.43Å
1119	S	67.2	Low	76.6	Confident	16 Å²	16	20.1 Å²	20.1	11%	0.112	11%	0.107	C	C	.	.	S	Bend	trans	-97	111.8	164.3	-179.1	0	0	0	0	109.8	D437 N1116	D437-S1119 PolarHBondContact OD2-N 3.37Å; N1116-S1119 VanDerWaalsContact O-CB 3.24Å; N1116-S1119 WeakPolarHBondContact O-CB 3.34Å; N1116-S1119 PolarHBondContact O-N 2.92Å; N1116-S1119 PolarHBondContact OD1-N 3.44Å
1120	V	69.6	Low	76.8	Confident	18 Å²	18	19.7 Å²	19.7	11%	0.109	11%	0.105	C	C	.	.			trans	-71.1	143.1	178.3	-146.7	0	0	0	0	111.6	E436 D437 V1154	E436-V1120 HydrophobicContact CB-CB 3.97Å; E436-V1120 HydrophobicContact CB-CG1 3.58Å; E436-V1120 HydrophobicContact CB-CG2 3.55Å; E436-V1120 HydrophobicContact CG-CB 4.35Å; E436-V1120 HydrophobicContact CG-CG1 4.28Å; E436-V1120 HydrophobicContact CG-CG2 3.99Å; E436-V1120 VanDerWaalsContact OE2-CB 3.29Å; E436-V1120 WeakPolarHBondContact OE2-CB 3.4Å; D437-V1120 HydrophobicContact CB-CG2 3.99Å; D437-V1120 WeakPolarHBondContact OD1-CA 3.12Å; D437-V1120 WeakPolarHBondContact OD1-CB 3.41Å; D437-V1120 VanDerWaalsContact OD1-CG1 3.24Å; D437-V1120 WeakPolarHBondContact OD1-CG1 3.26Å; D437-V1120 WeakPolarHBondContact OD1-CG2 3.26Å; D437-V1120 PolarHBondContact OD2-N 3.17Å; V1120-V1154 HydrophobicContact CG1-CG2 3.91Å
1121	V	72.6	Confident	76.7	Confident	20 Å²	20	22.2 Å²	22.2	12%	0.121	12%	0.117	C	C	.	.			trans	-145.9	142.1	170.1	179.7	0	0	0	0	107.8	F1109 L1113 S1123 L1125 F1126 V1154	F1109-V1121 HydrophobicContact CE2-CG1 3.89Å; F1109-V1121 HydrophobicContact CZ-CG1 3.89Å; L1113-V1121 HydrophobicContact CD1-CG2 3.97Å; L1113-V1121 HydrophobicContact CD2-CG2 3.4Å; L1113-V1121 HydrophobicContact CG-CG2 4.31Å; V1121-S1123 PolarHBondContact O-N 3.49Å; V1121-L1125 HydrophobicContact CG1-CB 3.73Å; V1121-L1125 HydrophobicContact CG1-CD1 3.3Å; V1121-L1125 HydrophobicContact CG1-CG 4.13Å; V1121-F1126 HydrophobicContact CB-CE2 4.01Å; V1121-F1126 HydrophobicContact CB-CZ 4.3Å; V1121-V1154 WeakPolarHBondContact O-CG1 3.4Å
1122	S	72.3	Confident	76.8	Confident	9 Å²	9	20 Å²	20	6%	0.063	12%	0.115	C	C	.	.			trans	-38.2	132	174.6	176.2	0	0	0	0	113.3	G1124 L1125 R1189	S1122-G1124 PolarHBondContact O-N 2.96Å; S1122-G1124 VanDerWaalsContact O-N 3.11Å; S1122-G1124 PolarHBondContact OG-N 3.11Å; S1122-L1125 PolarHBondContact O-N 3.11Å; S1122-R1189 WeakPolarHBondContact OG-CD 3.26Å; S1122-R1189 WeakPolarHBondContact OG-CG 3.39Å
1123	S	75.9	Confident	77	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-55.7	-30.7	173.9	67.9	0	0	0	0	112.4	V1121 L1125 F1126 A1127 V1154 G1158 N1187 R1189	V1121-S1123 PolarHBondContact O-N 3.49Å; S1123-L1125 VanDerWaalsContact C-N 3.3Å; S1123-L1125 PolarHBondContact O-N 2.87Å; S1123-F1126 PolarHBondContact O-N 3.1Å; S1123-A1127 PolarHBondContact O-N 2.93Å; S1123-V1154 VanDerWaalsContact N-CG1 3.33Å; S1123-G1158 WeakPolarHBondContact O-CA 3.13Å; S1123-N1187 PolarHBondContact OG-O 3.29Å; S1123-R1189 PolarHBondContact OG-N 3.5Å
1124	G	75.1	Confident	77.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-32.4	174.3	0	0	0	0	0	113.8	S1122 A1127 F1128	S1122-G1124 PolarHBondContact O-N 2.96Å; S1122-G1124 VanDerWaalsContact O-N 3.11Å; S1122-G1124 PolarHBondContact OG-N 3.11Å; G1124-A1127 PolarHBondContact O-N 3.02Å; G1124-F1128 WeakPolarHBondContact O-CB 3.49Å; G1124-F1128 PolarHBondContact O-N 2.74Å
1125	L	79	Confident	77.5	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-74.7	-30.4	178.7	-75.3	162.7	0	0	0	112.5	F1094 E1098 I1101 F1109 V1121 S1122 S1123 L1129	F1094-L1125 HydrophobicContact CD2-CD1 3.61Å; F1094-L1125 HydrophobicContact CD2-CD2 4.33Å; F1094-L1125 HydrophobicContact CD2-CG 3.82Å; F1094-L1125 HydrophobicContact CE2-CD1 3.95Å; F1094-L1125 HydrophobicContact CE2-CD2 4.06Å; F1094-L1125 HydrophobicContact CE2-CG 3.59Å; F1094-L1125 HydrophobicContact CG-CD1 4.36Å; F1094-L1125 HydrophobicContact CZ-CD2 4.35Å; F1094-L1125 HydrophobicContact CZ-CG 4.33Å; E1098-L1125 HydrophobicContact CB-CD2 4.32Å; I1101-L1125 HydrophobicContact CD1-CB 4.38Å; I1101-L1125 HydrophobicContact CD1-CD2 3.89Å; F1109-L1125 HydrophobicContact CE2-CB 4.23Å; F1109-L1125 HydrophobicContact CE2-CD1 4.47Å; F1109-L1125 HydrophobicContact CZ-CB 3.87Å; V1121-L1125 HydrophobicContact CG1-CB 3.73Å; V1121-L1125 HydrophobicContact CG1-CD1 3.3Å; V1121-L1125 HydrophobicContact CG1-CG 4.13Å; S1122-L1125 PolarHBondContact O-N 3.11Å; S1123-L1125 VanDerWaalsContact C-N 3.3Å; S1123-L1125 PolarHBondContact O-N 2.87Å; L1125-L1129 WeakPolarHBondContact O-CB 3.44Å; L1125-L1129 PolarHBondContact O-N 3.31Å
1126	F	82.7	Confident	77.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.9	-36.9	171.5	-71.4	-70	0	0	0	112.3	F1109 L1113 V1121 S1123 L1130 V1140 Y1143 P1155	F1109-F1126 HydrophobicContact CE1-CE1 4.37Å; L1113-F1126 HydrophobicContact CD1-CE1 4.03Å; L1113-F1126 HydrophobicContact CD1-CZ 3.89Å; V1121-F1126 HydrophobicContact CB-CE2 4.01Å; V1121-F1126 HydrophobicContact CB-CZ 4.3Å; S1123-F1126 PolarHBondContact O-N 3.1Å; F1126-L1130 WeakPolarHBondContact O-CG 3.31Å; F1126-L1130 PolarHBondContact O-N 2.84Å; F1126-V1140 HydrophobicContact CD1-CG1 4.42Å; F1126-Y1143 HydrophobicContact CD1-CE1 4.46Å; F1126-Y1143 AromaticContact CE1-CD1 3.92Å; F1126-Y1143 HydrophobicContact CE1-CD1 3.92Å; F1126-Y1143 AromaticContact CE1-CE1 3.45Å; F1126-Y1143 HydrophobicContact CE1-CE1 3.45Å; F1126-Y1143 VanDerWaalsContact CE1-CE1 3.45Å; F1126-Y1143 HydrophobicContact CZ-CD1 4.47Å; F1126-Y1143 AromaticContact CZ-CE1 3.58Å; F1126-Y1143 HydrophobicContact CZ-CE1 3.58Å; F1126-P1155 HydrophobicContact CD1-CB 4.21Å; F1126-P1155 HydrophobicContact CD2-CB 4.16Å; F1126-P1155 HydrophobicContact CD2-CG 4.26Å; F1126-P1155 HydrophobicContact CE1-CB 4.16Å; F1126-P1155 HydrophobicContact CE1-CG 4.22Å; F1126-P1155 HydrophobicContact CE2-CB 4.09Å; F1126-P1155 HydrophobicContact CE2-CG 3.72Å; F1126-P1155 HydrophobicContact CG-CB 4.23Å; F1126-P1155 HydrophobicContact CZ-CB 4.11Å; F1126-P1155 HydrophobicContact CZ-CG 3.72Å
1127	A	81.6	Confident	78.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-72	-37	175.9	0	0	0	0	0	112.4	S1123 G1124 L1130 E1131 V1161 Y1192	S1123-A1127 PolarHBondContact O-N 2.93Å; G1124-A1127 PolarHBondContact O-N 3.02Å; A1127-L1130 PolarHBondContact O-N 2.77Å; A1127-E1131 WeakPolarHBondContact O-CB 3.24Å; A1127-E1131 PolarHBondContact O-N 2.92Å; A1127-V1161 HydrophobicContact CB-CB 3.95Å; A1127-V1161 HydrophobicContact CB-CG1 3.36Å; A1127-Y1192 VanDerWaalsContact C-OH 3.25Å; A1127-Y1192 HydrophobicContact CB-CD1 3.94Å; A1127-Y1192 HydrophobicContact CB-CE1 3.29Å; A1127-Y1192 PolarHBondContact O-OH 3.3Å
1128	F	79.5	Confident	78.7	Confident	27 Å²	27	30 Å²	30	12%	0.118	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-46.2	171.5	-174.8	-121.5	0	0	0	111.4	E1098 I1101 E1102 G1124 L1130 E1131 C1132 Y1192	E1098-F1128 HydrophobicContact CG-CE1 3.98Å; E1098-F1128 HydrophobicContact CG-CZ 4.32Å; I1101-F1128 HydrophobicContact CB-CD1 3.98Å; I1101-F1128 HydrophobicContact CB-CE1 3.93Å; I1101-F1128 HydrophobicContact CD1-CD1 3.93Å; I1101-F1128 HydrophobicContact CG2-CD1 3.7Å; I1101-F1128 HydrophobicContact CG2-CE1 3.78Å; E1102-F1128 HydrophobicContact CG-CE1 3.8Å; E1102-F1128 HydrophobicContact CG-CZ 3.5Å; G1124-F1128 WeakPolarHBondContact O-CB 3.49Å; G1124-F1128 PolarHBondContact O-N 2.74Å; F1128-L1130 PolarHBondContact O-N 3.35Å; F1128-E1131 WeakPolarHBondContact O-CB 3.42Å; F1128-E1131 PolarHBondContact O-N 3.37Å; F1128-E1131 VanDerWaalsContact O-N 3.11Å; F1128-C1132 PolarHBondContact O-N 2.7Å; F1128-C1132 PolarHBondContact O-SG 2.76Å; F1128-C1132 VanDerWaalsContact O-SG 3.35Å; F1128-Y1192 HydrophobicContact CB-CD2 4.42Å; F1128-Y1192 HydrophobicContact CB-CE2 3.74Å; F1128-Y1192 HydrophobicContact CD2-CE2 4.12Å; F1128-Y1192 HydrophobicContact CG-CE2 4.38Å; F1128-Y1192 PolarHBondContact N-OH 3.34Å
1129	L	82.6	Confident	79.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-52.7	-50.8	172.4	168.7	67.6	0	0	0	112.2	I1101 V1106 F1109 L1110 L1125 E1131 C1132 Q1133 L1136 V1140	I1101-L1129 HydrophobicContact CD1-CB 4.17Å; V1106-L1129 HydrophobicContact CB-CD1 4.25Å; V1106-L1129 HydrophobicContact CG1-CD1 3.37Å; V1106-L1129 HydrophobicContact CG2-CD1 3.83Å; F1109-L1129 HydrophobicContact CD1-CD1 4.47Å; F1109-L1129 HydrophobicContact CD1-CD2 4.13Å; F1109-L1129 HydrophobicContact CE1-CB 4.38Å; F1109-L1129 HydrophobicContact CE1-CD2 3.94Å; L1110-L1129 HydrophobicContact CD1-CD2 3.99Å; L1110-L1129 HydrophobicContact CD2-CD2 3.53Å; L1110-L1129 HydrophobicContact CG-CD2 3.74Å; L1125-L1129 WeakPolarHBondContact O-CB 3.44Å; L1125-L1129 PolarHBondContact O-N 3.31Å; L1129-E1131 VanDerWaalsContact C-N 3.27Å; L1129-E1131 PolarHBondContact O-N 3.05Å; L1129-C1132 PolarHBondContact O-N 3.35Å; L1129-Q1133 PolarHBondContact O-N 2.73Å; L1129-L1136 HydrophobicContact CD1-CD1 4.08Å; L1129-V1140 HydrophobicContact CD2-CG2 3.89Å
1130	L	82.9	Confident	80.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-72.1	-21.7	-179.6	-72.5	172.9	0	0	0	113.1	F1126 A1127 F1128 P1134 E1137 V1140 L1159 Y1162	F1126-L1130 WeakPolarHBondContact O-CG 3.31Å; F1126-L1130 PolarHBondContact O-N 2.84Å; A1127-L1130 PolarHBondContact O-N 2.77Å; F1128-L1130 PolarHBondContact O-N 3.35Å; L1130-P1134 WeakPolarHBondContact O-CA 3.45Å; L1130-E1137 HydrophobicContact CD2-CB 4.23Å; L1130-V1140 HydrophobicContact CD1-CB 4.21Å; L1130-V1140 HydrophobicContact CD1-CG1 3.93Å; L1130-V1140 HydrophobicContact CD2-CB 3.98Å; L1130-V1140 HydrophobicContact CD2-CG2 3.74Å; L1130-V1140 HydrophobicContact CG-CB 4.34Å; L1130-V1140 HydrophobicContact CG-CG1 4.38Å; L1130-V1140 HydrophobicContact CG-CG2 4.14Å; L1130-L1159 HydrophobicContact CD1-CD2 3.54Å; L1130-L1159 HydrophobicContact CD1-CG 4.25Å; L1130-Y1162 VanDerWaalsContact C-CE2 3.42Å; L1130-Y1162 HydrophobicContact CB-CD1 4.07Å; L1130-Y1162 HydrophobicContact CB-CD2 3.38Å; L1130-Y1162 HydrophobicContact CB-CE1 4.18Å; L1130-Y1162 HydrophobicContact CB-CE2 3.52Å; L1130-Y1162 HydrophobicContact CB-CG 3.68Å; L1130-Y1162 HydrophobicContact CD1-CD1 3.8Å; L1130-Y1162 HydrophobicContact CD1-CD2 4.42Å; L1130-Y1162 HydrophobicContact CD1-CE1 4.36Å; L1130-Y1162 HydrophobicContact CD1-CG 3.84Å; L1130-Y1162 HydrophobicContact CG-CG 4.44Å; L1130-Y1162 WeakPolarHBondContact O-CE2 3.3Å
1131	E	79.5	Confident	81.2	Confident	54 Å²	54	33.5 Å²	33.5	25%	0.252	17%	0.171	S	C	.	.	H	α-helix	trans	-70.8	-43.2	169.1	179.2	174.9	-137.4	0	0	111.7	A1127 F1128 L1129 Y1192 Q1196 R1200	A1127-E1131 WeakPolarHBondContact O-CB 3.24Å; A1127-E1131 PolarHBondContact O-N 2.92Å; F1128-E1131 WeakPolarHBondContact O-CB 3.42Å; F1128-E1131 PolarHBondContact O-N 3.37Å; F1128-E1131 VanDerWaalsContact O-N 3.11Å; L1129-E1131 VanDerWaalsContact C-N 3.27Å; L1129-E1131 PolarHBondContact O-N 3.05Å; E1131-Y1192 PolarHBondContact OE2-OH 3.22Å; E1131-Q1196 VanDerWaalsContact CD-NE2 3.29Å; E1131-Q1196 PolarHBondContact OE1-NE2 3.18Å; E1131-Q1196 VanDerWaalsContact OE1-NE2 3.11Å; E1131-Q1196 PolarHBondContact OE1-OE1 2.85Å; E1131-Q1196 PolarHBondContact OE2-NE2 3Å; E1131-R1200 VanDerWaalsContact CD-NH2 3.29Å; E1131-R1200 IonicContact OE1-CZ 2.87Å; E1131-R1200 IonicContact OE1-NE 2.83Å; E1131-R1200 IonicContact OE1-NH2 3.22Å; E1131-R1200 PolarHBondContact OE1-NH2 3.29Å
1132	C	80	Confident	81.7	Confident	61 Å²	61	34.9 Å²	34.9	41%	0.412	18%	0.184	S	C	.	.	H	α-helix	trans	-72.6	-38.9	176.1	-63.1	0	0	0	0	113.3	I1101 F1128 L1129	I1101-C1132 HydrophobicContact CG2-CB 4.07Å; F1128-C1132 PolarHBondContact O-N 2.7Å; F1128-C1132 PolarHBondContact O-SG 2.76Å; F1128-C1132 VanDerWaalsContact O-SG 3.35Å; L1129-C1132 PolarHBondContact O-N 3.35Å
1133	Q	82.2	Confident	82.4	Confident	54 Å²	54	34.5 Å²	34.5	25%	0.252	18%	0.182	S	C	.	.			trans	-138	81.2	-174.2	-70	-170.7	-3	0	0	111.3	V1106 L1129 D1135 L1136	V1106-Q1133 HydrophobicContact CG2-CG 4.48Å; L1129-Q1133 PolarHBondContact O-N 2.73Å; Q1133-D1135 VanDerWaalsContact C-N 3.29Å; Q1133-D1135 WeakPolarHBondContact CA-OD1 3.39Å; Q1133-D1135 PolarHBondContact O-N 3.09Å; Q1133-L1136 HydrophobicContact CB-CD1 3.8Å; Q1133-L1136 HydrophobicContact CB-CG 4.08Å; Q1133-L1136 WeakPolarHBondContact O-CB 3.33Å; Q1133-L1136 PolarHBondContact O-N 3.24Å; Q1133-L1136 VanDerWaalsContact OE1-CD1 3.25Å
1134	P	83.5	Confident	82.8	Confident	64 Å²	64	34.5 Å²	34.5	42%	0.416	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-73.5	-17.1	-177.6	30.1	-36.1	0	0	0	113.8	L1130 L1136 E1137	L1130-P1134 WeakPolarHBondContact O-CA 3.45Å; P1134-L1136 PolarHBondContact O-N 3.21Å; P1134-E1137 VanDerWaalsContact O-CB 3.29Å; P1134-E1137 WeakPolarHBondContact O-CB 3.26Å; P1134-E1137 PolarHBondContact O-N 3.14Å; P1134-E1137 VanDerWaalsContact O-N 3.09Å
1135	D	83.3	Confident	83.3	Confident	124 Å²	124	38.5 Å²	38.5	66%	0.663	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-61.7	-23	171.4	59.3	-59.8	0	0	0	112.5	Q1133 E1137	Q1133-D1135 VanDerWaalsContact C-N 3.29Å; Q1133-D1135 WeakPolarHBondContact CA-OD1 3.39Å; Q1133-D1135 PolarHBondContact O-N 3.09Å; D1135-E1137 PolarHBondContact O-N 2.95Å
1136	L	83.8	Confident	83.5	Confident	19 Å²	19	43.1 Å²	43.1	10%	0.099	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-80.3	3.5	174.8	-58	179.9	0	0	0	113.5	V1106 L1110 L1129 Q1133 P1134 E1138 R1139 V1140	V1106-L1136 HydrophobicContact CG1-CD1 3.52Å; L1110-L1136 HydrophobicContact CD1-CD1 3.82Å; L1129-L1136 HydrophobicContact CD1-CD1 4.08Å; Q1133-L1136 HydrophobicContact CB-CD1 3.8Å; Q1133-L1136 HydrophobicContact CB-CG 4.08Å; Q1133-L1136 WeakPolarHBondContact O-CB 3.33Å; Q1133-L1136 PolarHBondContact O-N 3.24Å; Q1133-L1136 VanDerWaalsContact OE1-CD1 3.25Å; P1134-L1136 PolarHBondContact O-N 3.21Å; L1136-E1138 VanDerWaalsContact C-N 3.34Å; L1136-E1138 PolarHBondContact O-N 2.52Å; L1136-R1139 HydrophobicContact CB-CB 4.47Å; L1136-R1139 CarbonylContact O-C 3.6Å; L1136-R1139 WeakPolarHBondContact O-CA 3.46Å; L1136-R1139 WeakPolarHBondContact O-CB 3.22Å; L1136-R1139 PolarHBondContact O-N 2.86Å; L1136-V1140 HydrophobicContact CB-CG2 4.42Å; L1136-V1140 WeakPolarHBondContact O-CG2 3.32Å; L1136-V1140 PolarHBondContact O-N 3.19Å
1137	E	85	Confident	83.5	Confident	18 Å²	18	43.1 Å²	43.1	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-54.7	-45.9	-178.1	-166.1	-173.3	138	0	0	112.7	L1130 P1134 D1135 R1139 V1140 K1141 L1159 Y1163 R1168	L1130-E1137 HydrophobicContact CD2-CB 4.23Å; P1134-E1137 VanDerWaalsContact O-CB 3.29Å; P1134-E1137 WeakPolarHBondContact O-CB 3.26Å; P1134-E1137 PolarHBondContact O-N 3.14Å; P1134-E1137 VanDerWaalsContact O-N 3.09Å; D1135-E1137 PolarHBondContact O-N 2.95Å; E1137-R1139 VanDerWaalsContact C-N 3.34Å; E1137-R1139 PolarHBondContact O-N 3.17Å; E1137-V1140 PolarHBondContact O-N 3.25Å; E1137-K1141 WeakPolarHBondContact O-CB 3.14Å; E1137-K1141 WeakPolarHBondContact O-CG 3.32Å; E1137-K1141 PolarHBondContact O-N 3.36Å; E1137-K1141 WeakPolarHBondContact OE1-CE 3.43Å; E1137-K1141 IonicContact OE1-NZ 3.91Å; E1137-K1141 PolarHBondContact OE1-NZ 2.84Å; E1137-L1159 HydrophobicContact CG-CD2 4.49Å; E1137-Y1163 PolarHBondContact OE1-OH 2.87Å; E1137-R1168 IonicContact OE1-CZ 3.91Å; E1137-R1168 IonicContact OE1-NH1 3.64Å; E1137-R1168 PolarHBondContact OE1-NH1 2.99Å; E1137-R1168 IonicContact OE2-CZ 3.91Å; E1137-R1168 VanDerWaalsContact OE2-CZ 3.26Å; E1137-R1168 IonicContact OE2-NH1 2.93Å; E1137-R1168 PolarHBondContact OE2-NH1 3.19Å; E1137-R1168 IonicContact OE2-NH2 3.88Å; E1137-R1168 PolarHBondContact OE2-NH2 3.49Å
1138	E	84.9	Confident	83.6	Confident	124 Å²	124	45.3 Å²	45.3	58%	0.579	23%	0.234	S	C	*	.	H	α-helix	trans	-67.4	-32.7	175.7	-70.7	-55	131.1	0	0	112.9	L1136 K1141 A1142	L1136-E1138 VanDerWaalsContact C-N 3.34Å; L1136-E1138 PolarHBondContact O-N 2.52Å; E1138-K1141 VanDerWaalsContact OE1-CD 3.29Å; E1138-K1141 WeakPolarHBondContact OE1-CD 2.93Å; E1138-K1141 IonicContact OE1-NZ 3.43Å; E1138-K1141 PolarHBondContact OE1-NZ 3.5Å; E1138-A1142 VanDerWaalsContact O-CB 3.26Å; E1138-A1142 WeakPolarHBondContact O-CB 3.22Å; E1138-A1142 PolarHBondContact O-N 2.86Å
1139	R	84.6	Confident	83.7	Confident	69 Å²	69	48.2 Å²	48.2	26%	0.26	26%	0.263	S	S	.	.	H	α-helix	trans	-69	-40.9	174.8	-170.2	-177.4	-177.7	176.3	-1.1	111.1	E1107 E1114 L1136 E1137 Y1143	E1107-R1139 IonicContact OE1-CZ 2.74Å; E1107-R1139 IonicContact OE1-NH1 2.67Å; E1107-R1139 PolarHBondContact OE1-NH1 3.03Å; E1107-R1139 IonicContact OE1-NH2 3.17Å; E1107-R1139 PolarHBondContact OE1-NH2 3.23Å; E1107-R1139 IonicContact OE2-NH2 3.59Å; E1114-R1139 IonicContact OE1-NE 2.93Å; E1114-R1139 PolarHBondContact OE1-NE 3.46Å; E1114-R1139 IonicContact OE2-CZ 2.71Å; E1114-R1139 VanDerWaalsContact OE2-CZ 3.3Å; E1114-R1139 IonicContact OE2-NE 2.84Å; E1114-R1139 PolarHBondContact OE2-NE 3.22Å; E1114-R1139 VanDerWaalsContact OE2-NE 3.09Å; E1114-R1139 IonicContact OE2-NH2 3.96Å; E1114-R1139 PolarHBondContact OE2-NH2 3.39Å; L1136-R1139 HydrophobicContact CB-CB 4.47Å; L1136-R1139 CarbonylContact O-C 3.6Å; L1136-R1139 WeakPolarHBondContact O-CA 3.46Å; L1136-R1139 WeakPolarHBondContact O-CB 3.22Å; L1136-R1139 PolarHBondContact O-N 2.86Å; E1137-R1139 VanDerWaalsContact C-N 3.34Å; E1137-R1139 PolarHBondContact O-N 3.17Å; R1139-Y1143 WeakPolarHBondContact O-CB 3.38Å; R1139-Y1143 PolarHBondContact O-N 2.96Å
1140	V	85.9	Confident	83.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-73.7	-33.5	176.4	-178.5	0	0	0	0	111.2	F1126 L1129 L1130 L1136 E1137 Y1143 S1144 L1159	F1126-V1140 HydrophobicContact CD1-CG1 4.42Å; L1129-V1140 HydrophobicContact CD2-CG2 3.89Å; L1130-V1140 HydrophobicContact CD1-CB 4.21Å; L1130-V1140 HydrophobicContact CD1-CG1 3.93Å; L1130-V1140 HydrophobicContact CD2-CB 3.98Å; L1130-V1140 HydrophobicContact CD2-CG2 3.74Å; L1130-V1140 HydrophobicContact CG-CB 4.34Å; L1130-V1140 HydrophobicContact CG-CG1 4.38Å; L1130-V1140 HydrophobicContact CG-CG2 4.14Å; L1136-V1140 HydrophobicContact CB-CG2 4.42Å; L1136-V1140 WeakPolarHBondContact O-CG2 3.32Å; L1136-V1140 PolarHBondContact O-N 3.19Å; E1137-V1140 PolarHBondContact O-N 3.25Å; V1140-Y1143 PolarHBondContact O-N 2.81Å; V1140-S1144 VanDerWaalsContact O-CB 3.25Å; V1140-S1144 WeakPolarHBondContact O-CB 3.5Å; V1140-S1144 PolarHBondContact O-N 2.86Å; V1140-S1144 PolarHBondContact O-OG 3.11Å; V1140-L1159 HydrophobicContact CG1-CD1 4.3Å; V1140-L1159 HydrophobicContact CG1-CD2 4.21Å; V1140-L1159 HydrophobicContact CG1-CG 4.03Å
1141	K	87.3	Confident	83.2	Confident	56 Å²	56	53.7 Å²	53.7	24%	0.243	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-56	166.6	-77.5	171.2	-173.5	163.5	0	110.8	E1137 E1138 Y1143 S1144 V1145 L1159 Y1163	E1137-K1141 WeakPolarHBondContact O-CB 3.14Å; E1137-K1141 WeakPolarHBondContact O-CG 3.32Å; E1137-K1141 PolarHBondContact O-N 3.36Å; E1137-K1141 WeakPolarHBondContact OE1-CE 3.43Å; E1137-K1141 IonicContact OE1-NZ 3.91Å; E1137-K1141 PolarHBondContact OE1-NZ 2.84Å; E1138-K1141 VanDerWaalsContact OE1-CD 3.29Å; E1138-K1141 WeakPolarHBondContact OE1-CD 2.93Å; E1138-K1141 IonicContact OE1-NZ 3.43Å; E1138-K1141 PolarHBondContact OE1-NZ 3.5Å; K1141-Y1143 PolarHBondContact O-N 2.9Å; K1141-S1144 PolarHBondContact O-N 3.3Å; K1141-S1144 PolarHBondContact O-OG 3.42Å; K1141-V1145 WeakPolarHBondContact O-CG2 3.45Å; K1141-V1145 PolarHBondContact O-N 2.91Å; K1141-L1159 HydrophobicContact CG-CD1 4.15Å; K1141-L1159 HydrophobicContact CG-CD2 4.31Å; K1141-Y1163 WeakPolarHBondContact CE-OH 3.42Å
1142	A	85.1	Confident	83.3	Confident	49 Å²	49	51.1 Å²	51.1	41%	0.405	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-32.7	177.9	0	0	0	0	0	112.5	E1138 R1146	E1138-A1142 VanDerWaalsContact O-CB 3.26Å; E1138-A1142 WeakPolarHBondContact O-CB 3.22Å; E1138-A1142 PolarHBondContact O-N 2.86Å; A1142-R1146 WeakPolarHBondContact O-CB 3.21Å; A1142-R1146 VanDerWaalsContact O-CG 3.24Å; A1142-R1146 WeakPolarHBondContact O-CG 3.5Å; A1142-R1146 PolarHBondContact O-N 3.4Å; A1142-R1146 PolarHBondContact O-NE 3.24Å
1143	Y	85.5	Confident	83.6	Confident	1 Å²	1	49.6 Å²	49.6	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-45.2	171.2	175.7	-112.4	0	0	0	111.9	L1113 E1114 P1117 F1126 R1139 V1140 K1141 V1145 R1146 A1147 P1155	L1113-Y1143 HydrophobicContact CB-CE1 4.47Å; L1113-Y1143 HydrophobicContact CB-CE2 4.25Å; L1113-Y1143 WeakPolarHBondContact O-CE2 3.4Å; E1114-Y1143 HydrophobicContact CG-CD2 4.05Å; P1117-Y1143 HydrophobicContact CB-CE2 3.75Å; P1117-Y1143 HydrophobicContact CG-CE2 4.04Å; F1126-Y1143 HydrophobicContact CD1-CE1 4.46Å; F1126-Y1143 AromaticContact CE1-CD1 3.92Å; F1126-Y1143 HydrophobicContact CE1-CD1 3.92Å; F1126-Y1143 AromaticContact CE1-CE1 3.45Å; F1126-Y1143 HydrophobicContact CE1-CE1 3.45Å; F1126-Y1143 VanDerWaalsContact CE1-CE1 3.45Å; F1126-Y1143 HydrophobicContact CZ-CD1 4.47Å; F1126-Y1143 AromaticContact CZ-CE1 3.58Å; F1126-Y1143 HydrophobicContact CZ-CE1 3.58Å; R1139-Y1143 WeakPolarHBondContact O-CB 3.38Å; R1139-Y1143 PolarHBondContact O-N 2.96Å; V1140-Y1143 PolarHBondContact O-N 2.81Å; K1141-Y1143 PolarHBondContact O-N 2.9Å; Y1143-V1145 VanDerWaalsContact C-N 3.31Å; Y1143-V1145 PolarHBondContact O-N 3.42Å; Y1143-R1146 CarbonylContact O-C 3.57Å; Y1143-R1146 WeakPolarHBondContact O-CA 3.38Å; Y1143-R1146 WeakPolarHBondContact O-CB 3.39Å; Y1143-R1146 PolarHBondContact O-N 3.33Å; Y1143-A1147 HydrophobicContact CE1-CB 4.39Å; Y1143-A1147 HydrophobicContact CE2-CB 4.38Å; Y1143-A1147 VanDerWaalsContact O-CB 3.26Å; Y1143-A1147 WeakPolarHBondContact O-CB 3.13Å; Y1143-A1147 PolarHBondContact O-N 3.1Å; Y1143-P1155 HydrophobicContact CD1-CB 3.84Å; Y1143-P1155 HydrophobicContact CD1-CG 3.97Å; Y1143-P1155 HydrophobicContact CE1-CB 3.69Å; Y1143-P1155 HydrophobicContact CE1-CG 3.31Å
1144	S	85.7	Confident	83.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-38.1	179	75.9	0	0	0	0	112.4	V1140 K1141 A1147 M1148 K1156 L1159	V1140-S1144 VanDerWaalsContact O-CB 3.25Å; V1140-S1144 WeakPolarHBondContact O-CB 3.5Å; V1140-S1144 PolarHBondContact O-N 2.86Å; V1140-S1144 PolarHBondContact O-OG 3.11Å; K1141-S1144 PolarHBondContact O-N 3.3Å; K1141-S1144 PolarHBondContact O-OG 3.42Å; S1144-A1147 PolarHBondContact O-N 2.96Å; S1144-M1148 WeakPolarHBondContact O-CB 3.35Å; S1144-M1148 VanDerWaalsContact O-CG 3.3Å; S1144-M1148 WeakPolarHBondContact O-CG 3.37Å; S1144-M1148 PolarHBondContact O-N 3.11Å; S1144-K1156 WeakPolarHBondContact OG-CD 3.44Å; S1144-L1159 WeakPolarHBondContact OG-CD1 3.11Å
1145	V	85.5	Confident	83.7	Confident	85 Å²	85	44.4 Å²	44.4	52%	0.515	24%	0.237	S	C	.	.	H	α-helix	trans	-66.6	-41.6	173.2	175.7	0	0	0	0	110.8	K1141 Y1143 A1147 A1149	K1141-V1145 WeakPolarHBondContact O-CG2 3.45Å; K1141-V1145 PolarHBondContact O-N 2.91Å; Y1143-V1145 VanDerWaalsContact C-N 3.31Å; Y1143-V1145 PolarHBondContact O-N 3.42Å; V1145-A1147 VanDerWaalsContact C-N 3.35Å; V1145-A1149 VanDerWaalsContact O-CB 3.31Å; V1145-A1149 WeakPolarHBondContact O-CB 3.41Å; V1145-A1149 PolarHBondContact O-N 2.83Å; V1145-A1149 VanDerWaalsContact O-N 3.1Å
1146	R	82.7	Confident	83.9	Confident	100 Å²	100	39.4 Å²	39.4	38%	0.377	21%	0.21	S	C	.	.	H	α-helix	trans	-66.5	-33	174.4	-74.6	177.4	-71.3	162.4	-1.5	113.2	E1114 A1142 Y1143	E1114-R1146 IonicContact OE1-CZ 3.87Å; E1114-R1146 IonicContact OE1-NH1 3.43Å; E1114-R1146 PolarHBondContact OE1-NH1 3.11Å; E1114-R1146 IonicContact OE1-NH2 3.06Å; E1114-R1146 PolarHBondContact OE1-NH2 2.88Å; A1142-R1146 WeakPolarHBondContact O-CB 3.21Å; A1142-R1146 VanDerWaalsContact O-CG 3.24Å; A1142-R1146 WeakPolarHBondContact O-CG 3.5Å; A1142-R1146 PolarHBondContact O-N 3.4Å; A1142-R1146 PolarHBondContact O-NE 3.24Å; Y1143-R1146 CarbonylContact O-C 3.57Å; Y1143-R1146 WeakPolarHBondContact O-CA 3.38Å; Y1143-R1146 WeakPolarHBondContact O-CB 3.39Å; Y1143-R1146 PolarHBondContact O-N 3.33Å
1147	A	82.7	Confident	83.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-76.9	-47.8	-179.7	0	0	0	0	0	110.7	P1117 Y1143 S1144 V1145 A1149 K1150 G1151 N1152 P1155	P1117-A1147 HydrophobicContact CB-CB 4.28Å; Y1143-A1147 HydrophobicContact CE1-CB 4.39Å; Y1143-A1147 HydrophobicContact CE2-CB 4.38Å; Y1143-A1147 VanDerWaalsContact O-CB 3.26Å; Y1143-A1147 WeakPolarHBondContact O-CB 3.13Å; Y1143-A1147 PolarHBondContact O-N 3.1Å; S1144-A1147 PolarHBondContact O-N 2.96Å; V1145-A1147 VanDerWaalsContact C-N 3.35Å; A1147-A1149 VanDerWaalsContact C-N 3.27Å; A1147-A1149 PolarHBondContact O-N 3.41Å; A1147-K1150 CarbonylContact O-C 3.31Å; A1147-K1150 WeakPolarHBondContact O-CA 3.3Å; A1147-K1150 PolarHBondContact O-N 2.91Å; A1147-G1151 PolarHBondContact O-N 2.91Å; A1147-G1151 VanDerWaalsContact O-N 3.11Å; A1147-N1152 CarbonylContact C-O 3.58Å; A1147-N1152 HydrophobicContact CB-CB 3.96Å; A1147-N1152 PolarHBondContact O-N 3.01Å; A1147-P1155 HydrophobicContact CB-CG 3.81Å
1148	M	83.5	Confident	83.9	Confident	46 Å²	46	37.7 Å²	37.7	23%	0.227	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-38.6	173.9	-74.2	-171.5	-52.9	0	0	111.7	S1144 K1150 G1151 N1152 V1153 K1156 E1178 L1179	S1144-M1148 WeakPolarHBondContact O-CB 3.35Å; S1144-M1148 VanDerWaalsContact O-CG 3.3Å; S1144-M1148 WeakPolarHBondContact O-CG 3.37Å; S1144-M1148 PolarHBondContact O-N 3.11Å; M1148-K1150 PolarHBondContact O-N 3.37Å; M1148-K1150 VanDerWaalsContact O-N 3.11Å; M1148-G1151 PolarHBondContact O-N 3.32Å; M1148-N1152 WeakPolarHBondContact CA-O 3.49Å; M1148-N1152 PolarHBondContact N-O 3.45Å; M1148-V1153 HydrophobicContact CG-CG1 4.41Å; M1148-K1156 HydrophobicContact CE-CB 4.42Å; M1148-K1156 HydrophobicContact CE-CD 3.73Å; M1148-K1156 HydrophobicContact CE-CG 4.07Å; M1148-K1156 HydrophobicContact CG-CB 4.16Å; M1148-K1156 HydrophobicContact SD-CB 3.64Å; M1148-K1156 HydrophobicContact SD-CD 3.98Å; M1148-K1156 HydrophobicContact SD-CG 3.6Å; M1148-E1178 WeakPolarHBondContact CE-OE1 3.44Å; M1148-L1179 HydrophobicContact SD-CD2 3.76Å
1149	A	81.4	Confident	83.9	Confident	88 Å²	88	31.8 Å²	31.8	73%	0.727	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.6	173.4	0	0	0	0	0	114.3	V1145 A1147	V1145-A1149 VanDerWaalsContact O-CB 3.31Å; V1145-A1149 WeakPolarHBondContact O-CB 3.41Å; V1145-A1149 PolarHBondContact O-N 2.83Å; V1145-A1149 VanDerWaalsContact O-N 3.1Å; A1147-A1149 VanDerWaalsContact C-N 3.27Å; A1147-A1149 PolarHBondContact O-N 3.41Å
1150	K	76.9	Confident	84.1	Confident	105 Å²	105	28.9 Å²	28.9	46%	0.457	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-3.5	171.6	-65.7	-164.4	-173.5	-179.1	0	114.1	P1117 A1147 M1148	P1117-K1150 HydrophobicContact CB-CD 4.04Å; P1117-K1150 HydrophobicContact CG-CD 4.35Å; A1147-K1150 CarbonylContact O-C 3.31Å; A1147-K1150 WeakPolarHBondContact O-CA 3.3Å; A1147-K1150 PolarHBondContact O-N 2.91Å; M1148-K1150 PolarHBondContact O-N 3.37Å; M1148-K1150 VanDerWaalsContact O-N 3.11Å
1151	G	77.6	Confident	83.9	Confident	10 Å²	10	28.9 Å²	28.9	10%	0.103	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	103	-1.3	-179.4	0	0	0	0	0	115.2	D437 A439 A1147 M1148 V1153	D437-G1151 CarbonylContact O-C 3.53Å; D437-G1151 VanDerWaalsContact O-C 3.31Å; A439-G1151 VanDerWaalsContact CB-CA 3.48Å; A439-G1151 WeakPolarHBondContact CB-O 2.83Å; A439-G1151 PolarHBondContact N-O 2.77Å; A1147-G1151 PolarHBondContact O-N 2.91Å; A1147-G1151 VanDerWaalsContact O-N 3.11Å; M1148-G1151 PolarHBondContact O-N 3.32Å; G1151-V1153 PolarHBondContact O-N 2.8Å
1152	N	82.2	Confident	83.8	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.			trans	-89.6	103.8	177.4	-176.8	-9.2	0	0	0	111.2	D437 P1117 A1147 M1148 V1154 P1155	D437-N1152 HydrophobicContact CB-CB 4.03Å; D437-N1152 VanDerWaalsContact OD1-CB 3.29Å; D437-N1152 WeakPolarHBondContact OD1-CB 3.29Å; D437-N1152 PolarHBondContact OD1-ND2 3.31Å; D437-N1152 PolarHBondContact OD1-OD1 2.81Å; D437-N1152 WeakPolarHBondContact OD2-CB 2.83Å; D437-N1152 VanDerWaalsContact OD2-CG 3.27Å; D437-N1152 PolarHBondContact OD2-ND2 3.06Å; P1117-N1152 WeakPolarHBondContact O-CB 3.19Å; A1147-N1152 CarbonylContact C-O 3.58Å; A1147-N1152 HydrophobicContact CB-CB 3.96Å; A1147-N1152 PolarHBondContact O-N 3.01Å; M1148-N1152 WeakPolarHBondContact CA-O 3.49Å; M1148-N1152 PolarHBondContact N-O 3.45Å; N1152-V1154 WeakPolarHBondContact OD1-CB 3.44Å; N1152-V1154 WeakPolarHBondContact OD1-CG2 3.11Å; N1152-V1154 PolarHBondContact OD1-N 3.28Å; N1152-P1155 WeakPolarHBondContact OD1-CD 3.49Å
1153	V	85.7	Confident	83.8	Confident	29 Å²	29	24.4 Å²	24.4	18%	0.176	13%	0.134	C	C	.	.			trans	-84.2	-14.1	174.3	-65	0	0	0	0	113.4	M1148 G1151 K1156 V1157 L1179 V1183 N1187	M1148-V1153 HydrophobicContact CG-CG1 4.41Å; G1151-V1153 PolarHBondContact O-N 2.8Å; V1153-K1156 WeakPolarHBondContact O-CA 2.97Å; V1153-K1156 WeakPolarHBondContact O-CB 3.17Å; V1153-K1156 PolarHBondContact O-N 2.95Å; V1153-V1157 PolarHBondContact O-N 3.32Å; V1153-L1179 HydrophobicContact CB-CD2 4.32Å; V1153-L1179 HydrophobicContact CG1-CD2 4.15Å; V1153-V1183 HydrophobicContact CB-CG1 4.16Å; V1153-V1183 HydrophobicContact CG1-CG1 4.03Å; V1153-V1183 HydrophobicContact CG2-CG1 3.86Å; V1153-N1187 HydrophobicContact CG2-CB 4.17Å
1154	V	84.7	Confident	83.6	Confident	8 Å²	8	25.2 Å²	25.2	5%	0.048	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-34.6	-167.1	-165.8	0	0	0	0	114	V1120 V1121 S1123 N1152 K1156 V1157 G1158	V1120-V1154 HydrophobicContact CG1-CG2 3.91Å; V1121-V1154 WeakPolarHBondContact O-CG1 3.4Å; S1123-V1154 VanDerWaalsContact N-CG1 3.33Å; N1152-V1154 WeakPolarHBondContact OD1-CB 3.44Å; N1152-V1154 WeakPolarHBondContact OD1-CG2 3.11Å; N1152-V1154 PolarHBondContact OD1-N 3.28Å; V1154-K1156 VanDerWaalsContact C-N 3.35Å; V1154-V1157 CarbonylContact O-C 3.53Å; V1154-V1157 PolarHBondContact O-N 2.73Å; V1154-G1158 PolarHBondContact O-N 2.98Å
1155	P	84	Confident	83.3	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-69.4	-29.2	171.1	-20.1	30.1	0	0	0	113.5	F1126 Y1143 A1147 N1152 G1158 L1159	F1126-P1155 HydrophobicContact CD1-CB 4.21Å; F1126-P1155 HydrophobicContact CD2-CB 4.16Å; F1126-P1155 HydrophobicContact CD2-CG 4.26Å; F1126-P1155 HydrophobicContact CE1-CB 4.16Å; F1126-P1155 HydrophobicContact CE1-CG 4.22Å; F1126-P1155 HydrophobicContact CE2-CB 4.09Å; F1126-P1155 HydrophobicContact CE2-CG 3.72Å; F1126-P1155 HydrophobicContact CG-CB 4.23Å; F1126-P1155 HydrophobicContact CZ-CB 4.11Å; F1126-P1155 HydrophobicContact CZ-CG 3.72Å; Y1143-P1155 HydrophobicContact CD1-CB 3.84Å; Y1143-P1155 HydrophobicContact CD1-CG 3.97Å; Y1143-P1155 HydrophobicContact CE1-CB 3.69Å; Y1143-P1155 HydrophobicContact CE1-CG 3.31Å; A1147-P1155 HydrophobicContact CB-CG 3.81Å; N1152-P1155 WeakPolarHBondContact OD1-CD 3.49Å; P1155-G1158 PolarHBondContact O-N 2.75Å; P1155-L1159 PolarHBondContact O-N 3.2Å
1156	K	86.4	Confident	83	Confident	20 Å²	20	24.9 Å²	24.9	9%	0.087	13%	0.13	C	C	.	.	H	α-helix	trans	-76.3	-38	175.1	-163.1	79.9	-177.3	-126.4	0	110.6	S1144 M1148 V1153 V1154 G1158 L1159 W1160 I1175 E1178 L1179	S1144-K1156 WeakPolarHBondContact OG-CD 3.44Å; M1148-K1156 HydrophobicContact CE-CB 4.42Å; M1148-K1156 HydrophobicContact CE-CD 3.73Å; M1148-K1156 HydrophobicContact CE-CG 4.07Å; M1148-K1156 HydrophobicContact CG-CB 4.16Å; M1148-K1156 HydrophobicContact SD-CB 3.64Å; M1148-K1156 HydrophobicContact SD-CD 3.98Å; M1148-K1156 HydrophobicContact SD-CG 3.6Å; V1153-K1156 WeakPolarHBondContact O-CA 2.97Å; V1153-K1156 WeakPolarHBondContact O-CB 3.17Å; V1153-K1156 PolarHBondContact O-N 2.95Å; V1154-K1156 VanDerWaalsContact C-N 3.35Å; K1156-G1158 VanDerWaalsContact C-N 3.27Å; K1156-G1158 PolarHBondContact O-N 3.27Å; K1156-L1159 HydrophobicContact CD-CD1 4.24Å; K1156-L1159 WeakPolarHBondContact O-CB 3.39Å; K1156-L1159 PolarHBondContact O-N 3.27Å; K1156-W1160 PolarHBondContact O-N 2.63Å; K1156-I1175 HydrophobicContact CD-CD1 4.19Å; K1156-I1175 HydrophobicContact CG-CD1 4.38Å; K1156-I1175 HydrophobicContact CG-CG2 3.87Å; K1156-E1178 VanDerWaalsContact CE-OE2 3.24Å; K1156-E1178 WeakPolarHBondContact CE-OE2 3.25Å; K1156-E1178 IonicContact NZ-OE1 3.67Å; K1156-E1178 PolarHBondContact NZ-OE1 3.28Å; K1156-E1178 IonicContact NZ-OE2 2.72Å; K1156-E1178 PolarHBondContact NZ-OE2 2.77Å; K1156-L1179 HydrophobicContact CB-CD1 4.14Å; K1156-L1179 HydrophobicContact CB-CD2 4.37Å; K1156-L1179 HydrophobicContact CG-CD1 3.95Å; K1156-L1179 HydrophobicContact CG-CD2 4.16Å; K1156-L1179 HydrophobicContact CG-CG 4.23Å
1157	V	85	Confident	82.8	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-34.2	166.4	178.9	0	0	0	0	110.8	V1153 V1154 W1160 V1161 L1179 N1187 M1188	V1153-V1157 PolarHBondContact O-N 3.32Å; V1154-V1157 CarbonylContact O-C 3.53Å; V1154-V1157 PolarHBondContact O-N 2.73Å; V1157-W1160 WeakPolarHBondContact O-CB 3.26Å; V1157-W1160 PolarHBondContact O-N 3.36Å; V1157-V1161 HydrophobicContact CG1-CG2 4.34Å; V1157-V1161 WeakPolarHBondContact O-CB 3.15Å; V1157-V1161 WeakPolarHBondContact O-CG2 3.39Å; V1157-V1161 PolarHBondContact O-N 3.18Å; V1157-L1179 HydrophobicContact CG2-CD1 3.67Å; V1157-N1187 HydrophobicContact CG1-CB 4.49Å; V1157-N1187 HydrophobicContact CG2-CB 4.03Å; V1157-M1188 HydrophobicContact CG1-CB 4.12Å
1158	G	83.6	Confident	82.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-41.4	171.1	0	0	0	0	0	113.4	S1123 V1154 P1155 K1156 V1161 Y1162	S1123-G1158 WeakPolarHBondContact O-CA 3.13Å; V1154-G1158 PolarHBondContact O-N 2.98Å; P1155-G1158 PolarHBondContact O-N 2.75Å; K1156-G1158 VanDerWaalsContact C-N 3.27Å; K1156-G1158 PolarHBondContact O-N 3.27Å; G1158-V1161 PolarHBondContact O-N 3.45Å; G1158-Y1162 VanDerWaalsContact O-CB 3.32Å; G1158-Y1162 WeakPolarHBondContact O-CB 3.31Å; G1158-Y1162 PolarHBondContact O-N 2.96Å
1159	L	86.5	Confident	82.7	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-42.8	169.5	-80.5	161.2	0	0	0	111.6	L1130 E1137 V1140 K1141 S1144 P1155 K1156 Y1162 Y1163 I1175	L1130-L1159 HydrophobicContact CD1-CD2 3.54Å; L1130-L1159 HydrophobicContact CD1-CG 4.25Å; E1137-L1159 HydrophobicContact CG-CD2 4.49Å; V1140-L1159 HydrophobicContact CG1-CD1 4.3Å; V1140-L1159 HydrophobicContact CG1-CD2 4.21Å; V1140-L1159 HydrophobicContact CG1-CG 4.03Å; K1141-L1159 HydrophobicContact CG-CD1 4.15Å; K1141-L1159 HydrophobicContact CG-CD2 4.31Å; S1144-L1159 WeakPolarHBondContact OG-CD1 3.11Å; P1155-L1159 PolarHBondContact O-N 3.2Å; K1156-L1159 HydrophobicContact CD-CD1 4.24Å; K1156-L1159 WeakPolarHBondContact O-CB 3.39Å; K1156-L1159 PolarHBondContact O-N 3.27Å; L1159-Y1162 WeakPolarHBondContact O-CB 3.42Å; L1159-Y1162 PolarHBondContact O-N 3.09Å; L1159-Y1163 HydrophobicContact CB-CE2 4.25Å; L1159-Y1163 HydrophobicContact CD2-CE1 4.48Å; L1159-Y1163 HydrophobicContact CD2-CE2 4.36Å; L1159-Y1163 WeakPolarHBondContact O-CB 3.38Å; L1159-Y1163 VanDerWaalsContact O-CD2 3.28Å; L1159-Y1163 WeakPolarHBondContact O-CD2 3.45Å; L1159-Y1163 PolarHBondContact O-N 3.33Å; L1159-I1175 HydrophobicContact CB-CD1 3.7Å
1160	W	87.7	Confident	82.6	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.027	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-47.9	173.9	-175.7	91.1	0	0	0	111.9	K1156 V1157 Y1162 Y1163 V1164 A1172 I1175 L1184 M1188 L1193 L1212	K1156-W1160 PolarHBondContact O-N 2.63Å; V1157-W1160 WeakPolarHBondContact O-CB 3.26Å; V1157-W1160 PolarHBondContact O-N 3.36Å; W1160-Y1162 VanDerWaalsContact C-N 3.26Å; W1160-Y1162 PolarHBondContact O-N 3.47Å; W1160-Y1163 PolarHBondContact O-N 3.33Å; W1160-Y1163 VanDerWaalsContact O-N 3.16Å; W1160-V1164 HydrophobicContact CD2-CG2 3.64Å; W1160-V1164 VanDerWaalsContact CE2-CG2 3.42Å; W1160-V1164 HydrophobicContact CE3-CB 4.35Å; W1160-V1164 HydrophobicContact CE3-CG2 3.89Å; W1160-V1164 HydrophobicContact CG-CG2 4.32Å; W1160-V1164 HydrophobicContact CH2-CB 4.45Å; W1160-V1164 HydrophobicContact CH2-CG1 4.27Å; W1160-V1164 HydrophobicContact CH2-CG2 3.79Å; W1160-V1164 HydrophobicContact CZ2-CG2 3.55Å; W1160-V1164 HydrophobicContact CZ3-CB 4.29Å; W1160-V1164 HydrophobicContact CZ3-CG1 4.3Å; W1160-V1164 HydrophobicContact CZ3-CG2 3.95Å; W1160-V1164 VanDerWaalsContact O-CB 3.31Å; W1160-V1164 WeakPolarHBondContact O-CB 3.49Å; W1160-V1164 WeakPolarHBondContact O-CG2 3.49Å; W1160-V1164 PolarHBondContact O-N 3.3Å; W1160-A1172 PolarHBondContact NE1-O 2.84Å; W1160-I1175 HydrophobicContact CB-CB 4.41Å; W1160-I1175 HydrophobicContact CB-CG2 3.85Å; W1160-I1175 HydrophobicContact CG-CG2 4.43Å; W1160-L1184 HydrophobicContact CD2-CD1 3.71Å; W1160-L1184 HydrophobicContact CD2-CD2 3.81Å; W1160-L1184 HydrophobicContact CD2-CG 4.05Å; W1160-L1184 HydrophobicContact CE3-CD1 4.45Å; W1160-L1184 HydrophobicContact CE3-CD2 3.7Å; W1160-L1184 HydrophobicContact CE3-CG 4.32Å; W1160-L1184 HydrophobicContact CG-CD1 3.73Å; W1160-L1184 HydrophobicContact CG-CG 4.29Å; W1160-L1184 HydrophobicContact CH2-CD2 3.78Å; W1160-L1184 HydrophobicContact CZ2-CD1 4.12Å; W1160-L1184 HydrophobicContact CZ2-CD2 3.86Å; W1160-L1184 HydrophobicContact CZ3-CD2 3.71Å; W1160-M1188 HydrophobicContact CE3-SD 4.45Å; W1160-M1188 HydrophobicContact CH2-SD 4.15Å; W1160-M1188 HydrophobicContact CZ3-SD 3.56Å; W1160-M1188 VanDerWaalsContact CZ3-SD 3.56Å; W1160-L1193 HydrophobicContact CZ3-CD1 3.96Å; W1160-L1212 HydrophobicContact CH2-CD1 3.63Å; W1160-L1212 HydrophobicContact CZ2-CD1 3.88Å
1161	V	82.7	Confident	83	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-56.7	-42.1	176	167.8	0	0	0	0	110.4	A1127 V1157 G1158 A1165 M1188 Y1192 L1193	A1127-V1161 HydrophobicContact CB-CB 3.95Å; A1127-V1161 HydrophobicContact CB-CG1 3.36Å; V1157-V1161 HydrophobicContact CG1-CG2 4.34Å; V1157-V1161 WeakPolarHBondContact O-CB 3.15Å; V1157-V1161 WeakPolarHBondContact O-CG2 3.39Å; V1157-V1161 PolarHBondContact O-N 3.18Å; G1158-V1161 PolarHBondContact O-N 3.45Å; V1161-A1165 WeakPolarHBondContact O-CB 3.38Å; V1161-A1165 PolarHBondContact O-N 2.72Å; V1161-M1188 HydrophobicContact CG2-CG 4.25Å; V1161-Y1192 HydrophobicContact CG1-CD1 3.54Å; V1161-Y1192 HydrophobicContact CG1-CE1 3.72Å; V1161-L1193 HydrophobicContact CG1-CD1 4.32Å; V1161-L1193 HydrophobicContact CG1-CD2 3.83Å; V1161-L1193 HydrophobicContact CG1-CG 3.76Å; V1161-L1193 HydrophobicContact CG2-CD1 3.97Å; V1161-L1193 HydrophobicContact CG2-CG 4.29Å
1162	Y	84.9	Confident	83.2	Confident	5 Å²	5	32.3 Å²	32.3	2%	0.02	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-46.4	175.2	173.6	-107.8	0	0	0	112.6	L1130 G1158 L1159 W1160 A1165 K1166	L1130-Y1162 VanDerWaalsContact C-CE2 3.42Å; L1130-Y1162 HydrophobicContact CB-CD1 4.07Å; L1130-Y1162 HydrophobicContact CB-CD2 3.38Å; L1130-Y1162 HydrophobicContact CB-CE1 4.18Å; L1130-Y1162 HydrophobicContact CB-CE2 3.52Å; L1130-Y1162 HydrophobicContact CB-CG 3.68Å; L1130-Y1162 HydrophobicContact CD1-CD1 3.8Å; L1130-Y1162 HydrophobicContact CD1-CD2 4.42Å; L1130-Y1162 HydrophobicContact CD1-CE1 4.36Å; L1130-Y1162 HydrophobicContact CD1-CG 3.84Å; L1130-Y1162 HydrophobicContact CG-CG 4.44Å; L1130-Y1162 WeakPolarHBondContact O-CE2 3.3Å; G1158-Y1162 VanDerWaalsContact O-CB 3.32Å; G1158-Y1162 WeakPolarHBondContact O-CB 3.31Å; G1158-Y1162 PolarHBondContact O-N 2.96Å; L1159-Y1162 WeakPolarHBondContact O-CB 3.42Å; L1159-Y1162 PolarHBondContact O-N 3.09Å; W1160-Y1162 VanDerWaalsContact C-N 3.26Å; W1160-Y1162 PolarHBondContact O-N 3.47Å; Y1162-A1165 PolarHBondContact O-N 2.66Å; Y1162-K1166 HydrophobicContact CD2-CG 4.08Å; Y1162-K1166 HydrophobicContact CE1-CG 4.3Å; Y1162-K1166 HydrophobicContact CE2-CD 4.12Å; Y1162-K1166 HydrophobicContact CE2-CG 3.67Å; Y1162-K1166 WeakPolarHBondContact O-CB 3.46Å; Y1162-K1166 WeakPolarHBondContact O-CG 3.41Å; Y1162-K1166 PolarHBondContact O-N 2.93Å
1163	Y	85.9	Confident	83.2	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-39.3	178.9	-65.8	-27.3	0	0	0	112.6	E1137 K1141 L1159 W1160 K1166 G1167 R1168 E1171 I1175	E1137-Y1163 PolarHBondContact OE1-OH 2.87Å; K1141-Y1163 WeakPolarHBondContact CE-OH 3.42Å; L1159-Y1163 HydrophobicContact CB-CE2 4.25Å; L1159-Y1163 HydrophobicContact CD2-CE1 4.48Å; L1159-Y1163 HydrophobicContact CD2-CE2 4.36Å; L1159-Y1163 WeakPolarHBondContact O-CB 3.38Å; L1159-Y1163 VanDerWaalsContact O-CD2 3.28Å; L1159-Y1163 WeakPolarHBondContact O-CD2 3.45Å; L1159-Y1163 PolarHBondContact O-N 3.33Å; W1160-Y1163 PolarHBondContact O-N 3.33Å; W1160-Y1163 VanDerWaalsContact O-N 3.16Å; Y1163-K1166 PolarHBondContact O-N 2.99Å; Y1163-G1167 CarbonylContact O-C 3.55Å; Y1163-G1167 WeakPolarHBondContact O-CA 3.37Å; Y1163-G1167 PolarHBondContact O-N 3.48Å; Y1163-R1168 HydrophobicContact CD1-CB 4.39Å; Y1163-R1168 HydrophobicContact CG-CB 4.47Å; Y1163-R1168 PolarHBondContact O-N 3.19Å; Y1163-E1171 WeakPolarHBondContact CD1-OE2 3.38Å; Y1163-E1171 HydrophobicContact CD2-CB 3.56Å; Y1163-E1171 WeakPolarHBondContact CE1-OE2 3.3Å; Y1163-E1171 HydrophobicContact CE2-CB 3.68Å; Y1163-E1171 HydrophobicContact CG-CB 4.01Å; Y1163-I1175 HydrophobicContact CD2-CD1 3.79Å; Y1163-I1175 HydrophobicContact CE2-CD1 3.64Å
1164	V	81	Confident	83.2	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.109	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-46.5	172	166.8	0	0	0	0	110.8	W1160 K1166 G1167 A1172 L1193 L1205	W1160-V1164 HydrophobicContact CD2-CG2 3.64Å; W1160-V1164 VanDerWaalsContact CE2-CG2 3.42Å; W1160-V1164 HydrophobicContact CE3-CB 4.35Å; W1160-V1164 HydrophobicContact CE3-CG2 3.89Å; W1160-V1164 HydrophobicContact CG-CG2 4.32Å; W1160-V1164 HydrophobicContact CH2-CB 4.45Å; W1160-V1164 HydrophobicContact CH2-CG1 4.27Å; W1160-V1164 HydrophobicContact CH2-CG2 3.79Å; W1160-V1164 HydrophobicContact CZ2-CG2 3.55Å; W1160-V1164 HydrophobicContact CZ3-CB 4.29Å; W1160-V1164 HydrophobicContact CZ3-CG1 4.3Å; W1160-V1164 HydrophobicContact CZ3-CG2 3.95Å; W1160-V1164 VanDerWaalsContact O-CB 3.31Å; W1160-V1164 WeakPolarHBondContact O-CB 3.49Å; W1160-V1164 WeakPolarHBondContact O-CG2 3.49Å; W1160-V1164 PolarHBondContact O-N 3.3Å; V1164-K1166 VanDerWaalsContact C-N 3.32Å; V1164-K1166 PolarHBondContact O-N 3.17Å; V1164-G1167 PolarHBondContact O-N 2.89Å; V1164-A1172 HydrophobicContact CG2-CB 3.84Å; V1164-L1193 HydrophobicContact CG1-CD2 4.15Å; V1164-L1205 HydrophobicContact CG1-CD1 3.45Å; V1164-L1205 VanDerWaalsContact CG1-CD1 3.45Å; V1164-L1205 HydrophobicContact CG1-CG 4.3Å
1165	A	77.8	Confident	83.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-37.9	174.8	0	0	0	0	0	112.7	V1161 Y1162 R1200 R1202	V1161-A1165 WeakPolarHBondContact O-CB 3.38Å; V1161-A1165 PolarHBondContact O-N 2.72Å; Y1162-A1165 PolarHBondContact O-N 2.66Å; A1165-R1200 PolarHBondContact O-NH1 3.34Å; A1165-R1202 PolarHBondContact O-NH1 3.33Å; A1165-R1202 VanDerWaalsContact O-NH1 3.12Å
1166	K	80.4	Confident	83.1	Confident	79 Å²	79	38.9 Å²	38.9	34%	0.343	20%	0.201	S	C	.	.	H	α-helix	trans	-79.6	-27	177.6	-69.9	-72.9	-174.5	-174.3	0	113.1	Y1162 Y1163 V1164 R1202	Y1162-K1166 HydrophobicContact CD2-CG 4.08Å; Y1162-K1166 HydrophobicContact CE1-CG 4.3Å; Y1162-K1166 HydrophobicContact CE2-CD 4.12Å; Y1162-K1166 HydrophobicContact CE2-CG 3.67Å; Y1162-K1166 WeakPolarHBondContact O-CB 3.46Å; Y1162-K1166 WeakPolarHBondContact O-CG 3.41Å; Y1162-K1166 PolarHBondContact O-N 2.93Å; Y1163-K1166 PolarHBondContact O-N 2.99Å; V1164-K1166 VanDerWaalsContact C-N 3.32Å; V1164-K1166 PolarHBondContact O-N 3.17Å; K1166-R1202 PolarHBondContact O-NH1 2.98Å; K1166-R1202 PolarHBondContact O-NH2 3.19Å
1167	G	78.2	Confident	83	Confident	41 Å²	41	43.7 Å²	43.7	42%	0.423	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	30	-176.4	0	0	0	0	0	114.8	Y1163 V1164 E1169	Y1163-G1167 CarbonylContact O-C 3.55Å; Y1163-G1167 WeakPolarHBondContact O-CA 3.37Å; Y1163-G1167 PolarHBondContact O-N 3.48Å; V1164-G1167 PolarHBondContact O-N 2.89Å; G1167-E1169 PolarHBondContact O-N 3.05Å
1168	R	84.2	Confident	82.9	Confident	87 Å²	87	48.7 Å²	48.7	33%	0.328	26%	0.255	S	S	.	.			trans	-92.7	79.9	175.6	-63.9	-168.6	-168.9	165.9	6.4	110.5	E1137 Y1163 E1170 E1171 A1172	E1137-R1168 IonicContact OE1-CZ 3.91Å; E1137-R1168 IonicContact OE1-NH1 3.64Å; E1137-R1168 PolarHBondContact OE1-NH1 2.99Å; E1137-R1168 IonicContact OE2-CZ 3.91Å; E1137-R1168 VanDerWaalsContact OE2-CZ 3.26Å; E1137-R1168 IonicContact OE2-NH1 2.93Å; E1137-R1168 PolarHBondContact OE2-NH1 3.19Å; E1137-R1168 IonicContact OE2-NH2 3.88Å; E1137-R1168 PolarHBondContact OE2-NH2 3.49Å; Y1163-R1168 HydrophobicContact CD1-CB 4.39Å; Y1163-R1168 HydrophobicContact CG-CB 4.47Å; Y1163-R1168 PolarHBondContact O-N 3.19Å; R1168-E1170 PolarHBondContact O-N 2.93Å; R1168-E1171 HydrophobicContact CB-CB 4.32Å; R1168-E1171 WeakPolarHBondContact CD-OE2 3.36Å; R1168-E1171 IonicContact CZ-OE2 2.78Å; R1168-E1171 IonicContact NE-OE2 3.26Å; R1168-E1171 IonicContact NH1-OE1 3.8Å; R1168-E1171 PolarHBondContact NH1-OE1 3.43Å; R1168-E1171 IonicContact NH1-OE2 2.77Å; R1168-E1171 PolarHBondContact NH1-OE2 2.91Å; R1168-E1171 PolarHBondContact O-N 3.04Å; R1168-A1172 WeakPolarHBondContact O-CB 3.34Å; R1168-A1172 PolarHBondContact O-N 2.98Å
1169	E	79	Confident	82.8	Confident	128 Å²	128	49.7 Å²	49.7	60%	0.598	26%	0.26	S	S	*	.	H	α-helix	trans	-65.1	-37.4	-171.2	-64.6	-170.6	171.5	0	0	114.1	G1167 E1171 A1172 N1173	G1167-E1169 PolarHBondContact O-N 3.05Å; E1169-E1171 PolarHBondContact O-N 2.85Å; E1169-A1172 PolarHBondContact O-N 3.37Å; E1169-N1173 WeakPolarHBondContact O-CB 3.38Å; E1169-N1173 PolarHBondContact O-N 2.96Å; E1169-N1173 PolarHBondContact O-ND2 2.81Å; E1169-N1173 VanDerWaalsContact O-ND2 3.08Å
1170	E	80.1	Confident	82.6	Confident	174 Å²	174	51 Å²	51	81%	0.813	27%	0.274	S	S	*	.	H	α-helix	trans	-62.1	-45.1	177.9	-64.8	-175.3	168.9	0	0	111.9	R1168 N1173 A1174	R1168-E1170 PolarHBondContact O-N 2.93Å; E1170-N1173 PolarHBondContact O-N 2.96Å; E1170-A1174 WeakPolarHBondContact O-CB 3.47Å; E1170-A1174 PolarHBondContact O-N 3.07Å
1171	E	84.6	Confident	82.2	Confident	70 Å²	70	53.5 Å²	53.5	33%	0.327	29%	0.286	S	S	.	.	H	α-helix	trans	-69.5	-39.4	178.1	-61.5	177.2	-177.9	0	0	111.4	Y1163 R1168 E1169 A1174 I1175	Y1163-E1171 WeakPolarHBondContact CD1-OE2 3.38Å; Y1163-E1171 HydrophobicContact CD2-CB 3.56Å; Y1163-E1171 WeakPolarHBondContact CE1-OE2 3.3Å; Y1163-E1171 HydrophobicContact CE2-CB 3.68Å; Y1163-E1171 HydrophobicContact CG-CB 4.01Å; R1168-E1171 HydrophobicContact CB-CB 4.32Å; R1168-E1171 WeakPolarHBondContact CD-OE2 3.36Å; R1168-E1171 IonicContact CZ-OE2 2.78Å; R1168-E1171 IonicContact NE-OE2 3.26Å; R1168-E1171 IonicContact NH1-OE1 3.8Å; R1168-E1171 PolarHBondContact NH1-OE1 3.43Å; R1168-E1171 IonicContact NH1-OE2 2.77Å; R1168-E1171 PolarHBondContact NH1-OE2 2.91Å; R1168-E1171 PolarHBondContact O-N 3.04Å; E1169-E1171 PolarHBondContact O-N 2.85Å; E1171-A1174 PolarHBondContact O-N 3Å; E1171-I1175 WeakPolarHBondContact O-CG1 3.15Å; E1171-I1175 PolarHBondContact O-N 3.11Å
1172	A	82.5	Confident	81.8	Confident	5 Å²	5	57 Å²	57	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-42.3	173.6	0	0	0	0	0	112	W1160 V1164 R1168 E1169 I1175 M1176	W1160-A1172 PolarHBondContact NE1-O 2.84Å; V1164-A1172 HydrophobicContact CG2-CB 3.84Å; R1168-A1172 WeakPolarHBondContact O-CB 3.34Å; R1168-A1172 PolarHBondContact O-N 2.98Å; E1169-A1172 PolarHBondContact O-N 3.37Å; A1172-I1175 PolarHBondContact O-N 3.29Å; A1172-M1176 VanDerWaalsContact O-CB 3.28Å; A1172-M1176 WeakPolarHBondContact O-CB 3.26Å; A1172-M1176 PolarHBondContact O-N 3.24Å
1173	N	83	Confident	81.4	Confident	79 Å²	79	58.3 Å²	58.3	42%	0.422	31%	0.313	S	S	.	.	H	α-helix	trans	-70.2	-35.2	177.6	-72.8	-32.1	0	0	0	112.1	E1169 E1170 M1176 T1177	E1169-N1173 WeakPolarHBondContact O-CB 3.38Å; E1169-N1173 PolarHBondContact O-N 2.96Å; E1169-N1173 PolarHBondContact O-ND2 2.81Å; E1169-N1173 VanDerWaalsContact O-ND2 3.08Å; E1170-N1173 PolarHBondContact O-N 2.96Å; N1173-M1176 PolarHBondContact O-N 3.14Å; N1173-M1176 WeakPolarHBondContact OD1-CE 3.39Å; N1173-T1177 WeakPolarHBondContact O-CB 3.43Å; N1173-T1177 WeakPolarHBondContact O-CG2 3.22Å; N1173-T1177 PolarHBondContact O-N 2.98Å; N1173-T1177 PolarHBondContact O-OG1 3.43Å
1174	A	84.9	Confident	81.1	Confident	50 Å²	50	58 Å²	58	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-46.5	170.1	0	0	0	0	0	111.2	E1170 E1171 M1176 T1177 E1178	E1170-A1174 WeakPolarHBondContact O-CB 3.47Å; E1170-A1174 PolarHBondContact O-N 3.07Å; E1171-A1174 PolarHBondContact O-N 3Å; A1174-M1176 PolarHBondContact O-N 2.99Å; A1174-T1177 WeakPolarHBondContact CA-OG1 3.41Å; A1174-T1177 PolarHBondContact O-N 2.72Å; A1174-T1177 PolarHBondContact O-OG1 3.07Å; A1174-E1178 VanDerWaalsContact O-CB 3.24Å; A1174-E1178 WeakPolarHBondContact O-CB 3.45Å; A1174-E1178 PolarHBondContact O-N 2.73Å
1175	I	84.8	Confident	80.7	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-36.2	175.3	-64.9	-174.8	0	0	0	111.9	K1156 L1159 W1160 Y1163 E1171 A1172 E1178 L1179	K1156-I1175 HydrophobicContact CD-CD1 4.19Å; K1156-I1175 HydrophobicContact CG-CD1 4.38Å; K1156-I1175 HydrophobicContact CG-CG2 3.87Å; L1159-I1175 HydrophobicContact CB-CD1 3.7Å; W1160-I1175 HydrophobicContact CB-CB 4.41Å; W1160-I1175 HydrophobicContact CB-CG2 3.85Å; W1160-I1175 HydrophobicContact CG-CG2 4.43Å; Y1163-I1175 HydrophobicContact CD2-CD1 3.79Å; Y1163-I1175 HydrophobicContact CE2-CD1 3.64Å; E1171-I1175 WeakPolarHBondContact O-CG1 3.15Å; E1171-I1175 PolarHBondContact O-N 3.11Å; A1172-I1175 PolarHBondContact O-N 3.29Å; I1175-E1178 PolarHBondContact O-N 3.14Å; I1175-L1179 HydrophobicContact CG2-CD1 3.5Å; I1175-L1179 HydrophobicContact CG2-CG 3.96Å; I1175-L1179 WeakPolarHBondContact O-CB 3.44Å; I1175-L1179 WeakPolarHBondContact O-CG 3.2Å; I1175-L1179 PolarHBondContact O-N 3.42Å
1176	M	82.6	Confident	80.5	Confident	38 Å²	38	58.8 Å²	58.8	19%	0.187	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-33.7	178.4	-170.8	168.4	73.7	0	0	112.3	A1172 N1173 A1174 G1180 E1181 L1184	A1172-M1176 VanDerWaalsContact O-CB 3.28Å; A1172-M1176 WeakPolarHBondContact O-CB 3.26Å; A1172-M1176 PolarHBondContact O-N 3.24Å; N1173-M1176 PolarHBondContact O-N 3.14Å; N1173-M1176 WeakPolarHBondContact OD1-CE 3.39Å; A1174-M1176 PolarHBondContact O-N 2.99Å; M1176-G1180 VanDerWaalsContact O-CA 3.23Å; M1176-G1180 WeakPolarHBondContact O-CA 3.23Å; M1176-G1180 PolarHBondContact O-N 2.88Å; M1176-E1181 HydrophobicContact CG-CG 3.98Å; M1176-E1181 HydrophobicContact SD-CG 4.08Å; M1176-L1184 HydrophobicContact CB-CD1 4.03Å; M1176-L1184 HydrophobicContact CG-CD1 3.94Å
1177	T	83.6	Confident	80	Confident	120 Å²	120	57.3 Å²	57.3	74%	0.736	31%	0.31	S	S	*	.	H	α-helix	trans	-78.1	-27.6	172.1	46.4	0	0	0	0	113	N1173 A1174	N1173-T1177 WeakPolarHBondContact O-CB 3.43Å; N1173-T1177 WeakPolarHBondContact O-CG2 3.22Å; N1173-T1177 PolarHBondContact O-N 2.98Å; N1173-T1177 PolarHBondContact O-OG1 3.43Å; A1174-T1177 WeakPolarHBondContact CA-OG1 3.41Å; A1174-T1177 PolarHBondContact O-N 2.72Å; A1174-T1177 PolarHBondContact O-OG1 3.07Å
1178	E	83.9	Confident	79.7	Confident	105 Å²	105	55.5 Å²	55.5	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-74.8	-40	174.3	-173.6	-176.7	164.6	0	0	112.8	M1148 K1156 A1174 I1175	M1148-E1178 WeakPolarHBondContact CE-OE1 3.44Å; K1156-E1178 VanDerWaalsContact CE-OE2 3.24Å; K1156-E1178 WeakPolarHBondContact CE-OE2 3.25Å; K1156-E1178 IonicContact NZ-OE1 3.67Å; K1156-E1178 PolarHBondContact NZ-OE1 3.28Å; K1156-E1178 IonicContact NZ-OE2 2.72Å; K1156-E1178 PolarHBondContact NZ-OE2 2.77Å; A1174-E1178 VanDerWaalsContact O-CB 3.24Å; A1174-E1178 WeakPolarHBondContact O-CB 3.45Å; A1174-E1178 PolarHBondContact O-N 2.73Å; I1175-E1178 PolarHBondContact O-N 3.14Å
1179	L	80.4	Confident	78.8	Confident	21 Å²	21	55.6 Å²	55.6	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-93.4	-33.2	-178.3	-65.7	179.3	0	0	0	113.9	M1148 V1153 K1156 V1157 I1175 V1183	M1148-L1179 HydrophobicContact SD-CD2 3.76Å; V1153-L1179 HydrophobicContact CB-CD2 4.32Å; V1153-L1179 HydrophobicContact CG1-CD2 4.15Å; K1156-L1179 HydrophobicContact CB-CD1 4.14Å; K1156-L1179 HydrophobicContact CB-CD2 4.37Å; K1156-L1179 HydrophobicContact CG-CD1 3.95Å; K1156-L1179 HydrophobicContact CG-CD2 4.16Å; K1156-L1179 HydrophobicContact CG-CG 4.23Å; V1157-L1179 HydrophobicContact CG2-CD1 3.67Å; I1175-L1179 HydrophobicContact CG2-CD1 3.5Å; I1175-L1179 HydrophobicContact CG2-CG 3.96Å; I1175-L1179 WeakPolarHBondContact O-CB 3.44Å; I1175-L1179 WeakPolarHBondContact O-CG 3.2Å; I1175-L1179 PolarHBondContact O-N 3.42Å; L1179-V1183 HydrophobicContact CB-CB 4.49Å; L1179-V1183 HydrophobicContact CB-CG1 4.5Å; L1179-V1183 VanDerWaalsContact O-CB 3.3Å; L1179-V1183 WeakPolarHBondContact O-CB 3.49Å; L1179-V1183 VanDerWaalsContact O-CG2 3.22Å; L1179-V1183 WeakPolarHBondContact O-CG2 3.18Å
1180	G	82	Confident	78.3	Confident	29 Å²	29	50.6 Å²	50.6	30%	0.299	27%	0.267	S	S	.	.			trans	83.3	143.8	-166.1	0	0	0	0	0	113.1	M1176 D1182 V1183 L1184	M1176-G1180 VanDerWaalsContact O-CA 3.23Å; M1176-G1180 WeakPolarHBondContact O-CA 3.23Å; M1176-G1180 PolarHBondContact O-N 2.88Å; G1180-D1182 VanDerWaalsContact C-N 3.27Å; G1180-D1182 PolarHBondContact O-N 3.41Å; G1180-V1183 PolarHBondContact O-N 3.33Å; G1180-L1184 WeakPolarHBondContact O-CB 3.43Å; G1180-L1184 PolarHBondContact O-N 2.81Å; G1180-L1184 VanDerWaalsContact O-N 3.17Å
1181	E	79.1	Confident	77.7	Confident	59 Å²	59	44.3 Å²	44.3	28%	0.276	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-36.6	-177.6	-60.5	-171.7	179.2	0	0	112.5	M1176 L1184 T1185 R1215 H1216	M1176-E1181 HydrophobicContact CG-CG 3.98Å; M1176-E1181 HydrophobicContact SD-CG 4.08Å; E1181-L1184 PolarHBondContact O-N 3.29Å; E1181-T1185 WeakPolarHBondContact O-CB 3.25Å; E1181-T1185 WeakPolarHBondContact O-CG2 3.18Å; E1181-T1185 PolarHBondContact O-N 3.08Å; E1181-T1185 PolarHBondContact O-OG1 3.46Å; E1181-R1215 IonicContact OE1-NH1 3.52Å; E1181-R1215 IonicContact OE2-NH1 3.07Å; E1181-H1216 WeakPolarHBondContact CB-NE2 3.46Å; E1181-H1216 IonicContact OE2-CD2 2.73Å; E1181-H1216 IonicContact OE2-CE1 2.69Å; E1181-H1216 IonicContact OE2-NE2 3.67Å; E1181-H1216 PolarHBondContact OE2-NE2 2.9Å
1182	D	74.4	Confident	76.8	Confident	75 Å²	75	41.6 Å²	41.6	40%	0.401	23%	0.225	S	C	.	.	H	α-helix	trans	-55.7	-56	174.1	-86.9	63.6	0	0	0	113.5	G1180 L1184 T1185 K1186 H1216	G1180-D1182 VanDerWaalsContact C-N 3.27Å; G1180-D1182 PolarHBondContact O-N 3.41Å; D1182-L1184 PolarHBondContact O-N 2.96Å; D1182-T1185 PolarHBondContact O-N 2.9Å; D1182-T1185 PolarHBondContact O-OG1 2.88Å; D1182-T1185 VanDerWaalsContact O-OG1 3.08Å; D1182-K1186 WeakPolarHBondContact O-CB 3.39Å; D1182-K1186 WeakPolarHBondContact O-CD 3.16Å; D1182-K1186 VanDerWaalsContact O-CG 3.23Å; D1182-K1186 WeakPolarHBondContact O-CG 3.46Å; D1182-K1186 PolarHBondContact O-N 3.36Å; D1182-K1186 VanDerWaalsContact O-N 3.08Å; D1182-K1186 IonicContact OD2-NZ 3.49Å; D1182-K1186 PolarHBondContact OD2-NZ 3.38Å; D1182-H1216 IonicContact OD1-CE1 3.78Å; D1182-H1216 IonicContact OD1-ND1 2.77Å
1183	V	77.3	Confident	76.2	Confident	32 Å²	32	41.3 Å²	41.3	19%	0.194	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-37.7	-176.7	176.8	0	0	0	0	109.8	V1153 L1179 G1180 N1187	V1153-V1183 HydrophobicContact CB-CG1 4.16Å; V1153-V1183 HydrophobicContact CG1-CG1 4.03Å; V1153-V1183 HydrophobicContact CG2-CG1 3.86Å; L1179-V1183 HydrophobicContact CB-CB 4.49Å; L1179-V1183 HydrophobicContact CB-CG1 4.5Å; L1179-V1183 VanDerWaalsContact O-CB 3.3Å; L1179-V1183 WeakPolarHBondContact O-CB 3.49Å; L1179-V1183 VanDerWaalsContact O-CG2 3.22Å; L1179-V1183 WeakPolarHBondContact O-CG2 3.18Å; G1180-V1183 PolarHBondContact O-N 3.33Å; V1183-N1187 WeakPolarHBondContact O-CB 3.35Å; V1183-N1187 PolarHBondContact O-N 2.78Å; V1183-N1187 PolarHBondContact O-ND2 3.25Å
1184	L	78.9	Confident	75.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-52.2	179.7	-166.8	161.7	0	0	0	111.5	W1160 M1176 G1180 E1181 D1182 N1187 M1188	W1160-L1184 HydrophobicContact CD2-CD1 3.71Å; W1160-L1184 HydrophobicContact CD2-CD2 3.81Å; W1160-L1184 HydrophobicContact CD2-CG 4.05Å; W1160-L1184 HydrophobicContact CE3-CD1 4.45Å; W1160-L1184 HydrophobicContact CE3-CD2 3.7Å; W1160-L1184 HydrophobicContact CE3-CG 4.32Å; W1160-L1184 HydrophobicContact CG-CD1 3.73Å; W1160-L1184 HydrophobicContact CG-CG 4.29Å; W1160-L1184 HydrophobicContact CH2-CD2 3.78Å; W1160-L1184 HydrophobicContact CZ2-CD1 4.12Å; W1160-L1184 HydrophobicContact CZ2-CD2 3.86Å; W1160-L1184 HydrophobicContact CZ3-CD2 3.71Å; M1176-L1184 HydrophobicContact CB-CD1 4.03Å; M1176-L1184 HydrophobicContact CG-CD1 3.94Å; G1180-L1184 WeakPolarHBondContact O-CB 3.43Å; G1180-L1184 PolarHBondContact O-N 2.81Å; G1180-L1184 VanDerWaalsContact O-N 3.17Å; E1181-L1184 PolarHBondContact O-N 3.29Å; D1182-L1184 PolarHBondContact O-N 2.96Å; L1184-N1187 PolarHBondContact O-N 3.17Å; L1184-M1188 HydrophobicContact CD2-SD 4.31Å; L1184-M1188 WeakPolarHBondContact O-CB 3.41Å; L1184-M1188 PolarHBondContact O-N 2.78Å
1185	T	73.6	Confident	74.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-41.9	-179.9	48	0	0	0	0	112.5	E1181 D1182 N1187 M1188 L1212 H1216 Q1220	E1181-T1185 WeakPolarHBondContact O-CB 3.25Å; E1181-T1185 WeakPolarHBondContact O-CG2 3.18Å; E1181-T1185 PolarHBondContact O-N 3.08Å; E1181-T1185 PolarHBondContact O-OG1 3.46Å; D1182-T1185 PolarHBondContact O-N 2.9Å; D1182-T1185 PolarHBondContact O-OG1 2.88Å; D1182-T1185 VanDerWaalsContact O-OG1 3.08Å; T1185-N1187 VanDerWaalsContact C-N 3.29Å; T1185-N1187 PolarHBondContact O-N 3.47Å; T1185-M1188 PolarHBondContact O-N 3.46Å; T1185-L1212 HydrophobicContact CG2-CB 4.38Å; T1185-H1216 HydrophobicContact CG2-CB 3.84Å; T1185-H1216 VanDerWaalsContact OG1-CB 3.25Å; T1185-H1216 WeakPolarHBondContact OG1-CB 3.45Å; T1185-Q1220 PolarHBondContact O-OE1 3.08Å
1186	K	72.7	Confident	73.9	Confident	34 Å²	34	39.2 Å²	39.2	15%	0.148	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-35.1	177.3	-71.1	159.4	-171.7	156.5	0	113.5	P471 S472 D1182	P471-K1186 HydrophobicContact CB-CD 4.24Å; P471-K1186 HydrophobicContact CB-CG 4.27Å; P471-K1186 HydrophobicContact CG-CB 4.34Å; P471-K1186 HydrophobicContact CG-CD 3.88Å; P471-K1186 HydrophobicContact CG-CG 3.8Å; P471-K1186 WeakPolarHBondContact O-CE 3.42Å; S472-K1186 WeakPolarHBondContact OG-CD 3.29Å; S472-K1186 WeakPolarHBondContact OG-CE 3.44Å; S472-K1186 PolarHBondContact OG-NZ 3.48Å; D1182-K1186 WeakPolarHBondContact O-CB 3.39Å; D1182-K1186 WeakPolarHBondContact O-CD 3.16Å; D1182-K1186 VanDerWaalsContact O-CG 3.23Å; D1182-K1186 WeakPolarHBondContact O-CG 3.46Å; D1182-K1186 PolarHBondContact O-N 3.36Å; D1182-K1186 VanDerWaalsContact O-N 3.08Å; D1182-K1186 IonicContact OD2-NZ 3.49Å; D1182-K1186 PolarHBondContact OD2-NZ 3.38Å
1187	N	70.6	Confident	73.1	Confident	48 Å²	48	37.5 Å²	37.5	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-102.2	2.2	-175.3	-68.6	-82.4	0	0	0	113.8	S1123 V1153 V1157 V1183 L1184 T1185	S1123-N1187 PolarHBondContact OG-O 3.29Å; V1153-N1187 HydrophobicContact CG2-CB 4.17Å; V1157-N1187 HydrophobicContact CG1-CB 4.49Å; V1157-N1187 HydrophobicContact CG2-CB 4.03Å; V1183-N1187 WeakPolarHBondContact O-CB 3.35Å; V1183-N1187 PolarHBondContact O-N 2.78Å; V1183-N1187 PolarHBondContact O-ND2 3.25Å; L1184-N1187 PolarHBondContact O-N 3.17Å; T1185-N1187 VanDerWaalsContact C-N 3.29Å; T1185-N1187 PolarHBondContact O-N 3.47Å
1188	M	71.9	Confident	72.1	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.02	17%	0.165	C	C	.	.			trans	-87.3	108.7	-178.9	175.4	179.9	71.2	0	0	110.9	V1157 W1160 V1161 L1184 T1185 Y1190 L1193 I1209 L1213	V1157-M1188 HydrophobicContact CG1-CB 4.12Å; W1160-M1188 HydrophobicContact CE3-SD 4.45Å; W1160-M1188 HydrophobicContact CH2-SD 4.15Å; W1160-M1188 HydrophobicContact CZ3-SD 3.56Å; W1160-M1188 VanDerWaalsContact CZ3-SD 3.56Å; V1161-M1188 HydrophobicContact CG2-CG 4.25Å; L1184-M1188 HydrophobicContact CD2-SD 4.31Å; L1184-M1188 WeakPolarHBondContact O-CB 3.41Å; L1184-M1188 PolarHBondContact O-N 2.78Å; T1185-M1188 PolarHBondContact O-N 3.46Å; M1188-Y1190 VanDerWaalsContact C-N 3.29Å; M1188-Y1190 WeakPolarHBondContact O-CD1 3.22Å; M1188-Y1190 PolarHBondContact O-N 2.74Å; M1188-L1193 HydrophobicContact CG-CD1 3.8Å; M1188-L1193 HydrophobicContact SD-CD1 3.39Å; M1188-L1193 WeakPolarHBondContact SD-CD1 3.37Å; M1188-I1209 HydrophobicContact CE-CG2 4.4Å; M1188-L1213 HydrophobicContact CE-CD2 3.66Å; M1188-L1213 HydrophobicContact CE-CG 4.07Å
1189	R	65.9	Low	71.3	Confident	88 Å²	88	32.4 Å²	32.4	33%	0.332	17%	0.169	S	C	.	.			trans	-71.6	86.3	165.6	-65.5	-133.3	-169.9	165.2	-3.5	110.4	E436 S1122 S1123 M1191 Y1192	E436-R1189 IonicContact OE1-NH2 3.54Å; S1122-R1189 WeakPolarHBondContact OG-CD 3.26Å; S1122-R1189 WeakPolarHBondContact OG-CG 3.39Å; S1123-R1189 PolarHBondContact OG-N 3.5Å; R1189-M1191 PolarHBondContact O-N 3.44Å; R1189-M1191 VanDerWaalsContact O-N 3.08Å; R1189-Y1192 PolarHBondContact O-N 3.05Å
1190	Y	68.3	Low	70.6	Confident	23 Å²	23	34.5 Å²	34.5	9%	0.09	18%	0.175	C	C	.	.	H	α-helix	trans	-55.7	-23	-179.9	42.9	-91	0	0	0	114	M1188 Y1192 L1193 V1194 L1213 Q1220 S1223 A1224 Y1227	M1188-Y1190 VanDerWaalsContact C-N 3.29Å; M1188-Y1190 WeakPolarHBondContact O-CD1 3.22Å; M1188-Y1190 PolarHBondContact O-N 2.74Å; Y1190-Y1192 VanDerWaalsContact C-N 3.33Å; Y1190-Y1192 PolarHBondContact O-N 2.8Å; Y1190-L1193 PolarHBondContact O-N 3.38Å; Y1190-L1193 VanDerWaalsContact O-N 3.13Å; Y1190-V1194 WeakPolarHBondContact O-CB 3.41Å; Y1190-V1194 WeakPolarHBondContact O-CG2 3.26Å; Y1190-V1194 PolarHBondContact O-N 3.47Å; Y1190-L1213 HydrophobicContact CD1-CD1 4.42Å; Y1190-L1213 HydrophobicContact CD1-CD2 4.17Å; Y1190-L1213 HydrophobicContact CG-CD1 4.21Å; Y1190-Q1220 HydrophobicContact CD1-CB 4.25Å; Y1190-Q1220 HydrophobicContact CE1-CB 3.55Å; Y1190-Q1220 HydrophobicContact CE1-CG 3.68Å; Y1190-S1223 WeakPolarHBondContact OH-CB 3.45Å; Y1190-A1224 HydrophobicContact CD2-CB 3.6Å; Y1190-A1224 HydrophobicContact CE2-CB 4Å; Y1190-A1224 HydrophobicContact CG-CB 4.18Å; Y1190-Y1227 HydrophobicContact CE2-CD2 4.07Å; Y1190-Y1227 HydrophobicContact CE2-CE2 4.13Å
1191	M	66.5	Low	69.8	Low	43 Å²	43	39.5 Å²	39.5	21%	0.212	20%	0.195	C	C	.	.	H	α-helix	trans	-54.4	-45.1	176.4	-171.8	170.6	79.1	0	0	112.8	R1189 V1194 Q1195 L1290	R1189-M1191 PolarHBondContact O-N 3.44Å; R1189-M1191 VanDerWaalsContact O-N 3.08Å; M1191-V1194 PolarHBondContact O-N 3.27Å; M1191-Q1195 WeakPolarHBondContact O-CB 3.25Å; M1191-Q1195 VanDerWaalsContact O-CG 3.29Å; M1191-Q1195 WeakPolarHBondContact O-CG 3.21Å; M1191-Q1195 PolarHBondContact O-N 2.88Å; M1191-Q1195 PolarHBondContact O-OE1 3.22Å; M1191-L1290 HydrophobicContact CE-CD2 4.45Å; M1191-L1290 HydrophobicContact SD-CD1 4.14Å; M1191-L1290 HydrophobicContact SD-CD2 3.7Å
1192	Y	66.9	Low	69.3	Low	12 Å²	12	41 Å²	41	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-66.9	-40.7	177.2	172.8	-92	0	0	0	111.6	A1127 F1128 E1131 V1161 R1189 Y1190 V1194 Q1195 Q1196	A1127-Y1192 VanDerWaalsContact C-OH 3.25Å; A1127-Y1192 HydrophobicContact CB-CD1 3.94Å; A1127-Y1192 HydrophobicContact CB-CE1 3.29Å; A1127-Y1192 PolarHBondContact O-OH 3.3Å; F1128-Y1192 HydrophobicContact CB-CD2 4.42Å; F1128-Y1192 HydrophobicContact CB-CE2 3.74Å; F1128-Y1192 HydrophobicContact CD2-CE2 4.12Å; F1128-Y1192 HydrophobicContact CG-CE2 4.38Å; F1128-Y1192 PolarHBondContact N-OH 3.34Å; E1131-Y1192 PolarHBondContact OE2-OH 3.22Å; V1161-Y1192 HydrophobicContact CG1-CD1 3.54Å; V1161-Y1192 HydrophobicContact CG1-CE1 3.72Å; R1189-Y1192 PolarHBondContact O-N 3.05Å; Y1190-Y1192 VanDerWaalsContact C-N 3.33Å; Y1190-Y1192 PolarHBondContact O-N 2.8Å; Y1192-V1194 PolarHBondContact O-N 2.81Å; Y1192-Q1195 PolarHBondContact O-N 3.37Å; Y1192-Q1196 HydrophobicContact CD1-CG 4.02Å; Y1192-Q1196 HydrophobicContact CD2-CG 4.31Å; Y1192-Q1196 HydrophobicContact CE1-CG 3.54Å; Y1192-Q1196 HydrophobicContact CE2-CG 3.86Å; Y1192-Q1196 HydrophobicContact CG-CG 4.4Å; Y1192-Q1196 VanDerWaalsContact CZ-CG 3.46Å; Y1192-Q1196 VanDerWaalsContact O-CB 3.3Å; Y1192-Q1196 WeakPolarHBondContact O-CB 3.33Å; Y1192-Q1196 VanDerWaalsContact O-CG 3.29Å; Y1192-Q1196 WeakPolarHBondContact O-CG 3.42Å; Y1192-Q1196 PolarHBondContact O-N 3.03Å
1193	L	68.1	Low	69	Low	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-36.5	176	-85.1	172.5	0	0	0	113	W1160 V1161 V1164 M1188 Y1190 Q1196 A1197 I1209	W1160-L1193 HydrophobicContact CZ3-CD1 3.96Å; V1161-L1193 HydrophobicContact CG1-CD1 4.32Å; V1161-L1193 HydrophobicContact CG1-CD2 3.83Å; V1161-L1193 HydrophobicContact CG1-CG 3.76Å; V1161-L1193 HydrophobicContact CG2-CD1 3.97Å; V1161-L1193 HydrophobicContact CG2-CG 4.29Å; V1164-L1193 HydrophobicContact CG1-CD2 4.15Å; M1188-L1193 HydrophobicContact CG-CD1 3.8Å; M1188-L1193 HydrophobicContact SD-CD1 3.39Å; M1188-L1193 WeakPolarHBondContact SD-CD1 3.37Å; Y1190-L1193 PolarHBondContact O-N 3.38Å; Y1190-L1193 VanDerWaalsContact O-N 3.13Å; L1193-Q1196 PolarHBondContact O-N 2.91Å; L1193-A1197 WeakPolarHBondContact O-CB 3.29Å; L1193-A1197 PolarHBondContact O-N 3.04Å; L1193-I1209 HydrophobicContact CB-CD1 3.66Å; L1193-I1209 HydrophobicContact CB-CG1 4.38Å; L1193-I1209 HydrophobicContact CD1-CD1 4.38Å; L1193-I1209 HydrophobicContact CD1-CG1 4.26Å; L1193-I1209 HydrophobicContact CD2-CD1 4.48Å; L1193-I1209 HydrophobicContact CG-CD1 4.4Å
1194	V	68.4	Low	68.7	Low	1 Å²	1	45.4 Å²	45.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-44.1	174.5	165.1	0	0	0	0	110.5	Y1190 M1191 Y1192 R1198 I1228 L1231	Y1190-V1194 WeakPolarHBondContact O-CB 3.41Å; Y1190-V1194 WeakPolarHBondContact O-CG2 3.26Å; Y1190-V1194 PolarHBondContact O-N 3.47Å; M1191-V1194 PolarHBondContact O-N 3.27Å; Y1192-V1194 PolarHBondContact O-N 2.81Å; V1194-R1198 WeakPolarHBondContact O-CB 3.3Å; V1194-R1198 VanDerWaalsContact O-CG 3.32Å; V1194-R1198 WeakPolarHBondContact O-CG 3.37Å; V1194-R1198 PolarHBondContact O-N 3.42Å; V1194-R1198 VanDerWaalsContact O-N 3.16Å; V1194-I1228 HydrophobicContact CB-CG1 4.43Å; V1194-I1228 HydrophobicContact CG1-CG1 3.55Å; V1194-I1228 HydrophobicContact CG2-CD1 4.07Å; V1194-I1228 HydrophobicContact CG2-CG1 3.94Å; V1194-L1231 HydrophobicContact CG1-CD1 3.67Å
1195	Q	67.9	Low	68.3	Low	76 Å²	76	45.9 Å²	45.9	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-61.4	-43.5	173.4	-74.3	168	-27.7	0	0	111.3	M1191 Y1192 R1198 S1199 L1231	M1191-Q1195 WeakPolarHBondContact O-CB 3.25Å; M1191-Q1195 VanDerWaalsContact O-CG 3.29Å; M1191-Q1195 WeakPolarHBondContact O-CG 3.21Å; M1191-Q1195 PolarHBondContact O-N 2.88Å; M1191-Q1195 PolarHBondContact O-OE1 3.22Å; Y1192-Q1195 PolarHBondContact O-N 3.37Å; Q1195-R1198 PolarHBondContact O-N 3.35Å; Q1195-S1199 WeakPolarHBondContact O-CB 3.32Å; Q1195-S1199 PolarHBondContact O-N 2.94Å; Q1195-S1199 PolarHBondContact O-OG 2.8Å; Q1195-L1231 HydrophobicContact CG-CD1 4.47Å
1196	Q	68.2	Low	68.2	Low	16 Å²	16	46.7 Å²	46.7	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-70	-40.9	178.5	-78.2	-65.1	-32.3	0	0	114.1	E1131 Y1192 L1193 R1198 S1199 R1200	E1131-Q1196 VanDerWaalsContact CD-NE2 3.29Å; E1131-Q1196 PolarHBondContact OE1-NE2 3.18Å; E1131-Q1196 VanDerWaalsContact OE1-NE2 3.11Å; E1131-Q1196 PolarHBondContact OE1-OE1 2.85Å; E1131-Q1196 PolarHBondContact OE2-NE2 3Å; Y1192-Q1196 HydrophobicContact CD1-CG 4.02Å; Y1192-Q1196 HydrophobicContact CD2-CG 4.31Å; Y1192-Q1196 HydrophobicContact CE1-CG 3.54Å; Y1192-Q1196 HydrophobicContact CE2-CG 3.86Å; Y1192-Q1196 HydrophobicContact CG-CG 4.4Å; Y1192-Q1196 VanDerWaalsContact CZ-CG 3.46Å; Y1192-Q1196 VanDerWaalsContact O-CB 3.3Å; Y1192-Q1196 WeakPolarHBondContact O-CB 3.33Å; Y1192-Q1196 VanDerWaalsContact O-CG 3.29Å; Y1192-Q1196 WeakPolarHBondContact O-CG 3.42Å; Y1192-Q1196 PolarHBondContact O-N 3.03Å; L1193-Q1196 PolarHBondContact O-N 2.91Å; Q1196-R1198 PolarHBondContact O-N 2.92Å; Q1196-S1199 WeakPolarHBondContact CA-OG 3.39Å; Q1196-S1199 PolarHBondContact O-N 3.08Å; Q1196-S1199 PolarHBondContact O-OG 3.13Å; Q1196-R1200 VanDerWaalsContact O-CB 3.29Å; Q1196-R1200 WeakPolarHBondContact O-CB 3.29Å; Q1196-R1200 WeakPolarHBondContact O-CG 3.3Å; Q1196-R1200 PolarHBondContact O-N 3.33Å
1197	A	66.3	Low	68.3	Low	2 Å²	2	52.1 Å²	52.1	2%	0.017	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-31.9	174	0	0	0	0	0	111.1	L1193 N1201 R1202 L1205 V1206	L1193-A1197 WeakPolarHBondContact O-CB 3.29Å; L1193-A1197 PolarHBondContact O-N 3.04Å; A1197-N1201 WeakPolarHBondContact O-CA 3.43Å; A1197-N1201 PolarHBondContact O-N 2.95Å; A1197-R1202 PolarHBondContact O-N 2.81Å; A1197-L1205 HydrophobicContact CB-CB 4.01Å; A1197-L1205 HydrophobicContact CB-CD2 4.01Å; A1197-L1205 HydrophobicContact CB-CG 4.35Å; A1197-V1206 HydrophobicContact CB-CG2 3.48Å; A1197-V1206 VanDerWaalsContact CB-CG2 3.48Å
1198	R	62.9	Low	68.4	Low	34 Å²	34	54 Å²	54	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-83.8	-36.8	177.5	-73.3	174.7	167	-116.7	-31.5	114	V1194 Q1195 Q1196 I1228 L1231 D1232 S1240	V1194-R1198 WeakPolarHBondContact O-CB 3.3Å; V1194-R1198 VanDerWaalsContact O-CG 3.32Å; V1194-R1198 WeakPolarHBondContact O-CG 3.37Å; V1194-R1198 PolarHBondContact O-N 3.42Å; V1194-R1198 VanDerWaalsContact O-N 3.16Å; Q1195-R1198 PolarHBondContact O-N 3.35Å; Q1196-R1198 PolarHBondContact O-N 2.92Å; R1198-I1228 PolarHBondContact NH1-O 3.11Å; R1198-I1228 VanDerWaalsContact NH1-O 3.1Å; R1198-L1231 PolarHBondContact NH1-O 2.68Å; R1198-D1232 IonicContact CZ-OD1 2.79Å; R1198-D1232 IonicContact CZ-OD2 2.66Å; R1198-D1232 IonicContact NH1-OD1 4Å; R1198-D1232 PolarHBondContact NH1-OD1 3.2Å; R1198-D1232 IonicContact NH1-OD2 3.52Å; R1198-D1232 IonicContact NH2-OD1 3.82Å; R1198-D1232 PolarHBondContact NH2-OD1 2.85Å; R1198-D1232 IonicContact NH2-OD2 3.74Å; R1198-D1232 PolarHBondContact NH2-OD2 3.09Å; R1198-S1240 PolarHBondContact NH2-OG 3.33Å; R1198-S1240 VanDerWaalsContact NH2-OG 3.1Å
1199	S	66.8	Low	68.4	Low	83 Å²	83	53.9 Å²	53.9	58%	0.58	26%	0.259	S	S	*	.	H	α-helix	trans	-72.3	-35.2	175.6	68	0	0	0	0	112.1	Q1195 Q1196	Q1195-S1199 WeakPolarHBondContact O-CB 3.32Å; Q1195-S1199 PolarHBondContact O-N 2.94Å; Q1195-S1199 PolarHBondContact O-OG 2.8Å; Q1196-S1199 WeakPolarHBondContact CA-OG 3.39Å; Q1196-S1199 PolarHBondContact O-N 3.08Å; Q1196-S1199 PolarHBondContact O-OG 3.13Å
1200	R	65.6	Low	68.9	Low	66 Å²	66	50.1 Å²	50.1	25%	0.249	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	4.2	177.8	-57.6	-174.9	-179.9	-178	3.7	114.2	E1131 A1165 Q1196 R1202	E1131-R1200 VanDerWaalsContact CD-NH2 3.29Å; E1131-R1200 IonicContact OE1-CZ 2.87Å; E1131-R1200 IonicContact OE1-NE 2.83Å; E1131-R1200 IonicContact OE1-NH2 3.22Å; E1131-R1200 PolarHBondContact OE1-NH2 3.29Å; A1165-R1200 PolarHBondContact O-NH1 3.34Å; Q1196-R1200 VanDerWaalsContact O-CB 3.29Å; Q1196-R1200 WeakPolarHBondContact O-CB 3.29Å; Q1196-R1200 WeakPolarHBondContact O-CG 3.3Å; Q1196-R1200 PolarHBondContact O-N 3.33Å; R1200-R1202 PolarHBondContact O-N 3.49Å
1201	N	65.9	Low	69.2	Low	133 Å²	133	53.2 Å²	53.2	71%	0.711	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	48.7	178.4	-157.1	32.3	0	0	0	114.1	A1197 P1203	A1197-N1201 WeakPolarHBondContact O-CA 3.43Å; A1197-N1201 PolarHBondContact O-N 2.95Å; N1201-P1203 VanDerWaalsContact O-CD 3.24Å; N1201-P1203 WeakPolarHBondContact O-CD 3.45Å
1202	R	68.4	Low	69.4	Low	90 Å²	90	52.2 Å²	52.2	34%	0.34	26%	0.259	S	S	.	.			trans	-109	83.2	177.9	-70.2	-173.4	173.8	-175.9	-2.8	110.7	A1165 K1166 A1197 R1200 E1204 L1205 V1206	A1165-R1202 PolarHBondContact O-NH1 3.33Å; A1165-R1202 VanDerWaalsContact O-NH1 3.12Å; K1166-R1202 PolarHBondContact O-NH1 2.98Å; K1166-R1202 PolarHBondContact O-NH2 3.19Å; A1197-R1202 PolarHBondContact O-N 2.81Å; R1200-R1202 PolarHBondContact O-N 3.49Å; R1202-E1204 PolarHBondContact O-N 3.36Å; R1202-L1205 HydrophobicContact CB-CB 3.8Å; R1202-L1205 VanDerWaalsContact O-CB 3.23Å; R1202-L1205 WeakPolarHBondContact O-CB 3.29Å; R1202-L1205 PolarHBondContact O-N 2.92Å; R1202-V1206 PolarHBondContact O-N 2.84Å
1203	P	68.7	Low	69.6	Low	79 Å²	79	51.7 Å²	51.7	51%	0.513	26%	0.256	S	S	.	.	H	α-helix	trans	-63	-27.9	178	26.6	-34.4	0	0	0	112.6	N1201 L1205 V1206 K1207	N1201-P1203 VanDerWaalsContact O-CD 3.24Å; N1201-P1203 WeakPolarHBondContact O-CD 3.45Å; P1203-L1205 PolarHBondContact O-N 3.24Å; P1203-V1206 WeakPolarHBondContact O-CB 3.49Å; P1203-V1206 PolarHBondContact O-N 3.5Å; P1203-K1207 PolarHBondContact O-N 2.92Å
1204	E	70.9	Confident	69.8	Low	122 Å²	122	56.7 Å²	56.7	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-60.2	-35.7	172.9	-57.7	71.6	-156.2	0	0	111.2	R1202 K1207 Q1208	R1202-E1204 PolarHBondContact O-N 3.36Å; E1204-K1207 PolarHBondContact O-N 3.38Å; E1204-Q1208 WeakPolarHBondContact O-CB 3.29Å; E1204-Q1208 VanDerWaalsContact O-CG 3.3Å; E1204-Q1208 WeakPolarHBondContact O-CG 3.44Å; E1204-Q1208 PolarHBondContact O-N 3.04Å
1205	L	70.3	Confident	69.8	Low	9 Å²	9	64.8 Å²	64.8	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-67.7	-45.2	177.5	-157.3	68.1	0	0	0	110.5	V1164 A1197 R1202 P1203 K1207 Q1208 I1209	V1164-L1205 HydrophobicContact CG1-CD1 3.45Å; V1164-L1205 VanDerWaalsContact CG1-CD1 3.45Å; V1164-L1205 HydrophobicContact CG1-CG 4.3Å; A1197-L1205 HydrophobicContact CB-CB 4.01Å; A1197-L1205 HydrophobicContact CB-CD2 4.01Å; A1197-L1205 HydrophobicContact CB-CG 4.35Å; R1202-L1205 HydrophobicContact CB-CB 3.8Å; R1202-L1205 VanDerWaalsContact O-CB 3.23Å; R1202-L1205 WeakPolarHBondContact O-CB 3.29Å; R1202-L1205 PolarHBondContact O-N 2.92Å; P1203-L1205 PolarHBondContact O-N 3.24Å; L1205-K1207 VanDerWaalsContact C-N 3.28Å; L1205-K1207 PolarHBondContact O-N 3.26Å; L1205-Q1208 PolarHBondContact O-N 2.77Å; L1205-I1209 HydrophobicContact CG-CD1 4.13Å; L1205-I1209 WeakPolarHBondContact O-CB 3.17Å; L1205-I1209 WeakPolarHBondContact O-CD1 3.39Å; L1205-I1209 WeakPolarHBondContact O-CG1 3.33Å; L1205-I1209 PolarHBondContact O-N 3.5Å
1206	V	71.2	Confident	69.5	Low	18 Å²	18	63.6 Å²	63.6	11%	0.109	30%	0.303	C	S	.	.	H	α-helix	trans	-55.9	-47.4	172.1	-173.4	0	0	0	0	109.5	A1197 R1202 P1203 Q1208 I1209 L1210 I1228	A1197-V1206 HydrophobicContact CB-CG2 3.48Å; A1197-V1206 VanDerWaalsContact CB-CG2 3.48Å; R1202-V1206 PolarHBondContact O-N 2.84Å; P1203-V1206 WeakPolarHBondContact O-CB 3.49Å; P1203-V1206 PolarHBondContact O-N 3.5Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; V1206-I1209 PolarHBondContact O-N 2.9Å; V1206-L1210 HydrophobicContact CG1-CD1 3.81Å; V1206-L1210 HydrophobicContact CG1-CG 4.14Å; V1206-L1210 WeakPolarHBondContact O-CB 3.17Å; V1206-L1210 WeakPolarHBondContact O-CG 3.48Å; V1206-L1210 PolarHBondContact O-N 3.37Å; V1206-I1228 HydrophobicContact CG1-CD1 3.92Å
1207	K	74.1	Confident	69.4	Low	147 Å²	147	63.6 Å²	63.6	64%	0.639	30%	0.304	S	S	*	.	H	α-helix	trans	-62.4	-40.6	179.1	-163.6	169.9	-173.2	167.7	0	112.7	P1203 E1204 L1205 L1211	P1203-K1207 PolarHBondContact O-N 2.92Å; E1204-K1207 PolarHBondContact O-N 3.38Å; L1205-K1207 VanDerWaalsContact C-N 3.28Å; L1205-K1207 PolarHBondContact O-N 3.26Å; K1207-L1211 HydrophobicContact CG-CD1 4.27Å; K1207-L1211 VanDerWaalsContact O-CB 3.3Å; K1207-L1211 WeakPolarHBondContact O-CB 3.24Å; K1207-L1211 WeakPolarHBondContact O-CD1 3.26Å; K1207-L1211 WeakPolarHBondContact O-CG 3.29Å; K1207-L1211 PolarHBondContact O-N 3.48Å
1208	Q	73.1	Confident	69.5	Low	87 Å²	87	67.4 Å²	67.4	41%	0.407	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-45.1	174	-75.3	173.8	-4.2	0	0	112	E1204 L1205 V1206 L1211 L1212	E1204-Q1208 WeakPolarHBondContact O-CB 3.29Å; E1204-Q1208 VanDerWaalsContact O-CG 3.3Å; E1204-Q1208 WeakPolarHBondContact O-CG 3.44Å; E1204-Q1208 PolarHBondContact O-N 3.04Å; L1205-Q1208 PolarHBondContact O-N 2.77Å; V1206-Q1208 PolarHBondContact O-N 2.99Å; Q1208-L1211 PolarHBondContact O-N 2.96Å; Q1208-L1212 WeakPolarHBondContact O-CB 3.32Å; Q1208-L1212 WeakPolarHBondContact O-CG 3.42Å; Q1208-L1212 PolarHBondContact O-N 2.87Å
1209	I	73	Confident	69.7	Low	2 Å²	2	69.1 Å²	69.1	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-62.5	-46.2	176.6	-64.1	153.6	0	0	0	110.4	M1188 L1193 L1205 V1206 L1211 L1212 L1213	M1188-I1209 HydrophobicContact CE-CG2 4.4Å; L1193-I1209 HydrophobicContact CB-CD1 3.66Å; L1193-I1209 HydrophobicContact CB-CG1 4.38Å; L1193-I1209 HydrophobicContact CD1-CD1 4.38Å; L1193-I1209 HydrophobicContact CD1-CG1 4.26Å; L1193-I1209 HydrophobicContact CD2-CD1 4.48Å; L1193-I1209 HydrophobicContact CG-CD1 4.4Å; L1205-I1209 HydrophobicContact CG-CD1 4.13Å; L1205-I1209 WeakPolarHBondContact O-CB 3.17Å; L1205-I1209 WeakPolarHBondContact O-CD1 3.39Å; L1205-I1209 WeakPolarHBondContact O-CG1 3.33Å; L1205-I1209 PolarHBondContact O-N 3.5Å; V1206-I1209 PolarHBondContact O-N 2.9Å; I1209-L1211 VanDerWaalsContact C-N 3.33Å; I1209-L1211 PolarHBondContact O-N 3.23Å; I1209-L1212 PolarHBondContact O-N 2.85Å; I1209-L1213 HydrophobicContact CG2-CD1 3.79Å; I1209-L1213 HydrophobicContact CG2-CG 4.21Å; I1209-L1213 WeakPolarHBondContact O-CB 3.23Å; I1209-L1213 WeakPolarHBondContact O-CG 3.3Å; I1209-L1213 PolarHBondContact O-N 2.89Å
1210	L	75.1	Confident	69.7	Low	10 Å²	10	67.2 Å²	67.2	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-38.5	176.4	-70.2	176	0	0	0	111.5	V1206 K1214 L1221 V1225 I1228 M1244 F1247	V1206-L1210 HydrophobicContact CG1-CD1 3.81Å; V1206-L1210 HydrophobicContact CG1-CG 4.14Å; V1206-L1210 WeakPolarHBondContact O-CB 3.17Å; V1206-L1210 WeakPolarHBondContact O-CG 3.48Å; V1206-L1210 PolarHBondContact O-N 3.37Å; L1210-K1214 WeakPolarHBondContact O-CB 3.43Å; L1210-K1214 PolarHBondContact O-N 3.05Å; L1210-L1221 HydrophobicContact CB-CD1 4.3Å; L1210-L1221 HydrophobicContact CD2-CD1 3.62Å; L1210-L1221 WeakPolarHBondContact O-CD1 3.46Å; L1210-V1225 HydrophobicContact CD2-CG2 3.75Å; L1210-I1228 HydrophobicContact CD2-CD1 4.02Å; L1210-M1244 HydrophobicContact CD1-CE 3.79Å; L1210-M1244 HydrophobicContact CD1-SD 3.81Å; L1210-M1244 HydrophobicContact CD2-CE 4.21Å; L1210-F1247 HydrophobicContact CB-CE1 4.25Å; L1210-F1247 HydrophobicContact CB-CE2 4.21Å; L1210-F1247 HydrophobicContact CB-CZ 3.71Å; L1210-F1247 HydrophobicContact CD1-CD1 4.3Å; L1210-F1247 HydrophobicContact CD1-CD2 4.48Å; L1210-F1247 HydrophobicContact CD1-CE1 4.1Å; L1210-F1247 HydrophobicContact CD1-CE2 4.25Å; L1210-F1247 HydrophobicContact CD1-CZ 4.08Å; L1210-F1247 HydrophobicContact CD2-CE1 3.86Å; L1210-F1247 HydrophobicContact CD2-CZ 4.22Å; L1210-F1247 HydrophobicContact CG-CE1 4.29Å; L1210-F1247 HydrophobicContact CG-CZ 4.22Å
1211	L	75.1	Confident	70.2	Confident	87 Å²	87	64.2 Å²	64.2	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-66.6	-36.2	173.9	-76.8	166.1	0	0	0	112.8	K1207 Q1208 I1209 R1215	K1207-L1211 HydrophobicContact CG-CD1 4.27Å; K1207-L1211 VanDerWaalsContact O-CB 3.3Å; K1207-L1211 WeakPolarHBondContact O-CB 3.24Å; K1207-L1211 WeakPolarHBondContact O-CD1 3.26Å; K1207-L1211 WeakPolarHBondContact O-CG 3.29Å; K1207-L1211 PolarHBondContact O-N 3.48Å; Q1208-L1211 PolarHBondContact O-N 2.96Å; I1209-L1211 VanDerWaalsContact C-N 3.33Å; I1209-L1211 PolarHBondContact O-N 3.23Å; L1211-R1215 WeakPolarHBondContact O-CG 3.44Å; L1211-R1215 PolarHBondContact O-N 3.29Å
1212	L	71.6	Confident	70.6	Confident	23 Å²	23	57.9 Å²	57.9	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-70.1	-50.3	175.1	-78.3	162.1	0	0	0	111.6	W1160 T1185 Q1208 I1209 K1214 R1215 H1216	W1160-L1212 HydrophobicContact CH2-CD1 3.63Å; W1160-L1212 HydrophobicContact CZ2-CD1 3.88Å; T1185-L1212 HydrophobicContact CG2-CB 4.38Å; Q1208-L1212 WeakPolarHBondContact O-CB 3.32Å; Q1208-L1212 WeakPolarHBondContact O-CG 3.42Å; Q1208-L1212 PolarHBondContact O-N 2.87Å; I1209-L1212 PolarHBondContact O-N 2.85Å; L1212-K1214 VanDerWaalsContact C-N 3.29Å; L1212-K1214 PolarHBondContact O-N 3.33Å; L1212-R1215 WeakPolarHBondContact O-CB 3.39Å; L1212-R1215 PolarHBondContact O-N 3.01Å; L1212-R1215 VanDerWaalsContact O-N 3.08Å; L1212-H1216 PolarHBondContact O-CD2 3.44Å; L1212-H1216 PolarHBondContact O-N 3.21Å
1213	L	70.5	Confident	70.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-35.7	177	-67.5	176	0	0	0	111.7	M1188 Y1190 I1209 R1215 H1216 T1217 Q1220 L1221 A1224	M1188-L1213 HydrophobicContact CE-CD2 3.66Å; M1188-L1213 HydrophobicContact CE-CG 4.07Å; Y1190-L1213 HydrophobicContact CD1-CD1 4.42Å; Y1190-L1213 HydrophobicContact CD1-CD2 4.17Å; Y1190-L1213 HydrophobicContact CG-CD1 4.21Å; I1209-L1213 HydrophobicContact CG2-CD1 3.79Å; I1209-L1213 HydrophobicContact CG2-CG 4.21Å; I1209-L1213 WeakPolarHBondContact O-CB 3.23Å; I1209-L1213 WeakPolarHBondContact O-CG 3.3Å; I1209-L1213 PolarHBondContact O-N 2.89Å; L1213-R1215 VanDerWaalsContact C-N 3.26Å; L1213-R1215 PolarHBondContact O-N 2.9Å; L1213-H1216 PolarHBondContact O-N 3.26Å; L1213-T1217 VanDerWaalsContact CD2-OG1 3.26Å; L1213-T1217 WeakPolarHBondContact CD2-OG1 3.48Å; L1213-T1217 CarbonylContact O-C 3.5Å; L1213-T1217 VanDerWaalsContact O-C 3.28Å; L1213-T1217 PolarHBondContact O-N 2.63Å; L1213-Q1220 HydrophobicContact CD2-CB 4.01Å; L1213-L1221 HydrophobicContact CB-CB 4.05Å; L1213-L1221 HydrophobicContact CB-CD1 3.67Å; L1213-L1221 HydrophobicContact CB-CG 4.5Å; L1213-A1224 HydrophobicContact CD1-CB 3.55Å
1214	K	71.4	Confident	70.9	Confident	106 Å²	106	50.1 Å²	50.1	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-63.8	-26.9	173.4	175.7	175.6	176.2	167	0	113.5	L1210 L1212 L1221 N1251	L1210-K1214 WeakPolarHBondContact O-CB 3.43Å; L1210-K1214 PolarHBondContact O-N 3.05Å; L1212-K1214 VanDerWaalsContact C-N 3.29Å; L1212-K1214 PolarHBondContact O-N 3.33Å; K1214-L1221 HydrophobicContact CB-CD1 4.43Å; K1214-L1221 HydrophobicContact CB-CD2 4.01Å; K1214-N1251 VanDerWaalsContact CD-OD1 3.27Å; K1214-N1251 WeakPolarHBondContact CD-OD1 3.35Å; K1214-N1251 WeakPolarHBondContact CE-OD1 3.24Å; K1214-N1251 PolarHBondContact NZ-OD1 2.93Å
1215	R	69.5	Low	71.3	Confident	170 Å²	170	44.3 Å²	44.3	64%	0.642	21%	0.209	S	C	*	.	H	α-helix	trans	-81.9	-35.7	176.7	-75.9	172.2	179.5	-168.8	1.6	113	E1181 L1211 L1212 L1213	E1181-R1215 IonicContact OE1-NH1 3.52Å; E1181-R1215 IonicContact OE2-NH1 3.07Å; L1211-R1215 WeakPolarHBondContact O-CG 3.44Å; L1211-R1215 PolarHBondContact O-N 3.29Å; L1212-R1215 WeakPolarHBondContact O-CB 3.39Å; L1212-R1215 PolarHBondContact O-N 3.01Å; L1212-R1215 VanDerWaalsContact O-N 3.08Å; L1213-R1215 VanDerWaalsContact C-N 3.26Å; L1213-R1215 PolarHBondContact O-N 2.9Å
1216	H	61.5	Low	71.6	Confident	51 Å²	51	43.9 Å²	43.9	24%	0.236	21%	0.207	C	C	.	.	H	α-helix	trans	-120.7	-28.8	-161.8	-67.4	-67.4	0	0	0	115.8	E1181 D1182 T1185 L1212 L1213	E1181-H1216 WeakPolarHBondContact CB-NE2 3.46Å; E1181-H1216 IonicContact OE2-CD2 2.73Å; E1181-H1216 IonicContact OE2-CE1 2.69Å; E1181-H1216 IonicContact OE2-NE2 3.67Å; E1181-H1216 PolarHBondContact OE2-NE2 2.9Å; D1182-H1216 IonicContact OD1-CE1 3.78Å; D1182-H1216 IonicContact OD1-ND1 2.77Å; T1185-H1216 HydrophobicContact CG2-CB 3.84Å; T1185-H1216 VanDerWaalsContact OG1-CB 3.25Å; T1185-H1216 WeakPolarHBondContact OG1-CB 3.45Å; L1212-H1216 PolarHBondContact O-CD2 3.44Å; L1212-H1216 PolarHBondContact O-N 3.21Å; L1213-H1216 PolarHBondContact O-N 3.26Å
1217	T	66	Low	71.6	Confident	16 Å²	16	43.9 Å²	43.9	10%	0.098	21%	0.205	C	C	.	.			trans	-150.2	76.1	-167.3	50.4	0	0	0	0	111.5	L1213 E1219 Q1220 L1221	L1213-T1217 VanDerWaalsContact CD2-OG1 3.26Å; L1213-T1217 WeakPolarHBondContact CD2-OG1 3.48Å; L1213-T1217 CarbonylContact O-C 3.5Å; L1213-T1217 VanDerWaalsContact O-C 3.28Å; L1213-T1217 PolarHBondContact O-N 2.63Å; T1217-E1219 VanDerWaalsContact C-N 3.32Å; T1217-E1219 PolarHBondContact O-N 2.69Å; T1217-Q1220 HydrophobicContact CG2-CG 4.39Å; T1217-Q1220 CarbonylContact O-C 3.41Å; T1217-Q1220 WeakPolarHBondContact O-CB 3.29Å; T1217-Q1220 PolarHBondContact O-N 2.78Å; T1217-Q1220 VanDerWaalsContact O-N 3.09Å; T1217-Q1220 PolarHBondContact OG1-OE1 3.46Å; T1217-L1221 PolarHBondContact O-N 2.97Å
1218	P	68.8	Low	71.6	Confident	82 Å²	82	37 Å²	37	53%	0.532	18%	0.175	S	C	.	.	H	α-helix	trans	-62.9	-31.6	-176.8	23.8	-33.5	0	0	0	114.1	L1221 S1222	P1218-L1221 WeakPolarHBondContact O-CB 3.36Å; P1218-L1221 PolarHBondContact O-N 3.3Å; P1218-S1222 PolarHBondContact O-N 3.09Å
1219	E	66.5	Low	71.8	Confident	70 Å²	70	32.8 Å²	32.8	33%	0.327	16%	0.156	S	C	.	.	H	α-helix	trans	-62.9	-41.9	172.7	-61.5	-176.5	177	0	0	111.5	N503 T1217 S1222 S1223	N503-E1219 WeakPolarHBondContact CB-OE1 3.25Å; T1217-E1219 VanDerWaalsContact C-N 3.32Å; T1217-E1219 PolarHBondContact O-N 2.69Å; E1219-S1222 PolarHBondContact O-N 3.3Å; E1219-S1223 PolarHBondContact O-N 2.89Å; E1219-S1223 VanDerWaalsContact O-N 3.09Å; E1219-S1223 PolarHBondContact O-OG 2.85Å
1220	Q	66.8	Low	71.6	Confident	43 Å²	43	34.2 Å²	34.2	20%	0.201	16%	0.164	C	C	.	.	H	α-helix	trans	-71.5	-33.2	173.9	-64.8	-173.6	-5.7	0	0	111.9	T1185 Y1190 L1213 T1217 S1223 A1224	T1185-Q1220 PolarHBondContact O-OE1 3.08Å; Y1190-Q1220 HydrophobicContact CD1-CB 4.25Å; Y1190-Q1220 HydrophobicContact CE1-CB 3.55Å; Y1190-Q1220 HydrophobicContact CE1-CG 3.68Å; L1213-Q1220 HydrophobicContact CD2-CB 4.01Å; T1217-Q1220 HydrophobicContact CG2-CG 4.39Å; T1217-Q1220 CarbonylContact O-C 3.41Å; T1217-Q1220 WeakPolarHBondContact O-CB 3.29Å; T1217-Q1220 PolarHBondContact O-N 2.78Å; T1217-Q1220 VanDerWaalsContact O-N 3.09Å; T1217-Q1220 PolarHBondContact OG1-OE1 3.46Å; Q1220-S1223 PolarHBondContact O-N 3.28Å; Q1220-A1224 VanDerWaalsContact O-CB 3.25Å; Q1220-A1224 WeakPolarHBondContact O-CB 3.43Å; Q1220-A1224 PolarHBondContact O-N 2.87Å
1221	L	75.7	Confident	71.3	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-48.6	171.3	-173.8	73.1	0	0	0	110.1	L1210 L1213 K1214 T1217 P1218 S1223 A1224 V1225 F1247 N1251 C1253	L1210-L1221 HydrophobicContact CB-CD1 4.3Å; L1210-L1221 HydrophobicContact CD2-CD1 3.62Å; L1210-L1221 WeakPolarHBondContact O-CD1 3.46Å; L1213-L1221 HydrophobicContact CB-CB 4.05Å; L1213-L1221 HydrophobicContact CB-CD1 3.67Å; L1213-L1221 HydrophobicContact CB-CG 4.5Å; K1214-L1221 HydrophobicContact CB-CD1 4.43Å; K1214-L1221 HydrophobicContact CB-CD2 4.01Å; T1217-L1221 PolarHBondContact O-N 2.97Å; P1218-L1221 WeakPolarHBondContact O-CB 3.36Å; P1218-L1221 PolarHBondContact O-N 3.3Å; L1221-S1223 VanDerWaalsContact C-N 3.26Å; L1221-S1223 PolarHBondContact O-N 2.92Å; L1221-A1224 PolarHBondContact O-N 3.41Å; L1221-V1225 HydrophobicContact CD1-CG2 4.46Å; L1221-V1225 HydrophobicContact CG-CG2 4.35Å; L1221-V1225 WeakPolarHBondContact O-CB 3.28Å; L1221-V1225 WeakPolarHBondContact O-CG2 3.42Å; L1221-V1225 PolarHBondContact O-N 3.37Å; L1221-F1247 HydrophobicContact CD1-CE1 3.91Å; L1221-F1247 HydrophobicContact CD1-CZ 4.15Å; L1221-F1247 HydrophobicContact CD2-CE1 4.12Å; L1221-F1247 HydrophobicContact CD2-CZ 4.39Å; L1221-F1247 HydrophobicContact CG-CE1 4.21Å; L1221-N1251 HydrophobicContact CD2-CB 4.2Å; L1221-C1253 HydrophobicContact CB-CB 4.31Å; L1221-C1253 HydrophobicContact CD2-CB 3.84Å; L1221-C1253 HydrophobicContact CG-CB 4.03Å
1222	S	75.4	Confident	71.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-37.2	177.7	-174.5	0	0	0	0	112.4	P1218 E1219 G1226 C1253 E1255 S1256	P1218-S1222 PolarHBondContact O-N 3.09Å; E1219-S1222 PolarHBondContact O-N 3.3Å; S1222-G1226 PolarHBondContact O-N 3.27Å; S1222-C1253 VanDerWaalsContact CA-O 3.3Å; S1222-C1253 WeakPolarHBondContact CA-O 3.11Å; S1222-C1253 WeakPolarHBondContact CB-O 3.32Å; S1222-C1253 PolarHBondContact OG-O 3.31Å; S1222-E1255 PolarHBondContact OG-N 3.49Å; S1222-E1255 VanDerWaalsContact OG-N 3.17Å; S1222-S1256 VanDerWaalsContact C-OG 3.31Å; S1222-S1256 PolarHBondContact O-OG 3.07Å; S1222-S1256 WeakPolarHBondContact OG-CB 3.27Å; S1222-S1256 PolarHBondContact OG-N 2.93Å; S1222-S1256 PolarHBondContact OG-OG 3.42Å
1223	S	71.3	Confident	71.1	Confident	6 Å²	6	34.4 Å²	34.4	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-69.4	-47.1	175.9	-58.4	0	0	0	0	111.5	Y1190 E1219 Q1220 L1221 V1225 G1226 Y1227 S1256	Y1190-S1223 WeakPolarHBondContact OH-CB 3.45Å; E1219-S1223 PolarHBondContact O-N 2.89Å; E1219-S1223 VanDerWaalsContact O-N 3.09Å; E1219-S1223 PolarHBondContact O-OG 2.85Å; Q1220-S1223 PolarHBondContact O-N 3.28Å; L1221-S1223 VanDerWaalsContact C-N 3.26Å; L1221-S1223 PolarHBondContact O-N 2.92Å; S1223-V1225 PolarHBondContact O-N 3.28Å; S1223-G1226 PolarHBondContact O-N 2.82Å; S1223-Y1227 WeakPolarHBondContact O-CD2 3.33Å; S1223-Y1227 PolarHBondContact O-N 3.28Å; S1223-S1256 WeakPolarHBondContact OG-CB 3.18Å
1224	A	71.3	Confident	70.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-46.5	176.9	0	0	0	0	0	111.5	Y1190 L1213 Q1220 L1221 G1226 Y1227 I1228	Y1190-A1224 HydrophobicContact CD2-CB 3.6Å; Y1190-A1224 HydrophobicContact CE2-CB 4Å; Y1190-A1224 HydrophobicContact CG-CB 4.18Å; L1213-A1224 HydrophobicContact CD1-CB 3.55Å; Q1220-A1224 VanDerWaalsContact O-CB 3.25Å; Q1220-A1224 WeakPolarHBondContact O-CB 3.43Å; Q1220-A1224 PolarHBondContact O-N 2.87Å; L1221-A1224 PolarHBondContact O-N 3.41Å; A1224-G1226 PolarHBondContact O-N 3.33Å; A1224-Y1227 PolarHBondContact O-N 3.4Å; A1224-I1228 WeakPolarHBondContact O-CB 3.48Å; A1224-I1228 WeakPolarHBondContact O-CD1 3.39Å; A1224-I1228 WeakPolarHBondContact O-CG1 3.37Å; A1224-I1228 PolarHBondContact O-N 3.39Å
1225	V	79.5	Confident	70.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-42.2	175.2	174.8	0	0	0	0	110.8	L1210 L1221 S1223 Y1227 I1228 I1229 M1244 F1247 A1248 Y1259	L1210-V1225 HydrophobicContact CD2-CG2 3.75Å; L1221-V1225 HydrophobicContact CD1-CG2 4.46Å; L1221-V1225 HydrophobicContact CG-CG2 4.35Å; L1221-V1225 WeakPolarHBondContact O-CB 3.28Å; L1221-V1225 WeakPolarHBondContact O-CG2 3.42Å; L1221-V1225 PolarHBondContact O-N 3.37Å; S1223-V1225 PolarHBondContact O-N 3.28Å; V1225-Y1227 PolarHBondContact O-N 3.24Å; V1225-I1228 PolarHBondContact O-N 2.75Å; V1225-I1229 HydrophobicContact CG1-CD1 3.86Å; V1225-I1229 HydrophobicContact CG1-CG1 4.46Å; V1225-I1229 VanDerWaalsContact O-CG1 3.29Å; V1225-I1229 WeakPolarHBondContact O-CG1 3.18Å; V1225-I1229 PolarHBondContact O-N 3.42Å; V1225-M1244 HydrophobicContact CB-CE 4.1Å; V1225-M1244 HydrophobicContact CG1-CE 3.84Å; V1225-M1244 WeakPolarHBondContact CG1-O 3.33Å; V1225-M1244 HydrophobicContact CG2-CE 3.7Å; V1225-F1247 HydrophobicContact CG2-CD1 3.83Å; V1225-F1247 HydrophobicContact CG2-CE1 3.84Å; V1225-A1248 HydrophobicContact CG1-CB 3.7Å; V1225-Y1259 HydrophobicContact CG1-CD2 4.21Å; V1225-Y1259 HydrophobicContact CG1-CE2 4.34Å
1226	G	76.5	Confident	70.6	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-39.2	172	0	0	0	0	0	114.2	S1222 S1223 A1224 N1230	S1222-G1226 PolarHBondContact O-N 3.27Å; S1223-G1226 PolarHBondContact O-N 2.82Å; A1224-G1226 PolarHBondContact O-N 3.33Å; G1226-N1230 PolarHBondContact O-N 2.89Å; G1226-N1230 PolarHBondContact O-ND2 2.8Å
1227	Y	70.5	Confident	71	Confident	19 Å²	19	33 Å²	33	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-40.1	173.2	-68.6	-59.7	0	0	0	112.4	Y1190 S1223 A1224 V1225 I1229 N1230 L1231 I1258 L1290	Y1190-Y1227 HydrophobicContact CE2-CD2 4.07Å; Y1190-Y1227 HydrophobicContact CE2-CE2 4.13Å; S1223-Y1227 WeakPolarHBondContact O-CD2 3.33Å; S1223-Y1227 PolarHBondContact O-N 3.28Å; A1224-Y1227 PolarHBondContact O-N 3.4Å; V1225-Y1227 PolarHBondContact O-N 3.24Å; Y1227-I1229 VanDerWaalsContact C-N 3.33Å; Y1227-I1229 PolarHBondContact O-N 3.38Å; Y1227-N1230 PolarHBondContact O-N 3.08Å; Y1227-L1231 VanDerWaalsContact O-CB 3.29Å; Y1227-L1231 WeakPolarHBondContact O-CB 3.31Å; Y1227-L1231 VanDerWaalsContact O-CG 3.26Å; Y1227-L1231 WeakPolarHBondContact O-CG 3.5Å; Y1227-L1231 PolarHBondContact O-N 3.31Å; Y1227-I1258 HydrophobicContact CD1-CG2 3.92Å; Y1227-I1258 HydrophobicContact CE1-CG1 4.23Å; Y1227-I1258 HydrophobicContact CE1-CG2 3.74Å; Y1227-I1258 HydrophobicContact CE2-CD1 3.88Å; Y1227-I1258 HydrophobicContact CE2-CG1 4.43Å; Y1227-I1258 HydrophobicContact CE2-CG2 4.44Å; Y1227-I1258 HydrophobicContact CG-CG2 4.3Å; Y1227-I1258 WeakPolarHBondContact OH-CD1 3.45Å; Y1227-I1258 WeakPolarHBondContact OH-CG1 3.42Å; Y1227-L1290 HydrophobicContact CE1-CD1 4.49Å; Y1227-L1290 HydrophobicContact CE1-CD2 3.83Å; Y1227-L1290 HydrophobicContact CE1-CG 3.9Å; Y1227-L1290 HydrophobicContact CE2-CD2 4.24Å; Y1227-L1290 VanDerWaalsContact CZ-CD2 3.46Å; Y1227-L1290 WeakPolarHBondContact OH-CD2 3.33Å; Y1227-L1290 WeakPolarHBondContact OH-CG 3.37Å
1228	I	74.8	Confident	71.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-44.2	176.6	-68.1	162.6	0	0	0	110	V1194 R1198 V1206 L1210 A1224 V1225 L1231 D1232 M1244	V1194-I1228 HydrophobicContact CB-CG1 4.43Å; V1194-I1228 HydrophobicContact CG1-CG1 3.55Å; V1194-I1228 HydrophobicContact CG2-CD1 4.07Å; V1194-I1228 HydrophobicContact CG2-CG1 3.94Å; R1198-I1228 PolarHBondContact NH1-O 3.11Å; R1198-I1228 VanDerWaalsContact NH1-O 3.1Å; V1206-I1228 HydrophobicContact CG1-CD1 3.92Å; L1210-I1228 HydrophobicContact CD2-CD1 4.02Å; A1224-I1228 WeakPolarHBondContact O-CB 3.48Å; A1224-I1228 WeakPolarHBondContact O-CD1 3.39Å; A1224-I1228 WeakPolarHBondContact O-CG1 3.37Å; A1224-I1228 PolarHBondContact O-N 3.39Å; V1225-I1228 PolarHBondContact O-N 2.75Å; I1228-L1231 CarbonylContact O-C 3.55Å; I1228-L1231 PolarHBondContact O-N 2.86Å; I1228-D1232 PolarHBondContact O-N 2.83Å; I1228-M1244 HydrophobicContact CB-CE 4.02Å; I1228-M1244 HydrophobicContact CD1-CE 3.64Å; I1228-M1244 HydrophobicContact CD1-SD 4.4Å; I1228-M1244 HydrophobicContact CG1-CE 4.43Å; I1228-M1244 HydrophobicContact CG2-CB 4.29Å; I1228-M1244 HydrophobicContact CG2-CE 3.76Å; I1228-M1244 HydrophobicContact CG2-CG 3.56Å; I1228-M1244 HydrophobicContact CG2-SD 3.81Å
1229	I	77.3	Confident	71.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-48.1	175.9	-66.6	165.2	0	0	0	111.1	V1225 Y1227 L1231 D1232 L1233 L1241 M1244 I1245 Y1259 A1262 I1266	V1225-I1229 HydrophobicContact CG1-CD1 3.86Å; V1225-I1229 HydrophobicContact CG1-CG1 4.46Å; V1225-I1229 VanDerWaalsContact O-CG1 3.29Å; V1225-I1229 WeakPolarHBondContact O-CG1 3.18Å; V1225-I1229 PolarHBondContact O-N 3.42Å; Y1227-I1229 VanDerWaalsContact C-N 3.33Å; Y1227-I1229 PolarHBondContact O-N 3.38Å; I1229-L1231 VanDerWaalsContact C-N 3.27Å; I1229-L1231 PolarHBondContact O-N 3.23Å; I1229-D1232 PolarHBondContact O-N 3.47Å; I1229-L1233 HydrophobicContact CG2-CD1 4.01Å; I1229-L1233 PolarHBondContact O-N 2.79Å; I1229-L1241 HydrophobicContact CG2-CD1 3.98Å; I1229-L1241 HydrophobicContact CG2-CG 4.4Å; I1229-M1244 HydrophobicContact CG1-CB 4.15Å; I1229-I1245 HydrophobicContact CD1-CG1 3.78Å; I1229-I1245 HydrophobicContact CG1-CG1 4.26Å; I1229-Y1259 HydrophobicContact CD1-CD2 3.75Å; I1229-Y1259 HydrophobicContact CD1-CE2 3.54Å; I1229-A1262 HydrophobicContact CB-CB 4.19Å; I1229-A1262 HydrophobicContact CG2-CB 3.78Å; I1229-I1266 HydrophobicContact CG2-CD1 3.92Å
1230	N	69.2	Low	71.8	Confident	32 Å²	32	37.6 Å²	37.6	17%	0.171	22%	0.221	C	C	.	.	H	α-helix	trans	-58.6	-38.1	174.9	-81.1	-62.1	0	0	0	112.2	G1226 Y1227 D1232 L1233 S1234 R1265	G1226-N1230 PolarHBondContact O-N 2.89Å; G1226-N1230 PolarHBondContact O-ND2 2.8Å; Y1227-N1230 PolarHBondContact O-N 3.08Å; N1230-D1232 VanDerWaalsContact C-N 3.33Å; N1230-L1233 WeakPolarHBondContact O-CB 3.21Å; N1230-S1234 WeakPolarHBondContact O-CB 3.15Å; N1230-S1234 PolarHBondContact O-N 3.45Å; N1230-S1234 PolarHBondContact O-OG 2.64Å; N1230-R1265 PolarHBondContact OD1-NH1 2.78Å
1231	L	68.3	Low	72.1	Confident	50 Å²	50	36.3 Å²	36.3	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-75.5	-14.6	176	-73.3	167.2	0	0	0	114.1	V1194 Q1195 R1198 Y1227 I1228 I1229 S1234 A1235 R1237	V1194-L1231 HydrophobicContact CG1-CD1 3.67Å; Q1195-L1231 HydrophobicContact CG-CD1 4.47Å; R1198-L1231 PolarHBondContact NH1-O 2.68Å; Y1227-L1231 VanDerWaalsContact O-CB 3.29Å; Y1227-L1231 WeakPolarHBondContact O-CB 3.31Å; Y1227-L1231 VanDerWaalsContact O-CG 3.26Å; Y1227-L1231 WeakPolarHBondContact O-CG 3.5Å; Y1227-L1231 PolarHBondContact O-N 3.31Å; I1228-L1231 CarbonylContact O-C 3.55Å; I1228-L1231 PolarHBondContact O-N 2.86Å; I1229-L1231 VanDerWaalsContact C-N 3.27Å; I1229-L1231 PolarHBondContact O-N 3.23Å; L1231-S1234 WeakPolarHBondContact CA-OG 3.49Å; L1231-A1235 WeakPolarHBondContact O-CB 3.19Å; L1231-R1237 PolarHBondContact O-NH2 3.38Å
1232	D	71.9	Confident	72.2	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.011	24%	0.24	C	C	.	.	H	α-helix	trans	-88.9	-38.6	169.8	-83	-24	0	0	0	111.8	R1198 I1228 I1229 N1230 A1235 G1236 R1237 S1240 L1241	R1198-D1232 IonicContact CZ-OD1 2.79Å; R1198-D1232 IonicContact CZ-OD2 2.66Å; R1198-D1232 IonicContact NH1-OD1 4Å; R1198-D1232 PolarHBondContact NH1-OD1 3.2Å; R1198-D1232 IonicContact NH1-OD2 3.52Å; R1198-D1232 IonicContact NH2-OD1 3.82Å; R1198-D1232 PolarHBondContact NH2-OD1 2.85Å; R1198-D1232 IonicContact NH2-OD2 3.74Å; R1198-D1232 PolarHBondContact NH2-OD2 3.09Å; I1228-D1232 PolarHBondContact O-N 2.83Å; I1229-D1232 PolarHBondContact O-N 3.47Å; N1230-D1232 VanDerWaalsContact C-N 3.33Å; D1232-A1235 CarbonylContact O-C 3.37Å; D1232-A1235 PolarHBondContact O-N 3.15Å; D1232-G1236 PolarHBondContact O-N 2.72Å; D1232-R1237 HydrophobicContact CB-CB 4.21Å; D1232-R1237 PolarHBondContact O-N 3.11Å; D1232-R1237 VanDerWaalsContact OD1-CB 3.23Å; D1232-R1237 WeakPolarHBondContact OD1-CB 3.45Å; D1232-R1237 IonicContact OD1-CZ 3.45Å; D1232-R1237 IonicContact OD1-NE 2.7Å; D1232-R1237 PolarHBondContact OD1-NE 3.24Å; D1232-R1237 IonicContact OD1-NH2 2.75Å; D1232-S1240 VanDerWaalsContact OD2-CB 3.27Å; D1232-S1240 WeakPolarHBondContact OD2-CB 3.42Å; D1232-S1240 PolarHBondContact OD2-OG 3.17Å; D1232-L1241 HydrophobicContact CB-CB 3.92Å; D1232-L1241 HydrophobicContact CB-CD1 4.04Å; D1232-L1241 PolarHBondContact OD2-N 3.3Å
1233	L	70.5	Confident	72.5	Confident	72 Å²	72	48.3 Å²	48.3	38%	0.377	27%	0.27	S	S	.	.	H	α-helix	trans	-53.4	-52.6	166.9	-84.9	151.2	0	0	0	110.8	I1229 N1230 A1235 G1236 L1241 I1266	I1229-L1233 HydrophobicContact CG2-CD1 4.01Å; I1229-L1233 PolarHBondContact O-N 2.79Å; N1230-L1233 WeakPolarHBondContact O-CB 3.21Å; L1233-A1235 PolarHBondContact O-N 3.16Å; L1233-G1236 PolarHBondContact O-N 2.82Å; L1233-L1241 HydrophobicContact CD1-CD1 4.38Å; L1233-L1241 HydrophobicContact CG-CD1 3.77Å; L1233-I1266 HydrophobicContact CD1-CD1 4.25Å; L1233-I1266 HydrophobicContact CD1-CG1 3.92Å; L1233-I1266 HydrophobicContact CD2-CG1 3.93Å; L1233-I1266 HydrophobicContact CG-CG1 4.28Å
1234	S	64.7	Low	72.8	Confident	94 Å²	94	48.7 Å²	48.7	66%	0.657	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.8	-179.4	73.1	0	0	0	0	114.1	N1230 L1231	N1230-S1234 WeakPolarHBondContact O-CB 3.15Å; N1230-S1234 PolarHBondContact O-N 3.45Å; N1230-S1234 PolarHBondContact O-OG 2.64Å; L1231-S1234 WeakPolarHBondContact CA-OG 3.49Å
1235	A	66.5	Low	73.2	Confident	52 Å²	52	50.1 Å²	50.1	43%	0.43	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	2.9	-178.3	0	0	0	0	0	113.8	L1231 D1232 L1233 R1237	L1231-A1235 WeakPolarHBondContact O-CB 3.19Å; D1232-A1235 CarbonylContact O-C 3.37Å; D1232-A1235 PolarHBondContact O-N 3.15Å; L1233-A1235 PolarHBondContact O-N 3.16Å; A1235-R1237 HydrophobicContact CB-CG 4.35Å; A1235-R1237 PolarHBondContact O-N 3.28Å
1236	G	68.9	Low	73.4	Confident	58 Å²	58	55.6 Å²	55.6	60%	0.598	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	17.3	-178	0	0	0	0	0	115.5	D1232 L1233 L1238	D1232-G1236 PolarHBondContact O-N 2.72Å; L1233-G1236 PolarHBondContact O-N 2.82Å; G1236-L1238 PolarHBondContact O-N 3.4Å; G1236-L1238 VanDerWaalsContact O-N 3.07Å
1237	R	70.5	Confident	73.7	Confident	92 Å²	92	57.5 Å²	57.5	35%	0.347	31%	0.313	S	S	.	.			trans	-87.3	72.5	-173.1	-76.4	-169.9	-66.1	-131.3	-20	112.3	L1231 D1232 A1235 D1239 S1240 L1241	L1231-R1237 PolarHBondContact O-NH2 3.38Å; D1232-R1237 HydrophobicContact CB-CB 4.21Å; D1232-R1237 PolarHBondContact O-N 3.11Å; D1232-R1237 VanDerWaalsContact OD1-CB 3.23Å; D1232-R1237 WeakPolarHBondContact OD1-CB 3.45Å; D1232-R1237 IonicContact OD1-CZ 3.45Å; D1232-R1237 IonicContact OD1-NE 2.7Å; D1232-R1237 PolarHBondContact OD1-NE 3.24Å; D1232-R1237 IonicContact OD1-NH2 2.75Å; A1235-R1237 HydrophobicContact CB-CG 4.35Å; A1235-R1237 PolarHBondContact O-N 3.28Å; R1237-D1239 VanDerWaalsContact C-N 3.35Å; R1237-D1239 PolarHBondContact O-N 3.3Å; R1237-S1240 PolarHBondContact O-N 2.81Å; R1237-L1241 WeakPolarHBondContact O-CB 2.99Å; R1237-L1241 PolarHBondContact O-N 3.09Å
1238	L	71.8	Confident	74	Confident	114 Å²	114	56.6 Å²	56.6	60%	0.597	31%	0.309	S	S	*	.	H	α-helix	trans	-60.9	-33.1	-173	-64.3	175.4	0	0	0	115.1	G1236 L1241 K1242	G1236-L1238 PolarHBondContact O-N 3.4Å; G1236-L1238 VanDerWaalsContact O-N 3.07Å; L1238-L1241 WeakPolarHBondContact O-CB 3.22Å; L1238-L1241 PolarHBondContact O-N 2.75Å; L1238-K1242 PolarHBondContact O-N 3.4Å; L1238-K1242 VanDerWaalsContact O-N 3.17Å
1239	D	73.6	Confident	74.3	Confident	117 Å²	117	62.4 Å²	62.4	63%	0.626	34%	0.336	S	S	*	.	H	α-helix	trans	-74.8	-46.5	-178.6	-60.9	-42.9	0	0	0	111.8	R1237 L1241 K1242 E1243	R1237-D1239 VanDerWaalsContact C-N 3.35Å; R1237-D1239 PolarHBondContact O-N 3.3Å; D1239-L1241 PolarHBondContact O-N 3.47Å; D1239-K1242 PolarHBondContact O-N 2.81Å; D1239-K1242 VanDerWaalsContact O-N 3.12Å; D1239-E1243 PolarHBondContact O-N 3.1Å
1240	S	71.7	Confident	74.5	Confident	34 Å²	34	70 Å²	70	24%	0.238	37%	0.372	C	S	.	.	H	α-helix	trans	-58.4	-35.8	170.3	175.2	0	0	0	0	111.5	R1198 D1232 R1237 K1242 E1243 M1244	R1198-S1240 PolarHBondContact NH2-OG 3.33Å; R1198-S1240 VanDerWaalsContact NH2-OG 3.1Å; D1232-S1240 VanDerWaalsContact OD2-CB 3.27Å; D1232-S1240 WeakPolarHBondContact OD2-CB 3.42Å; D1232-S1240 PolarHBondContact OD2-OG 3.17Å; R1237-S1240 PolarHBondContact O-N 2.81Å; S1240-K1242 PolarHBondContact O-N 2.91Å; S1240-E1243 PolarHBondContact O-N 3.27Å; S1240-M1244 VanDerWaalsContact O-CB 3.24Å; S1240-M1244 WeakPolarHBondContact O-CB 3.48Å; S1240-M1244 WeakPolarHBondContact O-CG 3.29Å; S1240-M1244 PolarHBondContact O-N 2.76Å
1241	L	73.5	Confident	74.8	Confident	17 Å²	17	70 Å²	70	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-41.3	176.4	-175.5	131.9	0	0	0	112.1	I1229 D1232 L1233 R1237 L1238 D1239 M1244 I1245 I1266	I1229-L1241 HydrophobicContact CG2-CD1 3.98Å; I1229-L1241 HydrophobicContact CG2-CG 4.4Å; D1232-L1241 HydrophobicContact CB-CB 3.92Å; D1232-L1241 HydrophobicContact CB-CD1 4.04Å; D1232-L1241 PolarHBondContact OD2-N 3.3Å; L1233-L1241 HydrophobicContact CD1-CD1 4.38Å; L1233-L1241 HydrophobicContact CG-CD1 3.77Å; R1237-L1241 WeakPolarHBondContact O-CB 2.99Å; R1237-L1241 PolarHBondContact O-N 3.09Å; L1238-L1241 WeakPolarHBondContact O-CB 3.22Å; L1238-L1241 PolarHBondContact O-N 2.75Å; D1239-L1241 PolarHBondContact O-N 3.47Å; L1241-M1244 PolarHBondContact O-N 2.69Å; L1241-I1245 HydrophobicContact CD2-CD1 3.57Å; L1241-I1245 HydrophobicContact CG-CD1 4Å; L1241-I1245 WeakPolarHBondContact O-CD1 3.32Å; L1241-I1245 VanDerWaalsContact O-CG1 3.24Å; L1241-I1245 WeakPolarHBondContact O-CG1 3.35Å; L1241-I1245 PolarHBondContact O-N 3.1Å; L1241-I1266 HydrophobicContact CD1-CD1 4.24Å; L1241-I1266 HydrophobicContact CD2-CD1 4.2Å
1242	K	78.6	Confident	75.1	Confident	120 Å²	120	73.9 Å²	73.9	52%	0.522	39%	0.387	S	S	.	.	H	α-helix	trans	-65	-51.8	174.8	-70.4	170.6	-174.3	164.1	0	111.5	L1238 D1239 S1240 M1244 I1245 E1246	L1238-K1242 PolarHBondContact O-N 3.4Å; L1238-K1242 VanDerWaalsContact O-N 3.17Å; D1239-K1242 PolarHBondContact O-N 2.81Å; D1239-K1242 VanDerWaalsContact O-N 3.12Å; S1240-K1242 PolarHBondContact O-N 2.91Å; K1242-M1244 PolarHBondContact O-N 3.27Å; K1242-I1245 PolarHBondContact O-N 2.84Å; K1242-E1246 WeakPolarHBondContact O-CB 3.37Å; K1242-E1246 WeakPolarHBondContact O-CG 3.39Å; K1242-E1246 PolarHBondContact O-N 3.14Å
1243	E	81.1	Confident	75	Confident	135 Å²	135	74 Å²	74	63%	0.631	39%	0.387	S	S	*	.	H	α-helix	trans	-54.4	-38.2	177.7	-69.9	-175.7	175.7	0	0	111.7	D1239 S1240 F1247	D1239-E1243 PolarHBondContact O-N 3.1Å; S1240-E1243 PolarHBondContact O-N 3.27Å; E1243-F1247 WeakPolarHBondContact O-CB 3.15Å; E1243-F1247 PolarHBondContact O-N 2.97Å
1244	M	78.3	Confident	75.1	Confident	14 Å²	14	73.3 Å²	73.3	7%	0.069	39%	0.386	C	S	.	.	H	α-helix	trans	-78	-27.9	-179.7	-70.1	-65.1	-39	0	0	113.9	L1210 V1225 I1228 I1229 S1240 L1241 K1242 F1247 A1248	L1210-M1244 HydrophobicContact CD1-CE 3.79Å; L1210-M1244 HydrophobicContact CD1-SD 3.81Å; L1210-M1244 HydrophobicContact CD2-CE 4.21Å; V1225-M1244 HydrophobicContact CB-CE 4.1Å; V1225-M1244 HydrophobicContact CG1-CE 3.84Å; V1225-M1244 WeakPolarHBondContact CG1-O 3.33Å; V1225-M1244 HydrophobicContact CG2-CE 3.7Å; I1228-M1244 HydrophobicContact CB-CE 4.02Å; I1228-M1244 HydrophobicContact CD1-CE 3.64Å; I1228-M1244 HydrophobicContact CD1-SD 4.4Å; I1228-M1244 HydrophobicContact CG1-CE 4.43Å; I1228-M1244 HydrophobicContact CG2-CB 4.29Å; I1228-M1244 HydrophobicContact CG2-CE 3.76Å; I1228-M1244 HydrophobicContact CG2-CG 3.56Å; I1228-M1244 HydrophobicContact CG2-SD 3.81Å; I1229-M1244 HydrophobicContact CG1-CB 4.15Å; S1240-M1244 VanDerWaalsContact O-CB 3.24Å; S1240-M1244 WeakPolarHBondContact O-CB 3.48Å; S1240-M1244 WeakPolarHBondContact O-CG 3.29Å; S1240-M1244 PolarHBondContact O-N 2.76Å; L1241-M1244 PolarHBondContact O-N 2.69Å; K1242-M1244 PolarHBondContact O-N 3.27Å; M1244-F1247 HydrophobicContact CE-CD1 4.31Å; M1244-A1248 WeakPolarHBondContact O-CB 3.31Å; M1244-A1248 PolarHBondContact O-N 3.09Å
1245	I	80.4	Confident	75.2	Confident	29 Å²	29	70.1 Å²	70.1	15%	0.149	36%	0.361	C	S	.	.	H	α-helix	trans	-74.9	-43.2	171	-70.8	167.3	0	0	0	110.5	I1229 L1241 K1242 A1248 Q1249 I1263 I1266	I1229-I1245 HydrophobicContact CD1-CG1 3.78Å; I1229-I1245 HydrophobicContact CG1-CG1 4.26Å; L1241-I1245 HydrophobicContact CD2-CD1 3.57Å; L1241-I1245 HydrophobicContact CG-CD1 4Å; L1241-I1245 WeakPolarHBondContact O-CD1 3.32Å; L1241-I1245 VanDerWaalsContact O-CG1 3.24Å; L1241-I1245 WeakPolarHBondContact O-CG1 3.35Å; L1241-I1245 PolarHBondContact O-N 3.1Å; K1242-I1245 PolarHBondContact O-N 2.84Å; I1245-A1248 WeakPolarHBondContact O-CB 3.37Å; I1245-A1248 PolarHBondContact O-N 2.95Å; I1245-A1248 VanDerWaalsContact O-N 3.09Å; I1245-Q1249 VanDerWaalsContact O-CG 3.31Å; I1245-Q1249 WeakPolarHBondContact O-CG 3.43Å; I1245-Q1249 PolarHBondContact O-N 2.85Å; I1245-I1263 HydrophobicContact CD1-CD1 4.18Å; I1245-I1263 HydrophobicContact CG1-CD1 4.12Å; I1245-I1266 HydrophobicContact CD1-CD1 3.85Å
1246	E	82.2	Confident	75.3	Confident	115 Å²	115	68.2 Å²	68.2	54%	0.537	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-48.8	172.5	-72.1	174.7	-179.7	0	0	110	K1242 A1248 Q1249 E1250	K1242-E1246 WeakPolarHBondContact O-CB 3.37Å; K1242-E1246 WeakPolarHBondContact O-CG 3.39Å; K1242-E1246 PolarHBondContact O-N 3.14Å; E1246-A1248 VanDerWaalsContact C-N 3.27Å; E1246-A1248 PolarHBondContact O-N 2.85Å; E1246-Q1249 PolarHBondContact O-N 3.01Å; E1246-Q1249 VanDerWaalsContact O-N 3.14Å; E1246-E1250 WeakPolarHBondContact O-CB 3.35Å; E1246-E1250 WeakPolarHBondContact O-CG 3.3Å; E1246-E1250 PolarHBondContact O-N 3.07Å
1247	F	82.8	Confident	75.1	Confident	40 Å²	40	66.8 Å²	66.8	18%	0.175	33%	0.33	C	S	.	.	H	α-helix	trans	-56	-40.3	171.5	-179.1	-83.8	0	0	0	112	L1210 L1221 V1225 E1243 M1244 Q1249 N1251	L1210-F1247 HydrophobicContact CB-CE1 4.25Å; L1210-F1247 HydrophobicContact CB-CE2 4.21Å; L1210-F1247 HydrophobicContact CB-CZ 3.71Å; L1210-F1247 HydrophobicContact CD1-CD1 4.3Å; L1210-F1247 HydrophobicContact CD1-CD2 4.48Å; L1210-F1247 HydrophobicContact CD1-CE1 4.1Å; L1210-F1247 HydrophobicContact CD1-CE2 4.25Å; L1210-F1247 HydrophobicContact CD1-CZ 4.08Å; L1210-F1247 HydrophobicContact CD2-CE1 3.86Å; L1210-F1247 HydrophobicContact CD2-CZ 4.22Å; L1210-F1247 HydrophobicContact CG-CE1 4.29Å; L1210-F1247 HydrophobicContact CG-CZ 4.22Å; L1221-F1247 HydrophobicContact CD1-CE1 3.91Å; L1221-F1247 HydrophobicContact CD1-CZ 4.15Å; L1221-F1247 HydrophobicContact CD2-CE1 4.12Å; L1221-F1247 HydrophobicContact CD2-CZ 4.39Å; L1221-F1247 HydrophobicContact CG-CE1 4.21Å; V1225-F1247 HydrophobicContact CG2-CD1 3.83Å; V1225-F1247 HydrophobicContact CG2-CE1 3.84Å; E1243-F1247 WeakPolarHBondContact O-CB 3.15Å; E1243-F1247 PolarHBondContact O-N 2.97Å; M1244-F1247 HydrophobicContact CE-CD1 4.31Å; F1247-Q1249 VanDerWaalsContact C-N 3.34Å; F1247-Q1249 PolarHBondContact O-N 3.29Å; F1247-N1251 VanDerWaalsContact CD2-ND2 3.35Å; F1247-N1251 WeakPolarHBondContact CD2-ND2 3.5Å; F1247-N1251 HydrophobicContact CE1-CB 4.39Å; F1247-N1251 WeakPolarHBondContact CE2-ND2 3.24Å; F1247-N1251 VanDerWaalsContact O-CB 3.3Å; F1247-N1251 WeakPolarHBondContact O-CB 3.24Å; F1247-N1251 PolarHBondContact O-N 3.49Å; F1247-N1251 VanDerWaalsContact O-N 3.09Å; F1247-N1251 PolarHBondContact O-ND2 2.94Å
1248	A	76.9	Confident	74.9	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-42.4	178	0	0	0	0	0	112.8	V1225 M1244 I1245 E1246 K1252 C1253 Y1259	V1225-A1248 HydrophobicContact CG1-CB 3.7Å; M1244-A1248 WeakPolarHBondContact O-CB 3.31Å; M1244-A1248 PolarHBondContact O-N 3.09Å; I1245-A1248 WeakPolarHBondContact O-CB 3.37Å; I1245-A1248 PolarHBondContact O-N 2.95Å; I1245-A1248 VanDerWaalsContact O-N 3.09Å; E1246-A1248 VanDerWaalsContact C-N 3.27Å; E1246-A1248 PolarHBondContact O-N 2.85Å; A1248-K1252 CarbonylContact O-C 3.58Å; A1248-K1252 PolarHBondContact O-N 3.44Å; A1248-C1253 PolarHBondContact O-N 3.03Å; A1248-Y1259 HydrophobicContact CB-CD2 4.15Å; A1248-Y1259 HydrophobicContact CB-CE2 3.28Å
1249	Q	80.8	Confident	75	Confident	124 Å²	124	58.1 Å²	58.1	58%	0.579	29%	0.29	S	S	*	.	H	α-helix	trans	-72.7	-47	-178.6	-68.6	172.1	3	0	0	111.3	I1245 E1246 F1247 N1251 K1252	I1245-Q1249 VanDerWaalsContact O-CG 3.31Å; I1245-Q1249 WeakPolarHBondContact O-CG 3.43Å; I1245-Q1249 PolarHBondContact O-N 2.85Å; E1246-Q1249 PolarHBondContact O-N 3.01Å; E1246-Q1249 VanDerWaalsContact O-N 3.14Å; F1247-Q1249 VanDerWaalsContact C-N 3.34Å; F1247-Q1249 PolarHBondContact O-N 3.29Å; Q1249-N1251 VanDerWaalsContact C-N 3.26Å; Q1249-N1251 PolarHBondContact O-N 3.18Å; Q1249-K1252 PolarHBondContact O-N 3.3Å
1250	E	82	Confident	75.1	Confident	158 Å²	158	55.3 Å²	55.3	74%	0.738	27%	0.27	S	S	*	.	H	α-helix	trans	-58.2	-36.5	175.7	-74.7	-172.4	163.3	0	0	112.8	E1246	E1246-E1250 WeakPolarHBondContact O-CB 3.35Å; E1246-E1250 WeakPolarHBondContact O-CG 3.3Å; E1246-E1250 PolarHBondContact O-N 3.07Å
1251	N	75	Confident	74.8	Confident	32 Å²	32	55.5 Å²	55.5	17%	0.171	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	9.2	-175.7	-62.4	-80.9	0	0	0	113.6	K1214 L1221 F1247 Q1249 C1253	K1214-N1251 VanDerWaalsContact CD-OD1 3.27Å; K1214-N1251 WeakPolarHBondContact CD-OD1 3.35Å; K1214-N1251 WeakPolarHBondContact CE-OD1 3.24Å; K1214-N1251 PolarHBondContact NZ-OD1 2.93Å; L1221-N1251 HydrophobicContact CD2-CB 4.2Å; F1247-N1251 VanDerWaalsContact CD2-ND2 3.35Å; F1247-N1251 WeakPolarHBondContact CD2-ND2 3.5Å; F1247-N1251 HydrophobicContact CE1-CB 4.39Å; F1247-N1251 WeakPolarHBondContact CE2-ND2 3.24Å; F1247-N1251 VanDerWaalsContact O-CB 3.3Å; F1247-N1251 WeakPolarHBondContact O-CB 3.24Å; F1247-N1251 PolarHBondContact O-N 3.49Å; F1247-N1251 VanDerWaalsContact O-N 3.09Å; F1247-N1251 PolarHBondContact O-ND2 2.94Å; Q1249-N1251 VanDerWaalsContact C-N 3.26Å; Q1249-N1251 PolarHBondContact O-N 3.18Å; N1251-C1253 PolarHBondContact O-N 2.66Å
1252	K	75.1	Confident	74.6	Confident	133 Å²	133	54.7 Å²	54.7	58%	0.578	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	17.6	-177.6	-60.5	-173.6	176.8	-174.5	0	115.4	A1248 Q1249 T1254	A1248-K1252 CarbonylContact O-C 3.58Å; A1248-K1252 PolarHBondContact O-N 3.44Å; Q1249-K1252 PolarHBondContact O-N 3.3Å; K1252-T1254 PolarHBondContact O-N 3.48Å
1253	C	70.4	Confident	74.6	Confident	4 Å²	4	50.8 Å²	50.8	3%	0.027	25%	0.246	C	C	.	.			trans	-88.7	57.5	-172.8	69.7	0	0	0	0	111.5	L1221 S1222 A1248 N1251	L1221-C1253 HydrophobicContact CB-CB 4.31Å; L1221-C1253 HydrophobicContact CD2-CB 3.84Å; L1221-C1253 HydrophobicContact CG-CB 4.03Å; S1222-C1253 VanDerWaalsContact CA-O 3.3Å; S1222-C1253 WeakPolarHBondContact CA-O 3.11Å; S1222-C1253 WeakPolarHBondContact CB-O 3.32Å; S1222-C1253 PolarHBondContact OG-O 3.31Å; A1248-C1253 PolarHBondContact O-N 3.03Å; N1251-C1253 PolarHBondContact O-N 2.66Å
1254	T	73.2	Confident	74.1	Confident	57 Å²	57	47.9 Å²	47.9	35%	0.35	23%	0.233	S	C	.	.			trans	-103.1	-0.1	-177.3	60.3	0	0	0	0	113.6	K1252 Y1259	K1252-T1254 PolarHBondContact O-N 3.48Å; T1254-Y1259 VanDerWaalsContact CA-CD1 3.46Å; T1254-Y1259 HydrophobicContact CG2-CD1 4.28Å; T1254-Y1259 HydrophobicContact CG2-CE1 3.56Å; T1254-Y1259 WeakPolarHBondContact O-CD1 3.48Å
1255	E	66.1	Low	73.4	Confident	27 Å²	27	50.2 Å²	50.2	13%	0.126	24%	0.241	C	C	.	.			trans	-68.4	-34.3	-171	-71.4	175.4	-159	0	0	115.6	A504 D505 S1222 R1260	A504-E1255 VanDerWaalsContact CA-OE2 3.26Å; A504-E1255 WeakPolarHBondContact CA-OE2 3.35Å; D505-E1255 HydrophobicContact CB-CG 3.63Å; D505-E1255 WeakPolarHBondContact CB-OE1 3.45Å; D505-E1255 PolarHBondContact N-OE1 3.48Å; D505-E1255 PolarHBondContact N-OE2 3.23Å; S1222-E1255 PolarHBondContact OG-N 3.49Å; S1222-E1255 VanDerWaalsContact OG-N 3.17Å; E1255-R1260 PolarHBondContact O-NE 3.47Å; E1255-R1260 PolarHBondContact O-NH2 3.42Å
1256	S	67.5	Low	73	Confident	12 Å²	12	51.3 Å²	51.3	8%	0.084	25%	0.246	C	C	.	.	S	Bend	trans	-66.9	142.2	-169.6	81	0	0	0	0	111.2	S1222 S1223 I1258 Y1259 R1260	S1222-S1256 VanDerWaalsContact C-OG 3.31Å; S1222-S1256 PolarHBondContact O-OG 3.07Å; S1222-S1256 WeakPolarHBondContact OG-CB 3.27Å; S1222-S1256 PolarHBondContact OG-N 2.93Å; S1222-S1256 PolarHBondContact OG-OG 3.42Å; S1223-S1256 WeakPolarHBondContact OG-CB 3.18Å; S1256-I1258 PolarHBondContact O-N 2.72Å; S1256-I1258 VanDerWaalsContact O-N 3.15Å; S1256-Y1259 PolarHBondContact O-N 3.17Å; S1256-Y1259 VanDerWaalsContact OG-CB 3.31Å; S1256-Y1259 WeakPolarHBondContact OG-CB 3.5Å; S1256-Y1259 PolarHBondContact OG-N 2.91Å; S1256-R1260 PolarHBondContact O-N 3.12Å
1257	G	66.1	Low	72.3	Confident	28 Å²	28	50.8 Å²	50.8	29%	0.289	25%	0.247	S	C	.	.	H	α-helix	trans	-62.9	-17.4	173.3	0	0	0	0	0	113	R1261	G1257-R1261 PolarHBondContact O-N 3.31Å; G1257-R1261 PolarHBondContact O-NE 3.26Å; G1257-R1261 PolarHBondContact O-NH2 2.77Å
1258	I	65	Low	70.9	Confident	12 Å²	12	58 Å²	58	6%	0.062	27%	0.273	C	S	.	.	H	α-helix	trans	-77.2	-48.6	174.4	-56.8	126.7	0	0	0	109.8	Y1227 S1256 R1261 A1262 D1289 I1291	Y1227-I1258 HydrophobicContact CD1-CG2 3.92Å; Y1227-I1258 HydrophobicContact CE1-CG1 4.23Å; Y1227-I1258 HydrophobicContact CE1-CG2 3.74Å; Y1227-I1258 HydrophobicContact CE2-CD1 3.88Å; Y1227-I1258 HydrophobicContact CE2-CG1 4.43Å; Y1227-I1258 HydrophobicContact CE2-CG2 4.44Å; Y1227-I1258 HydrophobicContact CG-CG2 4.3Å; Y1227-I1258 WeakPolarHBondContact OH-CD1 3.45Å; Y1227-I1258 WeakPolarHBondContact OH-CG1 3.42Å; S1256-I1258 PolarHBondContact O-N 2.72Å; S1256-I1258 VanDerWaalsContact O-N 3.15Å; I1258-R1261 PolarHBondContact O-N 2.89Å; I1258-A1262 WeakPolarHBondContact O-CB 2.94Å; I1258-A1262 PolarHBondContact O-N 2.78Å; I1258-D1289 WeakPolarHBondContact CG1-O 3.23Å; I1258-I1291 HydrophobicContact CD1-CD1 4.04Å; I1258-I1291 HydrophobicContact CD1-CG1 4.1Å
1259	Y	74.6	Confident	69.6	Low	13 Å²	13	60.1 Å²	60.1	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-51.8	175.2	177.4	-90.3	0	0	0	111	V1225 I1229 A1248 T1254 S1256 R1261 A1262 I1263	V1225-Y1259 HydrophobicContact CG1-CD2 4.21Å; V1225-Y1259 HydrophobicContact CG1-CE2 4.34Å; I1229-Y1259 HydrophobicContact CD1-CD2 3.75Å; I1229-Y1259 HydrophobicContact CD1-CE2 3.54Å; A1248-Y1259 HydrophobicContact CB-CD2 4.15Å; A1248-Y1259 HydrophobicContact CB-CE2 3.28Å; T1254-Y1259 VanDerWaalsContact CA-CD1 3.46Å; T1254-Y1259 HydrophobicContact CG2-CD1 4.28Å; T1254-Y1259 HydrophobicContact CG2-CE1 3.56Å; T1254-Y1259 WeakPolarHBondContact O-CD1 3.48Å; S1256-Y1259 PolarHBondContact O-N 3.17Å; S1256-Y1259 VanDerWaalsContact OG-CB 3.31Å; S1256-Y1259 WeakPolarHBondContact OG-CB 3.5Å; S1256-Y1259 PolarHBondContact OG-N 2.91Å; Y1259-R1261 PolarHBondContact O-N 3.49Å; Y1259-A1262 WeakPolarHBondContact O-CB 2.98Å; Y1259-A1262 PolarHBondContact O-N 2.87Å; Y1259-I1263 HydrophobicContact CD1-CG1 4.05Å; Y1259-I1263 HydrophobicContact CE1-CD1 4.29Å; Y1259-I1263 HydrophobicContact CE1-CG1 3.54Å; Y1259-I1263 HydrophobicContact CE2-CD1 4.08Å; Y1259-I1263 HydrophobicContact CE2-CG1 4.1Å; Y1259-I1263 WeakPolarHBondContact O-CG1 3.45Å; Y1259-I1263 PolarHBondContact O-N 3.03Å
1260	R	76.7	Confident	67.6	Low	57 Å²	57	59 Å²	59	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-32.2	-179.6	-84	-178.7	-77.3	132.9	-3.2	113.2	R536 E1255 S1256 Q1264	R536-R1260 PolarHBondContact O-NH1 3.45Å; E1255-R1260 PolarHBondContact O-NE 3.47Å; E1255-R1260 PolarHBondContact O-NH2 3.42Å; S1256-R1260 PolarHBondContact O-N 3.12Å; R1260-Q1264 WeakPolarHBondContact O-CB 3.49Å; R1260-Q1264 VanDerWaalsContact O-CG 3.23Å; R1260-Q1264 WeakPolarHBondContact O-CG 3.47Å; R1260-Q1264 PolarHBondContact O-N 2.76Å
1261	R	64.2	Low	65.3	Low	39 Å²	39	58.6 Å²	58.6	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-78.5	-33.9	171.2	-89.9	176.9	-68.7	-163.5	-22.2	114.7	G1257 I1258 Y1259 I1263 Q1264 R1265 D1287 D1289	G1257-R1261 PolarHBondContact O-N 3.31Å; G1257-R1261 PolarHBondContact O-NE 3.26Å; G1257-R1261 PolarHBondContact O-NH2 2.77Å; I1258-R1261 PolarHBondContact O-N 2.89Å; Y1259-R1261 PolarHBondContact O-N 3.49Å; R1261-I1263 VanDerWaalsContact C-N 3.26Å; R1261-I1263 PolarHBondContact O-N 3.36Å; R1261-Q1264 PolarHBondContact O-N 3Å; R1261-R1265 WeakPolarHBondContact O-CB 3.32Å; R1261-R1265 WeakPolarHBondContact O-CG 3.34Å; R1261-R1265 PolarHBondContact O-N 3.35Å; R1261-D1287 VanDerWaalsContact CD-OD1 3.23Å; R1261-D1287 WeakPolarHBondContact CD-OD1 3.33Å; R1261-D1287 PolarHBondContact NH1-O 3.48Å; R1261-D1287 IonicContact NH1-OD1 2.71Å; R1261-D1289 IonicContact CZ-OD2 3.5Å; R1261-D1289 VanDerWaalsContact CZ-OD2 3.24Å; R1261-D1289 IonicContact NH1-OD1 2.67Å; R1261-D1289 PolarHBondContact NH1-OD1 2.87Å; R1261-D1289 IonicContact NH1-OD2 3.82Å; R1261-D1289 PolarHBondContact NH1-OD2 2.92Å; R1261-D1289 VanDerWaalsContact NH2-CB 3.25Å; R1261-D1289 IonicContact NH2-OD2 3.56Å; R1261-D1289 PolarHBondContact NH2-OD2 3.22Å
1262	A	68.9	Low	63.3	Low	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-43.7	172	0	0	0	0	0	110.1	I1229 I1258 Y1259 R1265 I1266	I1229-A1262 HydrophobicContact CB-CB 4.19Å; I1229-A1262 HydrophobicContact CG2-CB 3.78Å; I1258-A1262 WeakPolarHBondContact O-CB 2.94Å; I1258-A1262 PolarHBondContact O-N 2.78Å; Y1259-A1262 WeakPolarHBondContact O-CB 2.98Å; Y1259-A1262 PolarHBondContact O-N 2.87Å; A1262-R1265 PolarHBondContact O-N 2.77Å; A1262-I1266 WeakPolarHBondContact O-CG1 2.88Å; A1262-I1266 PolarHBondContact O-N 3.31Å; A1262-I1266 VanDerWaalsContact O-N 3.14Å
1263	I	78.8	Confident	61.3	Low	37 Å²	37	59.9 Å²	59.9	19%	0.19	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-49	171.9	-59.3	-54.2	0	0	0	111.5	I1245 Y1259 R1261 R1265 I1266 D1267	I1245-I1263 HydrophobicContact CD1-CD1 4.18Å; I1245-I1263 HydrophobicContact CG1-CD1 4.12Å; Y1259-I1263 HydrophobicContact CD1-CG1 4.05Å; Y1259-I1263 HydrophobicContact CE1-CD1 4.29Å; Y1259-I1263 HydrophobicContact CE1-CG1 3.54Å; Y1259-I1263 HydrophobicContact CE2-CD1 4.08Å; Y1259-I1263 HydrophobicContact CE2-CG1 4.1Å; Y1259-I1263 WeakPolarHBondContact O-CG1 3.45Å; Y1259-I1263 PolarHBondContact O-N 3.03Å; R1261-I1263 VanDerWaalsContact C-N 3.26Å; R1261-I1263 PolarHBondContact O-N 3.36Å; I1263-R1265 PolarHBondContact O-N 2.82Å; I1263-I1266 HydrophobicContact CD1-CD1 4.17Å; I1263-I1266 CarbonylContact O-C 3.59Å; I1263-I1266 WeakPolarHBondContact O-CA 3.08Å; I1263-I1266 WeakPolarHBondContact O-CB 3.39Å; I1263-I1266 PolarHBondContact O-N 2.83Å; I1263-D1267 PolarHBondContact O-N 3.43Å
1264	Q	72.3	Confident	59.5	Low	74 Å²	74	66.3 Å²	66.3	35%	0.346	36%	0.358	S	S	.	.	H	α-helix	trans	-59.6	-29.6	176.3	-74.7	170.4	-5.4	0	0	113.8	R1260 R1261 R1268	R1260-Q1264 WeakPolarHBondContact O-CB 3.49Å; R1260-Q1264 VanDerWaalsContact O-CG 3.23Å; R1260-Q1264 WeakPolarHBondContact O-CG 3.47Å; R1260-Q1264 PolarHBondContact O-N 2.76Å; R1261-Q1264 PolarHBondContact O-N 3Å; Q1264-R1268 VanDerWaalsContact O-CB 3.27Å; Q1264-R1268 WeakPolarHBondContact O-CB 3.44Å; Q1264-R1268 WeakPolarHBondContact O-CG 3.28Å; Q1264-R1268 PolarHBondContact O-N 2.78Å
1265	R	63.3	Low	57.5	Low	63 Å²	63	68.8 Å²	68.8	24%	0.238	38%	0.378	C	S	.	.	H	α-helix	trans	-70.3	-36.6	172.9	-79.4	172.2	162.4	-166	-14.6	111.8	N1230 R1261 A1262 I1263 G1269 S1284	N1230-R1265 PolarHBondContact OD1-NH1 2.78Å; R1261-R1265 WeakPolarHBondContact O-CB 3.32Å; R1261-R1265 WeakPolarHBondContact O-CG 3.34Å; R1261-R1265 PolarHBondContact O-N 3.35Å; A1262-R1265 PolarHBondContact O-N 2.77Å; I1263-R1265 PolarHBondContact O-N 2.82Å; R1265-G1269 WeakPolarHBondContact O-CA 3.41Å; R1265-G1269 PolarHBondContact O-N 3.16Å; R1265-S1284 PolarHBondContact NH2-O 3.4Å
1266	I	71.9	Confident	56	Low	52 Å²	52	69.2 Å²	69.2	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-65.7	-48	170.5	-64.4	160.7	0	0	0	110	I1229 L1233 L1241 I1245 A1262 I1263 R1268 G1269	I1229-I1266 HydrophobicContact CG2-CD1 3.92Å; L1233-I1266 HydrophobicContact CD1-CD1 4.25Å; L1233-I1266 HydrophobicContact CD1-CG1 3.92Å; L1233-I1266 HydrophobicContact CD2-CG1 3.93Å; L1233-I1266 HydrophobicContact CG-CG1 4.28Å; L1241-I1266 HydrophobicContact CD1-CD1 4.24Å; L1241-I1266 HydrophobicContact CD2-CD1 4.2Å; I1245-I1266 HydrophobicContact CD1-CD1 3.85Å; A1262-I1266 WeakPolarHBondContact O-CG1 2.88Å; A1262-I1266 PolarHBondContact O-N 3.31Å; A1262-I1266 VanDerWaalsContact O-N 3.14Å; I1263-I1266 HydrophobicContact CD1-CD1 4.17Å; I1263-I1266 CarbonylContact O-C 3.59Å; I1263-I1266 WeakPolarHBondContact O-CA 3.08Å; I1263-I1266 WeakPolarHBondContact O-CB 3.39Å; I1263-I1266 PolarHBondContact O-N 2.83Å; I1266-R1268 PolarHBondContact O-N 3.39Å; I1266-G1269 PolarHBondContact O-N 3.29Å
1267	D	67.2	Low	54.3	Low	104 Å²	104	74.5 Å²	74.5	56%	0.556	41%	0.412	S	S	*	.	H	α-helix	trans	-63.3	-38.9	-178.9	-64	-26.2	0	0	0	112.6	I1263 G1269	I1263-D1267 PolarHBondContact O-N 3.43Å; D1267-G1269 VanDerWaalsContact C-N 3.34Å
1268	R	54.1	Low	52.5	Low	193 Å²	193	76 Å²	76	73%	0.728	43%	0.429	S	S	*	.	H	α-helix	trans	-76	-21.8	173.8	-71.2	173.1	-179.4	178.9	2.5	113	Q1264 I1266 S1270	Q1264-R1268 VanDerWaalsContact O-CB 3.27Å; Q1264-R1268 WeakPolarHBondContact O-CB 3.44Å; Q1264-R1268 WeakPolarHBondContact O-CG 3.28Å; Q1264-R1268 PolarHBondContact O-N 2.78Å; I1266-R1268 PolarHBondContact O-N 3.39Å; R1268-S1270 VanDerWaalsContact C-N 3.34Å; R1268-S1270 PolarHBondContact O-N 2.98Å
1269	G	49.1	Very low	50.9	Low	43 Å²	43	81.5 Å²	81.5	44%	0.443	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	19.4	-173.2	0	0	0	0	0	114.9	R1265 I1266 D1267 I1271	R1265-G1269 WeakPolarHBondContact O-CA 3.41Å; R1265-G1269 PolarHBondContact O-N 3.16Å; I1266-G1269 PolarHBondContact O-N 3.29Å; D1267-G1269 VanDerWaalsContact C-N 3.34Å; G1269-I1271 PolarHBondContact O-N 2.75Å
1270	S	37.4	Very low	48.7	Very low	102 Å²	102	86.2 Å²	86.2	71%	0.713	48%	0.483	S	S	*	.			trans	-71.7	27.5	-171	74.6	0	0	0	0	115.8	R1268	R1268-S1270 VanDerWaalsContact C-N 3.34Å; R1268-S1270 PolarHBondContact O-N 2.98Å
1271	I	34.5	Very low	46.5	Very low	148 Å²	148	86.5 Å²	86.5	76%	0.759	50%	0.498	S	S	*	.			trans	-132.4	78	169	-52	-179.3	0	0	0	108.1	G1269 S1273	G1269-I1271 PolarHBondContact O-N 2.75Å; I1271-S1273 PolarHBondContact O-N 3.34Å
1272	V	33.6	Very low	44.8	Very low	131 Å²	131	90.1 Å²	90.1	79%	0.794	52%	0.516	S	S	*	.			trans	-72.7	110.6	169.9	178.6	0	0	0	0	108.2
1273	S	32.1	Very low	42.9	Very low	61 Å²	61	96.3 Å²	96.3	43%	0.427	55%	0.549	S	S	.	.			trans	-133.5	126.5	168.8	64.3	0	0	0	0	110.3	I1271 S1275 A1276	I1271-S1273 PolarHBondContact O-N 3.34Å; S1273-S1275 PolarHBondContact O-N 3.36Å; S1273-A1276 PolarHBondContact O-N 2.85Å; S1273-A1276 VanDerWaalsContact O-N 3.14Å
1274	D	33.5	Very low	40.6	Very low	139 Å²	139	96.8 Å²	96.8	74%	0.743	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-10.9	-161.7	-61.6	-51.4	0	0	0	116.6
1275	S	31.8	Very low	38.6	Very low	110 Å²	110	96.4 Å²	96.4	77%	0.769	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-14.9	178	55.8	0	0	0	0	114.8	S1273 I1277	S1273-S1275 PolarHBondContact O-N 3.36Å; S1275-I1277 VanDerWaalsContact C-N 3.34Å
1276	A	32.9	Very low	36.9	Very low	36 Å²	36	98.9 Å²	98.9	30%	0.298	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-82.2	-10.1	-176.7	0	0	0	0	0	114.2	S1273 G1278 N1279 L1280	S1273-A1276 PolarHBondContact O-N 2.85Å; S1273-A1276 VanDerWaalsContact O-N 3.14Å; A1276-G1278 PolarHBondContact O-N 3.38Å; A1276-G1278 VanDerWaalsContact O-N 3.11Å; A1276-N1279 PolarHBondContact O-N 2.83Å; A1276-L1280 HydrophobicContact CB-CD1 4.07Å; A1276-L1280 HydrophobicContact CB-CG 4.38Å; A1276-L1280 WeakPolarHBondContact O-CG 3.45Å; A1276-L1280 PolarHBondContact O-N 2.89Å
1277	I	32.4	Very low	34.8	Very low	122 Å²	122	99 Å²	99	63%	0.626	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-63.7	-22.8	-168	-59	175.3	0	0	0	112.8	S1275	S1275-I1277 VanDerWaalsContact C-N 3.34Å
1278	G	29.4	Very low	33.2	Very low	61 Å²	61	99 Å²	99	63%	0.629	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-78.2	-29	173	0	0	0	0	0	115.2	A1276	A1276-G1278 PolarHBondContact O-N 3.38Å; A1276-G1278 VanDerWaalsContact O-N 3.11Å
1279	N	29.5	Very low	31.9	Very low	126 Å²	126	92.7 Å²	92.7	67%	0.674	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-21.1	-173	-66.7	-2.4	0	0	0	112.8	A1276 A1281 E1282	A1276-N1279 PolarHBondContact O-N 2.83Å; N1279-A1281 PolarHBondContact O-N 3.27Å; N1279-E1282 PolarHBondContact O-N 2.88Å; N1279-E1282 VanDerWaalsContact O-N 3.08Å
1280	L	30.1	Very low	31	Very low	112 Å²	112	92 Å²	92	59%	0.586	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.2	176.5	-72.3	165.3	0	0	0	114	A1276	A1276-L1280 HydrophobicContact CB-CD1 4.07Å; A1276-L1280 HydrophobicContact CB-CG 4.38Å; A1276-L1280 WeakPolarHBondContact O-CG 3.45Å; A1276-L1280 PolarHBondContact O-N 2.89Å
1281	A	29.5	Very low	30.5	Very low	63 Å²	63	91.3 Å²	91.3	52%	0.521	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-30.6	170.8	0	0	0	0	0	112.9	N1279 S1284	N1279-A1281 PolarHBondContact O-N 3.27Å; A1281-S1284 PolarHBondContact O-OG 3.24Å
1282	E	29.2	Very low	30.2	Very low	115 Å²	115	87 Å²	87	54%	0.537	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-41.7	-172	-58.6	-158.2	128.7	0	0	112.5	N1279 S1284 N1285	N1279-E1282 PolarHBondContact O-N 2.88Å; N1279-E1282 VanDerWaalsContact O-N 3.08Å; E1282-S1284 PolarHBondContact O-N 3.28Å; E1282-N1285 PolarHBondContact O-ND2 3.12Å
1283	D	28.5	Very low	30.1	Very low	130 Å²	130	84.7 Å²	84.7	70%	0.695	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-73.1	-6.3	175.1	-72.1	-27.6	0	0	0	113.8	N1285	D1283-N1285 PolarHBondContact O-N 2.73Å; D1283-N1285 VanDerWaalsContact O-N 3.16Å
1284	S	30	Very low	29.8	Very low	48 Å²	48	85 Å²	85	34%	0.336	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-63.2	-19.4	175.5	73.2	0	0	0	0	113.4	R1265 A1281 E1282 E1286	R1265-S1284 PolarHBondContact NH2-O 3.4Å; A1281-S1284 PolarHBondContact O-OG 3.24Å; E1282-S1284 PolarHBondContact O-N 3.28Å; S1284-E1286 PolarHBondContact O-N 2.67Å
1285	N	29.8	Very low	29.5	Very low	65 Å²	65	78.6 Å²	78.6	35%	0.348	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-82.6	-7.5	-167.5	-73.2	-71.9	0	0	0	116.6	R1060 E1282 D1283	R1060-N1285 VanDerWaalsContact CD-O 3.29Å; R1060-N1285 WeakPolarHBondContact CD-O 3.21Å; R1060-N1285 PolarHBondContact NH1-O 3.4Å; E1282-N1285 PolarHBondContact O-ND2 3.12Å; D1283-N1285 PolarHBondContact O-N 2.73Å; D1283-N1285 VanDerWaalsContact O-N 3.16Å
1286	E	28.4	Very low	29.3	Very low	115 Å²	115	73.5 Å²	73.5	54%	0.537	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-84.8	-23.1	-173.5	-63.8	-135.4	111.8	0	0	114.6	Q1057 S1284	Q1057-E1286 PolarHBondContact NE2-OE1 2.88Å; S1284-E1286 PolarHBondContact O-N 2.67Å
1287	D	28.5	Very low	29.1	Very low	55 Å²	55	74.4 Å²	74.4	29%	0.294	41%	0.41	S	S	.	.			trans	-123.6	18.8	-163.9	-95.9	-47	0	0	0	116.6	R1261 D1289	R1261-D1287 VanDerWaalsContact CD-OD1 3.23Å; R1261-D1287 WeakPolarHBondContact CD-OD1 3.33Å; R1261-D1287 PolarHBondContact NH1-O 3.48Å; R1261-D1287 IonicContact NH1-OD1 2.71Å; D1287-D1289 PolarHBondContact O-N 2.82Å; D1287-D1289 VanDerWaalsContact O-N 3.07Å
1288	E	32.4	Very low	29.1	Very low	103 Å²	103	68.7 Å²	68.7	48%	0.481	38%	0.381	S	S	.	.			trans	-78.2	81.1	169	-71.4	-160.9	157.1	0	0	112.4	R1060 L1290	R1060-E1288 PolarHBondContact NH2-O 3.45Å; E1288-L1290 VanDerWaalsContact C-N 3.25Å; E1288-L1290 PolarHBondContact O-N 3.43Å; E1288-L1290 VanDerWaalsContact O-N 3.07Å
1289	D	26.3	Very low	29.1	Very low	61 Å²	61	69.6 Å²	69.6	33%	0.326	37%	0.374	S	S	.	.			trans	-77.8	85.7	155.8	-63.9	-4.1	0	0	0	108.9	Y1089 I1258 R1261 D1287 I1291	Y1089-D1289 VanDerWaalsContact CE2-OD1 3.24Å; Y1089-D1289 WeakPolarHBondContact CE2-OD1 3.27Å; Y1089-D1289 PolarHBondContact OH-OD1 3.31Å; I1258-D1289 WeakPolarHBondContact CG1-O 3.23Å; R1261-D1289 IonicContact CZ-OD2 3.5Å; R1261-D1289 VanDerWaalsContact CZ-OD2 3.24Å; R1261-D1289 IonicContact NH1-OD1 2.67Å; R1261-D1289 PolarHBondContact NH1-OD1 2.87Å; R1261-D1289 IonicContact NH1-OD2 3.82Å; R1261-D1289 PolarHBondContact NH1-OD2 2.92Å; R1261-D1289 VanDerWaalsContact NH2-CB 3.25Å; R1261-D1289 IonicContact NH2-OD2 3.56Å; R1261-D1289 PolarHBondContact NH2-OD2 3.22Å; D1287-D1289 PolarHBondContact O-N 2.82Å; D1287-D1289 VanDerWaalsContact O-N 3.07Å; D1289-I1291 PolarHBondContact O-N 3.33Å
1290	L	30.5	Very low	29.1	Very low	28 Å²	28	70.4 Å²	70.4	15%	0.147	37%	0.367	C	S	.	.			trans	-74	112.2	157.7	-90.3	144	0	0	0	108.8	M1191 Y1227 E1288 V1292	M1191-L1290 HydrophobicContact CE-CD2 4.45Å; M1191-L1290 HydrophobicContact SD-CD1 4.14Å; M1191-L1290 HydrophobicContact SD-CD2 3.7Å; Y1227-L1290 HydrophobicContact CE1-CD1 4.49Å; Y1227-L1290 HydrophobicContact CE1-CD2 3.83Å; Y1227-L1290 HydrophobicContact CE1-CG 3.9Å; Y1227-L1290 HydrophobicContact CE2-CD2 4.24Å; Y1227-L1290 VanDerWaalsContact CZ-CD2 3.46Å; Y1227-L1290 WeakPolarHBondContact OH-CD2 3.33Å; Y1227-L1290 WeakPolarHBondContact OH-CG 3.37Å; E1288-L1290 VanDerWaalsContact C-N 3.25Å; E1288-L1290 PolarHBondContact O-N 3.43Å; E1288-L1290 VanDerWaalsContact O-N 3.07Å; L1290-V1292 PolarHBondContact O-N 3.04Å; L1290-V1292 VanDerWaalsContact O-N 3.15Å
1291	I	28.3	Very low	29	Very low	88 Å²	88	70 Å²	70	45%	0.451	36%	0.363	S	S	.	.			trans	-27	110.3	174.8	-59.2	163.7	0	0	0	112	I1258 D1289	I1258-I1291 HydrophobicContact CD1-CD1 4.04Å; I1258-I1291 HydrophobicContact CD1-CG1 4.1Å; D1289-I1291 PolarHBondContact O-N 3.33Å
1292	V	27.8	Very low	28.8	Very low	58 Å²	58	75 Å²	75	35%	0.352	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-97.2	121	157.5	178.6	0	0	0	0	106.7	R1088 L1290 K1294	R1088-V1292 HydrophobicContact CB-CG1 3.83Å; R1088-V1292 HydrophobicContact CB-CG2 3.88Å; R1088-V1292 HydrophobicContact CG-CG1 4.47Å; R1088-V1292 VanDerWaalsContact O-CG2 3.3Å; R1088-V1292 WeakPolarHBondContact O-CG2 3.3Å; L1290-V1292 PolarHBondContact O-N 3.04Å; L1290-V1292 VanDerWaalsContact O-N 3.15Å; V1292-K1294 PolarHBondContact O-N 3.31Å; V1292-K1294 VanDerWaalsContact O-N 3.14Å
1293	D	31.3	Very low	28.7	Very low	83 Å²	83	80.3 Å²	80.3	44%	0.444	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-56.8	119.2	179.6	-63.2	-67.6	0	0	0	111.5	E1295	D1293-E1295 PolarHBondContact O-N 2.88Å
1294	K	24.7	Very low	28.7	Very low	66 Å²	66	77.8 Å²	77.8	29%	0.287	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-59.1	117.9	137.9	-54.8	149.6	178.6	167	0	103.8	W465 K502 N503 V1292	W465-K1294 HydrophobicContact CH2-CB 4.01Å; W465-K1294 HydrophobicContact CH2-CG 4.4Å; W465-K1294 HydrophobicContact CZ2-CB 4.47Å; W465-K1294 HydrophobicContact CZ3-CB 4.18Å; K502-K1294 HydrophobicContact CD-CD 4.37Å; N503-K1294 PolarHBondContact OD1-NZ 3.31Å; V1292-K1294 PolarHBondContact O-N 3.31Å; V1292-K1294 VanDerWaalsContact O-N 3.14Å
1295	E	28.4	Very low	28.6	Very low	5 Å²	5	79.4 Å²	79.4	2%	0.023	39%	0.393	C	S	.	.			trans	-179.4	148.9	139	-77.8	-118.3	148.7	0	0	114	C434 D464 W465 F466 W467 S468 H469 D1293	C434-E1295 PolarHBondContact SG-O 3.44Å; D464-E1295 WeakPolarHBondContact O-CA 2.99Å; D464-E1295 WeakPolarHBondContact O-CG 2.85Å; W465-E1295 WeakPolarHBondContact CA-OE1 3.45Å; W465-E1295 VanDerWaalsContact CE3-N 3.27Å; W465-E1295 VanDerWaalsContact N-CD 3.34Å; W465-E1295 PolarHBondContact N-OE1 3.33Å; F466-E1295 WeakPolarHBondContact CA-OE2 3.35Å; F466-E1295 PolarHBondContact N-OE1 3.2Å; F466-E1295 VanDerWaalsContact N-OE1 3.12Å; F466-E1295 PolarHBondContact N-OE2 2.91Å; W467-E1295 PolarHBondContact N-OE1 3.06Å; W467-E1295 VanDerWaalsContact N-OE1 3.13Å; W467-E1295 PolarHBondContact N-OE2 3.42Å; W467-E1295 VanDerWaalsContact N-OE2 3.14Å; S468-E1295 VanDerWaalsContact CA-CD 3.43Å; S468-E1295 VanDerWaalsContact CB-CD 3.48Å; S468-E1295 VanDerWaalsContact CB-CG 3.48Å; S468-E1295 WeakPolarHBondContact CB-OE1 3.04Å; S468-E1295 PolarHBondContact N-OE1 3.49Å; S468-E1295 PolarHBondContact N-OE2 3.49Å; S468-E1295 VanDerWaalsContact OG-CG 3.28Å; S468-E1295 WeakPolarHBondContact OG-CG 3.23Å; S468-E1295 PolarHBondContact OG-OE1 3.44Å; H469-E1295 HydrophobicContact CB-CB 4.26Å; H469-E1295 WeakPolarHBondContact CB-OE2 3.35Å; H469-E1295 IonicContact CG-OE2 3.14Å; H469-E1295 PolarHBondContact N-OE2 3.08Å; H469-E1295 VanDerWaalsContact ND1-CB 3.33Å; H469-E1295 WeakPolarHBondContact ND1-CB 3.46Å; D1293-E1295 PolarHBondContact O-N 2.88Å
1296	A	28.4	Very low	28.5	Very low	3 Å²	3	80.2 Å²	80.2	3%	0.025	40%	0.395	C	S	.	.			trans	73.6	84.2	-155.4	0	0	0	0	0	122.6	W430 I433 C434 W465	W430-A1296 HydrophobicContact CB-CB 3.71Å; W430-A1296 VanDerWaalsContact CB-O 3.26Å; W430-A1296 WeakPolarHBondContact CB-O 3.17Å; W430-A1296 VanDerWaalsContact CD2-O 3.26Å; W430-A1296 HydrophobicContact CG-CB 4.35Å; W430-A1296 WeakPolarHBondContact O-CB 3.27Å; I433-A1296 HydrophobicContact CB-CB 3.73Å; I433-A1296 HydrophobicContact CG2-CB 3.97Å; C434-A1296 HydrophobicContact CB-CB 4.38Å; C434-A1296 WeakPolarHBondContact SG-CB 3.17Å; W465-A1296 VanDerWaalsContact CA-N 3.27Å; W465-A1296 VanDerWaalsContact CB-CA 3.44Å; W465-A1296 VanDerWaalsContact CE3-C 3.44Å; W465-A1296 PolarHBondContact O-N 3.19Å
1297	I	28.1	Very low	28.6	Very low	55 Å²	55	78.1 Å²	78.1	28%	0.282	39%	0.387	S	S	.	.			trans	-148.1	115	164.8	-63.5	-174.1	0	0	0	114.3	W430 T460 T461 W465	W430-I1297 HydrophobicContact CD2-CB 4.27Å; W430-I1297 HydrophobicContact CD2-CG1 4.08Å; W430-I1297 HydrophobicContact CE3-CB 4.41Å; W430-I1297 HydrophobicContact CE3-CG1 3.76Å; W430-I1297 HydrophobicContact CH2-CB 3.79Å; W430-I1297 HydrophobicContact CH2-CD1 4.02Å; W430-I1297 HydrophobicContact CH2-CG1 3.56Å; W430-I1297 HydrophobicContact CH2-CG2 3.56Å; W430-I1297 VanDerWaalsContact CZ2-CA 3.45Å; W430-I1297 HydrophobicContact CZ2-CB 3.63Å; W430-I1297 HydrophobicContact CZ2-CG1 3.9Å; W430-I1297 HydrophobicContact CZ2-CG2 3.42Å; W430-I1297 VanDerWaalsContact CZ2-CG2 3.42Å; W430-I1297 HydrophobicContact CZ3-CB 4.21Å; W430-I1297 HydrophobicContact CZ3-CD1 4Å; W430-I1297 HydrophobicContact CZ3-CG1 3.52Å; W430-I1297 HydrophobicContact CZ3-CG2 4.42Å; T460-I1297 CarbonylContact C-O 3.56Å; T460-I1297 VanDerWaalsContact CB-O 3.23Å; T460-I1297 WeakPolarHBondContact CB-O 3.43Å; T460-I1297 PolarHBondContact OG1-O 3.49Å; T461-I1297 PolarHBondContact N-O 3.46Å; W465-I1297 HydrophobicContact CD2-CB 3.55Å; W465-I1297 HydrophobicContact CD2-CD1 4.3Å; W465-I1297 HydrophobicContact CD2-CG1 3.7Å; W465-I1297 VanDerWaalsContact CD2-N 3.31Å; W465-I1297 HydrophobicContact CE3-CB 3.99Å; W465-I1297 HydrophobicContact CE3-CD1 4.13Å; W465-I1297 HydrophobicContact CE3-CG1 3.59Å; W465-I1297 HydrophobicContact CG-CB 3.72Å; W465-I1297 HydrophobicContact CG-CG1 4.37Å; W465-I1297 HydrophobicContact CH2-CD1 3.76Å; W465-I1297 HydrophobicContact CH2-CG1 4.17Å; W465-I1297 HydrophobicContact CZ2-CB 4.31Å; W465-I1297 HydrophobicContact CZ2-CD1 3.72Å; W465-I1297 HydrophobicContact CZ2-CG1 4.09Å; W465-I1297 HydrophobicContact CZ3-CD1 3.91Å; W465-I1297 HydrophobicContact CZ3-CG1 3.87Å
1298	P	31.1	Very low	28.6	Very low	3 Å²	3	79.6 Å²	79.6	2%	0.019	39%	0.393	C	S	.	.				-142.1	154.7	115.8	15.2	6.8	0	0	0	120.1	P426 Q427 W430 T458 T460 T461	P426-P1298 CarbonylContact C-O 3.53Å; P426-P1298 HydrophobicContact CB-CB 4.25Å; P426-P1298 HydrophobicContact CB-CG 3.81Å; P426-P1298 VanDerWaalsContact CB-O 3.22Å; P426-P1298 WeakPolarHBondContact CB-O 3.42Å; P426-P1298 HydrophobicContact CG-CG 4.42Å; Q427-P1298 WeakPolarHBondContact CG-O 3.18Å; Q427-P1298 PolarHBondContact N-O 3.39Å; W430-P1298 WeakPolarHBondContact CZ2-O 3.45Å; W430-P1298 PolarHBondContact NE1-O 3.41Å; T458-P1298 HydrophobicContact CG2-CB 3.77Å; T458-P1298 HydrophobicContact CG2-CG 3.9Å; T458-P1298 WeakPolarHBondContact OG1-CB 3.45Å; T458-P1298 WeakPolarHBondContact OG1-CG 3.49Å; T460-P1298 WeakPolarHBondContact OG1-CB 3.48Å; T461-P1298 HydrophobicContact CG2-CG 4.33Å; T461-P1298 WeakPolarHBondContact OG1-CD 3.2Å; T461-P1298 WeakPolarHBondContact OG1-CG 3.5Å
1299	V	29.7	Very low	28.3	Very low	80 Å²	80	78 Å²	78	49%	0.485	39%	0.387	S	S	.	.			trans	-37.2	152.4	164.1	178.9	0	0	0	0	119.3	P426	P426-V1299 WeakPolarHBondContact CD-O 3.34Å; P426-V1299 WeakPolarHBondContact CG-O 3.32Å
1300	R	30.7	Very low	28.4	Very low	143 Å²	143	79.2 Å²	79.2	54%	0.54	39%	0.391	S	S	.	.				-175.4	121.2	123.8	-103.5	175.9	-172.3	-161.4	0.2	119.7	R425	R425-R1300 WeakPolarHBondContact CD-O 3.24Å; R425-R1300 WeakPolarHBondContact CG-O 3.3Å; R425-R1300 PolarHBondContact NE-O 3.42Å
1301	E	26.6	Very low	28.3	Very low	104 Å²	104	83.2 Å²	83.2	49%	0.486	41%	0.41	S	S	.	.			trans	-64.6	151.9	171.9	-53.1	112.7	136.3	0	0	114.6
1302	K	25.6	Very low	28.3	Very low	168 Å²	168	82.8 Å²	82.8	73%	0.73	41%	0.406	S	S	*	.				-168.6	139	129.4	-106.2	177.3	-178.3	-172.9	0	110
1303	N	26.9	Very low	28.3	Very low	225 Å²	225	85 Å²	85	100%	1.203	41%	0.411	S	S	*	.			trans	66	0	-163.6	-60.9	-0	0	0	0	114.5

Retrieved 1,303 of 1,303 residues in 4032.3 ms (Link to these results)

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