A0A077Z9W0_TRITR Loading...

FATC domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9W0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 955 aa.

						>A0A077Z9W0_TRITR|A0A077Z9W0
MLRCKSATLLKLFDAFIYDPLIDWTTGYPGDGHGTVVQNIIYALHPSSFNMHQYKEAAFQLKKQLFCLYCRDALVQWNCYNERLWNALEAYRDSVMKVSVAESAIEEIEKELQLLRDRNIYLAEAKGDINHPIFTLSQRFGQYRSIDAKSGQLLARLKATSQFYDHLVNSYECDNLKNSLLLTYQNLRHLLASTMELMPAYIELQRYMPVEFRNSYFVRKWLKLINDAIEVKSTNDSKKLEVECNDLLNEDSLRIKDASASEQAQKSCHSVEAAFSTVSERSAKLPVKDFSNSFLELSLCHIYSTSSDFLKVHVMKIVREKLLYVLEKVMDFNEHRTASSFREFDPDFELKDMVVIMKHIKAAQQFLNVIQSETFSSVVALVQCFERVFNQLLHLIRELTLEVIPELFGVAAVNRGAIVKLLDLLMHFNTSSAVTWDSLYDDLVVSKIVVCVKNPLYISTLQSQASCLFQENLPEGLEPIQPVVKQILDQYSMLETVILDLISLVTEAEQSDQFKIRNKNDSDLFTPIVADSSFYSTLFLCRYYATYLAFSGVLACSDFLRGFNSPDSFLDVFIQFPKLVVFTLLRQVLYGLASHVLYVVKTNVEERSTPLETEASSAAFKLLEELYRNVLSKWDVKCKQRIALTFGEGLSVVHNVSFAFRWCNRGVVPIDRFVHSELLLQLRKLDQSLAEVVPSLQGSLESLTHFSGEMFSRLNWAAGANKVWTSHLESFKHAVIVDKQKIENTMNTCRQLNLYLNAVISMETLPREADGTLSGNAETVRLVLNYIEISSVLNFEYSKLSQLELKLSNVLPFCSAKDPSRDWLVSLMAKTDQEIEEMNIKRDQSILRFSEAIKSADVYLDSVRAEFSNFFEHTAEISSVVKNFAKLEDNELFGKLHDFVRLCRFHAETAVSIVKSGQMLRNSISMWSKEVNNLLKKARDVDNLALMYEGWTAWV
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.1	Very low	42.6	Very low	189 Å²	189	122.9 Å²	122.9	93%	0.931	63%	0.628	S	S	*	*				0	-49.7	0	-127.3	-175.4	-170.1	0	0	113.2	C4 K5	M1-C4 PolarHBondContact O-N 3.35Å; M1-K5 WeakPolarHBondContact O-CG 3.35Å; M1-K5 PolarHBondContact O-N 3.33Å
2	L	29.4	Very low	43.2	Very low	154 Å²	154	120.3 Å²	120.3	81%	0.806	62%	0.616	S	S	*	*	H	α-helix	trans	-63.2	-40	178.5	-88.2	142.6	0	0	0	114.7	K5 S6	L2-K5 PolarHBondContact O-N 2.99Å; L2-S6 WeakPolarHBondContact O-CB 3.39Å; L2-S6 PolarHBondContact O-N 3.32Å
3	R	37.6	Very low	43.7	Very low	230 Å²	230	115.3 Å²	115.3	87%	0.868	59%	0.587	S	S	*	*	H	α-helix	trans	-63.7	-42.9	174.1	-86.2	-174.9	176.2	175.4	-1.4	113.5	S6 A7	R3-S6 PolarHBondContact O-N 2.96Å; R3-A7 WeakPolarHBondContact O-CB 3.29Å; R3-A7 PolarHBondContact O-N 2.97Å
4	C	37	Very low	44.2	Very low	92 Å²	92	113.4 Å²	113.4	62%	0.622	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-40.4	173.9	-72.6	0	0	0	0	111.8	M1 S6 A7 T8	M1-C4 PolarHBondContact O-N 3.35Å; C4-S6 VanDerWaalsContact C-N 3.35Å; C4-S6 PolarHBondContact O-N 3.45Å; C4-A7 PolarHBondContact O-N 2.9Å; C4-T8 WeakPolarHBondContact O-CB 3.27Å; C4-T8 PolarHBondContact O-N 3.48Å; C4-T8 PolarHBondContact O-OG1 3.47Å
5	K	34.8	Very low	44.8	Very low	134 Å²	134	109.7 Å²	109.7	58%	0.583	57%	0.573	S	S	*	*	H	α-helix	trans	-64.2	-38.5	175.8	-75.4	-174.2	175.9	-173.2	0	112.1	M1 L2 L9	M1-K5 WeakPolarHBondContact O-CG 3.35Å; M1-K5 PolarHBondContact O-N 3.33Å; L2-K5 PolarHBondContact O-N 2.99Å; K5-L9 WeakPolarHBondContact O-CB 3.49Å; K5-L9 PolarHBondContact O-N 2.97Å
6	S	45.3	Very low	44.7	Very low	66 Å²	66	110.6 Å²	110.6	46%	0.462	57%	0.571	S	S	.	*	H	α-helix	trans	-65.8	-44.3	174.1	153.2	0	0	0	0	112.4	L2 R3 C4 L9 L10	L2-S6 WeakPolarHBondContact O-CB 3.39Å; L2-S6 PolarHBondContact O-N 3.32Å; R3-S6 PolarHBondContact O-N 2.96Å; C4-S6 VanDerWaalsContact C-N 3.35Å; C4-S6 PolarHBondContact O-N 3.45Å; S6-L9 PolarHBondContact O-N 3.22Å; S6-L10 PolarHBondContact O-N 3.38Å
7	A	48.4	Very low	44.9	Very low	50 Å²	50	107.5 Å²	107.5	41%	0.413	56%	0.555	S	S	.	*	H	α-helix	trans	-67.8	-37.4	177.3	0	0	0	0	0	112.7	R3 C4 K11	R3-A7 WeakPolarHBondContact O-CB 3.29Å; R3-A7 PolarHBondContact O-N 2.97Å; C4-A7 PolarHBondContact O-N 2.9Å; A7-K11 WeakPolarHBondContact O-CB 3.44Å; A7-K11 WeakPolarHBondContact O-CG 3.45Å; A7-K11 PolarHBondContact O-N 3.21Å
8	T	54.9	Low	44.9	Very low	83 Å²	83	108.7 Å²	108.7	51%	0.509	55%	0.552	S	S	.	*	H	α-helix	trans	-68.7	-38.8	173.8	-54.5	0	0	0	0	111.5	C4 K11 L12	C4-T8 WeakPolarHBondContact O-CB 3.27Å; C4-T8 PolarHBondContact O-N 3.48Å; C4-T8 PolarHBondContact O-OG1 3.47Å; T8-K11 PolarHBondContact O-N 3.03Å; T8-L12 HydrophobicContact CG2-CD1 4.16Å; T8-L12 WeakPolarHBondContact O-CB 3.39Å; T8-L12 WeakPolarHBondContact O-CG 3.39Å; T8-L12 PolarHBondContact O-N 3.01Å
9	L	45.6	Very low	44.9	Very low	96 Å²	96	105.9 Å²	105.9	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-63.2	-47.9	173.2	-107.1	146.8	0	0	0	111.3	K5 S6 K11 L12 F13	K5-L9 WeakPolarHBondContact O-CB 3.49Å; K5-L9 PolarHBondContact O-N 2.97Å; S6-L9 PolarHBondContact O-N 3.22Å; L9-K11 VanDerWaalsContact C-N 3.35Å; L9-K11 PolarHBondContact O-N 3.29Å; L9-L12 PolarHBondContact O-N 3.33Å; L9-F13 HydrophobicContact CD2-CD2 3.88Å; L9-F13 HydrophobicContact CD2-CE2 3.53Å; L9-F13 WeakPolarHBondContact O-CB 3.44Å; L9-F13 VanDerWaalsContact O-CD2 3.26Å; L9-F13 WeakPolarHBondContact O-CD2 3.35Å; L9-F13 PolarHBondContact O-N 2.7Å
10	L	51.3	Low	44.9	Very low	105 Å²	105	107 Å²	107	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-59.8	-44.2	175.6	-108.4	93	0	0	0	111.5	S6 L12 F13 D14	S6-L10 PolarHBondContact O-N 3.38Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 3.08Å; L10-F13 CarbonylContact O-C 3.57Å; L10-F13 WeakPolarHBondContact O-CB 3.45Å; L10-F13 PolarHBondContact O-N 3.02Å; L10-F13 VanDerWaalsContact O-N 3.15Å; L10-D14 WeakPolarHBondContact O-CB 3.43Å; L10-D14 PolarHBondContact O-N 2.87Å
11	K	59.5	Low	44.7	Very low	153 Å²	153	109.3 Å²	109.3	67%	0.665	57%	0.566	S	S	*	*	H	α-helix	trans	-63.2	-36.4	175.8	-78.6	-178.3	178.4	-173	0	113.1	A7 T8 L9 A15	A7-K11 WeakPolarHBondContact O-CB 3.44Å; A7-K11 WeakPolarHBondContact O-CG 3.45Å; A7-K11 PolarHBondContact O-N 3.21Å; T8-K11 PolarHBondContact O-N 3.03Å; L9-K11 VanDerWaalsContact C-N 3.35Å; L9-K11 PolarHBondContact O-N 3.29Å; K11-A15 WeakPolarHBondContact O-CB 3.37Å; K11-A15 PolarHBondContact O-N 3.48Å
12	L	49.3	Very low	45.5	Very low	91 Å²	91	103 Å²	103	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-39.9	173	-84.4	161.2	0	0	0	111	T8 L9 L10 A15 F16	T8-L12 HydrophobicContact CG2-CD1 4.16Å; T8-L12 WeakPolarHBondContact O-CB 3.39Å; T8-L12 WeakPolarHBondContact O-CG 3.39Å; T8-L12 PolarHBondContact O-N 3.01Å; L9-L12 PolarHBondContact O-N 3.33Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 3.08Å; L12-A15 PolarHBondContact O-N 3.24Å; L12-F16 HydrophobicContact CD2-CD2 4.16Å; L12-F16 HydrophobicContact CD2-CE2 4.16Å; L12-F16 WeakPolarHBondContact O-CB 3.32Å; L12-F16 PolarHBondContact O-N 3Å
13	F	49.4	Very low	46.3	Very low	56 Å²	56	99.4 Å²	99.4	25%	0.246	52%	0.516	C	S	.	.	H	α-helix	trans	-64	-43.4	173.9	-91.6	-77.6	0	0	0	111.6	L9 L10 F16 I17 Y18 L65	L9-F13 HydrophobicContact CD2-CD2 3.88Å; L9-F13 HydrophobicContact CD2-CE2 3.53Å; L9-F13 WeakPolarHBondContact O-CB 3.44Å; L9-F13 VanDerWaalsContact O-CD2 3.26Å; L9-F13 WeakPolarHBondContact O-CD2 3.35Å; L9-F13 PolarHBondContact O-N 2.7Å; L10-F13 CarbonylContact O-C 3.57Å; L10-F13 WeakPolarHBondContact O-CB 3.45Å; L10-F13 PolarHBondContact O-N 3.02Å; L10-F13 VanDerWaalsContact O-N 3.15Å; F13-F16 PolarHBondContact O-N 3.29Å; F13-I17 HydrophobicContact CD1-CB 4.25Å; F13-I17 HydrophobicContact CD1-CD1 3.32Å; F13-I17 HydrophobicContact CD1-CG1 3.59Å; F13-I17 HydrophobicContact CE1-CD1 3.3Å; F13-I17 HydrophobicContact CE1-CG1 4.07Å; F13-I17 WeakPolarHBondContact O-CA 3.32Å; F13-I17 VanDerWaalsContact O-CB 3.28Å; F13-I17 WeakPolarHBondContact O-CB 3.35Å; F13-I17 PolarHBondContact O-N 3.44Å; F13-Y18 PolarHBondContact O-N 2.82Å; F13-L65 HydrophobicContact CD1-CD1 4.2Å; F13-L65 HydrophobicContact CE1-CD1 3.73Å; F13-L65 HydrophobicContact CZ-CD1 4.21Å
14	D	50.8	Low	46.8	Very low	89 Å²	89	94 Å²	94	48%	0.476	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-43.1	173.1	-76.6	-16.1	0	0	0	112.3	L10 Y18	L10-D14 WeakPolarHBondContact O-CB 3.43Å; L10-D14 PolarHBondContact O-N 2.87Å; D14-Y18 WeakPolarHBondContact OD1-CD2 3.37Å
15	A	53.2	Low	46.9	Very low	58 Å²	58	94.9 Å²	94.9	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-74.1	-24	-179.7	0	0	0	0	0	114.1	K11 L12 D19	K11-A15 WeakPolarHBondContact O-CB 3.37Å; K11-A15 PolarHBondContact O-N 3.48Å; L12-A15 PolarHBondContact O-N 3.24Å; A15-D19 WeakPolarHBondContact O-CB 3.49Å
16	F	44.3	Very low	46.9	Very low	124 Å²	124	92.6 Å²	92.6	54%	0.544	50%	0.496	S	S	.	.	H	α-helix	trans	-115.2	-40.3	-175.5	-86.9	-87.7	0	0	0	114.8	L12 F13 I22 W24	L12-F16 HydrophobicContact CD2-CD2 4.16Å; L12-F16 HydrophobicContact CD2-CE2 4.16Å; L12-F16 WeakPolarHBondContact O-CB 3.32Å; L12-F16 PolarHBondContact O-N 3Å; F13-F16 PolarHBondContact O-N 3.29Å; F16-I22 HydrophobicContact CD1-CD1 4.15Å; F16-I22 WeakPolarHBondContact O-CD1 3.35Å; F16-W24 WeakPolarHBondContact O-CZ2 3.5Å
17	I	47.2	Very low	46.3	Very low	58 Å²	58	91.3 Å²	91.3	30%	0.297	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-34.4	-178.3	-60.5	-145.4	0	0	0	110.9	F13 W24	F13-I17 HydrophobicContact CD1-CB 4.25Å; F13-I17 HydrophobicContact CD1-CD1 3.32Å; F13-I17 HydrophobicContact CD1-CG1 3.59Å; F13-I17 HydrophobicContact CE1-CD1 3.3Å; F13-I17 HydrophobicContact CE1-CG1 4.07Å; F13-I17 WeakPolarHBondContact O-CA 3.32Å; F13-I17 VanDerWaalsContact O-CB 3.28Å; F13-I17 WeakPolarHBondContact O-CB 3.35Å; F13-I17 PolarHBondContact O-N 3.44Å; I17-W24 PolarHBondContact O-NE1 2.96Å
18	Y	45.7	Very low	45.6	Very low	129 Å²	129	99.2 Å²	99.2	51%	0.506	51%	0.514	S	S	.	.	S	Bend	trans	-100.4	4.6	-178.1	-63.4	-70.6	0	0	0	114.2	F13 D14 P20	F13-Y18 PolarHBondContact O-N 2.82Å; D14-Y18 WeakPolarHBondContact OD1-CD2 3.37Å; Y18-P20 VanDerWaalsContact O-CD 3.26Å; Y18-P20 WeakPolarHBondContact O-CD 3.47Å
19	D	45.2	Very low	45	Very low	55 Å²	55	101.7 Å²	101.7	29%	0.294	53%	0.532	S	S	.	.			trans	-67.2	115.8	171.8	-174.8	-15.7	0	0	0	110	A15 L21 I22	A15-D19 WeakPolarHBondContact O-CB 3.49Å; D19-L21 PolarHBondContact O-N 3.39Å; D19-L21 WeakPolarHBondContact OD1-CB 3.36Å; D19-L21 PolarHBondContact OD1-N 2.9Å; D19-I22 HydrophobicContact CB-CB 4.5Å; D19-I22 HydrophobicContact CB-CD1 3.94Å; D19-I22 HydrophobicContact CB-CG1 4Å; D19-I22 PolarHBondContact O-N 2.88Å
20	P	45	Very low	44.7	Very low	127 Å²	127	100.1 Å²	100.1	83%	0.825	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.8	-178.7	27.1	-33.8	0	0	0	114.1	Y18 I22	Y18-P20 VanDerWaalsContact O-CD 3.26Å; Y18-P20 WeakPolarHBondContact O-CD 3.47Å; P20-I22 VanDerWaalsContact C-N 3.3Å
21	L	40	Very low	43.8	Very low	157 Å²	157	102 Å²	102	82%	0.822	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-16.4	171.8	-65.5	171.6	0	0	0	112.6	D19 D23	D19-L21 PolarHBondContact O-N 3.39Å; D19-L21 WeakPolarHBondContact OD1-CB 3.36Å; D19-L21 PolarHBondContact OD1-N 2.9Å; L21-D23 PolarHBondContact O-N 3.06Å
22	I	42.6	Very low	42.9	Very low	56 Å²	56	98.7 Å²	98.7	29%	0.287	56%	0.558	S	S	.	*	S	Bend	trans	-91.8	90.6	177.6	-57.4	179.6	0	0	0	107.8	F16 D19 P20 W24	F16-I22 HydrophobicContact CD1-CD1 4.15Å; F16-I22 WeakPolarHBondContact O-CD1 3.35Å; D19-I22 HydrophobicContact CB-CB 4.5Å; D19-I22 HydrophobicContact CB-CD1 3.94Å; D19-I22 HydrophobicContact CB-CG1 4Å; D19-I22 PolarHBondContact O-N 2.88Å; P20-I22 VanDerWaalsContact C-N 3.3Å; I22-W24 HydrophobicContact CG2-CD2 4.07Å; I22-W24 VanDerWaalsContact CG2-CE2 3.45Å; I22-W24 HydrophobicContact CG2-CH2 4.28Å; I22-W24 HydrophobicContact CG2-CZ2 3.58Å; I22-W24 PolarHBondContact O-N 3.19Å; I22-W24 VanDerWaalsContact O-N 3.15Å; I22-W24 PolarHBondContact O-NE1 2.67Å
23	D	44.2	Very low	42.2	Very low	78 Å²	78	102.2 Å²	102.2	42%	0.417	57%	0.572	S	S	.	*			trans	-76.4	102.1	176.7	-157.1	-36.2	0	0	0	110.5	L21 T25 T26	L21-D23 PolarHBondContact O-N 3.06Å; D23-T25 PolarHBondContact O-N 3.22Å; D23-T25 WeakPolarHBondContact OD1-CA 3.43Å; D23-T25 PolarHBondContact OD1-N 3.47Å; D23-T25 PolarHBondContact OD1-OG1 2.99Å; D23-T26 PolarHBondContact OD1-N 2.99Å; D23-T26 PolarHBondContact OD1-OG1 3.18Å; D23-T26 WeakPolarHBondContact OD2-CG2 3.47Å; D23-T26 PolarHBondContact OD2-OG1 3.47Å; D23-T26 VanDerWaalsContact OD2-OG1 3.08Å
24	W	48.2	Very low	41.9	Very low	116 Å²	116	100.5 Å²	100.5	44%	0.439	57%	0.57	S	S	.	*	S	Bend	trans	-78.3	-6.7	176.2	-61.2	97.8	0	0	0	113.2	F16 I17 I22 V37	F16-W24 WeakPolarHBondContact O-CZ2 3.5Å; I17-W24 PolarHBondContact O-NE1 2.96Å; I22-W24 HydrophobicContact CG2-CD2 4.07Å; I22-W24 VanDerWaalsContact CG2-CE2 3.45Å; I22-W24 HydrophobicContact CG2-CH2 4.28Å; I22-W24 HydrophobicContact CG2-CZ2 3.58Å; I22-W24 PolarHBondContact O-N 3.19Å; I22-W24 VanDerWaalsContact O-N 3.15Å; I22-W24 PolarHBondContact O-NE1 2.67Å; W24-V37 HydrophobicContact CE3-CG2 4.47Å; W24-V37 HydrophobicContact CH2-CG2 4.47Å; W24-V37 HydrophobicContact CZ3-CG2 3.63Å
25	T	40.8	Very low	41.8	Very low	111 Å²	111	97.9 Å²	97.9	68%	0.681	56%	0.557	S	S	*	*	S	Bend	trans	-120.9	-28.2	-163.1	36.5	0	0	0	0	114.7	D23 G27	D23-T25 PolarHBondContact O-N 3.22Å; D23-T25 WeakPolarHBondContact OD1-CA 3.43Å; D23-T25 PolarHBondContact OD1-N 3.47Å; D23-T25 PolarHBondContact OD1-OG1 2.99Å; T25-G27 PolarHBondContact O-N 2.96Å; T25-G27 VanDerWaalsContact O-N 3.1Å
26	T	33.5	Very low	41.4	Very low	87 Å²	87	100.5 Å²	100.5	53%	0.534	57%	0.567	S	S	.	*			trans	-85.1	90.6	-177	59.1	0	0	0	0	112.4	D23	D23-T26 PolarHBondContact OD1-N 2.99Å; D23-T26 PolarHBondContact OD1-OG1 3.18Å; D23-T26 WeakPolarHBondContact OD2-CG2 3.47Å; D23-T26 PolarHBondContact OD2-OG1 3.47Å; D23-T26 VanDerWaalsContact OD2-OG1 3.08Å
27	G	33.7	Very low	41.4	Very low	39 Å²	39	96 Å²	96	40%	0.402	55%	0.55	S	S	.	.			trans	-135.7	82.5	157	0	0	0	0	0	108.4	T25	T25-G27 PolarHBondContact O-N 2.96Å; T25-G27 VanDerWaalsContact O-N 3.1Å
28	Y	34	Very low	41.3	Very low	215 Å²	215	95.8 Å²	95.8	84%	0.843	55%	0.548	S	S	*	.			trans	-58.4	132.6	170.5	-95.2	-92.4	0	0	0	108.7	G30	Y28-G30 PolarHBondContact O-N 3.49Å
29	P	41.2	Very low	41.4	Very low	136 Å²	136	93.8 Å²	93.8	88%	0.883	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	28.1	-165.9	32.1	-37	0	0	0	114.4
30	G	40.1	Very low	41.5	Very low	62 Å²	62	95.6 Å²	95.6	64%	0.639	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-49.5	-174.1	0	0	0	0	0	114.8	Y28	Y28-G30 PolarHBondContact O-N 3.49Å
31	D	32.6	Very low	41.5	Very low	144 Å²	144	91.4 Å²	91.4	77%	0.77	53%	0.525	S	S	*	.	S	Bend	trans	-137.9	95.1	-168	-73.1	-40.7	0	0	0	111.9	H33	D31-H33 PolarHBondContact O-CD2 3.09Å; D31-H33 PolarHBondContact O-N 3.32Å
32	G	38.8	Very low	41.9	Very low	84 Å²	84	90.4 Å²	90.4	87%	0.866	51%	0.511	S	S	*	.	S	Bend	trans	53.9	-4.7	145.3	0	0	0	0	0	122.3
33	H	36.1	Very low	42.3	Very low	166 Å²	166	91.7 Å²	91.7	77%	0.769	53%	0.53	S	S	*	.			trans	-117.5	84.4	-173.6	-60.8	-58.6	0	0	0	109.9	D31	D31-H33 PolarHBondContact O-CD2 3.09Å; D31-H33 PolarHBondContact O-N 3.32Å
34	G	43	Very low	42.5	Very low	20 Å²	20	93.5 Å²	93.5	21%	0.206	54%	0.539	C	S	.	.			trans	-68.7	160.2	172.6	0	0	0	0	0	112.3	N39	G34-N39 PolarHBondContact O-ND2 3.36Å; G34-N39 PolarHBondContact O-OD1 2.89Å
35	T	47.8	Very low	42.6	Very low	33 Å²	33	93.2 Å²	93.2	20%	0.202	54%	0.542	C	S	.	.			trans	-57.1	161.1	174.8	58.7	0	0	0	0	111.8	V37 Q38 N39	T35-V37 PolarHBondContact O-N 3.23Å; T35-Q38 CarbonylContact O-C 3.55Å; T35-Q38 WeakPolarHBondContact O-CA 3.33Å; T35-Q38 WeakPolarHBondContact O-CB 3.25Å; T35-Q38 PolarHBondContact O-N 3.27Å; T35-Q38 WeakPolarHBondContact OG1-CB 3.37Å; T35-Q38 PolarHBondContact OG1-N 3.08Å; T35-N39 PolarHBondContact O-N 3.06Å
36	V	45.5	Very low	43	Very low	113 Å²	113	91.8 Å²	91.8	69%	0.685	54%	0.535	S	S	*	.	H	α-helix	trans	-52.3	-43.1	178.8	174.4	0	0	0	0	111.6	N39 I40	V36-N39 PolarHBondContact O-N 3.39Å; V36-I40 HydrophobicContact CG1-CD1 3.79Å; V36-I40 WeakPolarHBondContact O-CB 3.44Å; V36-I40 WeakPolarHBondContact O-CD1 3.28Å; V36-I40 WeakPolarHBondContact O-CG1 3.39Å; V36-I40 PolarHBondContact O-N 2.92Å
37	V	44.9	Very low	43.7	Very low	30 Å²	30	93.5 Å²	93.5	18%	0.182	55%	0.55	C	S	.	*	H	α-helix	trans	-67.5	-42	175.9	172.6	0	0	0	0	111.9	W24 T35 N39 I40 I41 Y54	W24-V37 HydrophobicContact CE3-CG2 4.47Å; W24-V37 HydrophobicContact CH2-CG2 4.47Å; W24-V37 HydrophobicContact CZ3-CG2 3.63Å; T35-V37 PolarHBondContact O-N 3.23Å; V37-N39 VanDerWaalsContact C-N 3.34Å; V37-N39 PolarHBondContact O-N 3.05Å; V37-I40 PolarHBondContact O-N 2.94Å; V37-I41 HydrophobicContact CG1-CD1 3.47Å; V37-I41 VanDerWaalsContact CG1-CD1 3.47Å; V37-I41 HydrophobicContact CG1-CG1 4.12Å; V37-I41 VanDerWaalsContact O-CG1 3.3Å; V37-I41 WeakPolarHBondContact O-CG1 3.38Å; V37-I41 PolarHBondContact O-N 3.18Å; V37-Y54 HydrophobicContact CG1-CE1 4.03Å; V37-Y54 HydrophobicContact CG1-CE2 4.4Å; V37-Y54 WeakPolarHBondContact CG1-OH 3.2Å
38	Q	44.9	Very low	44.4	Very low	54 Å²	54	95.7 Å²	95.7	25%	0.252	56%	0.559	S	S	.	*	H	α-helix	trans	-62.3	-43.2	177.8	-164.4	173.4	-3	0	0	110.5	T35 I41 Y42 M51	T35-Q38 CarbonylContact O-C 3.55Å; T35-Q38 WeakPolarHBondContact O-CA 3.33Å; T35-Q38 WeakPolarHBondContact O-CB 3.25Å; T35-Q38 PolarHBondContact O-N 3.27Å; T35-Q38 WeakPolarHBondContact OG1-CB 3.37Å; T35-Q38 PolarHBondContact OG1-N 3.08Å; Q38-I41 PolarHBondContact O-N 2.83Å; Q38-Y42 WeakPolarHBondContact O-CB 3.45Å; Q38-Y42 PolarHBondContact O-N 3.07Å; Q38-M51 HydrophobicContact CG-CE 3.95Å
39	N	46.9	Very low	44.9	Very low	87 Å²	87	87.8 Å²	87.8	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-40.5	176	-66.6	-22.9	0	0	0	112.5	G34 T35 V36 V37 A43	G34-N39 PolarHBondContact O-ND2 3.36Å; G34-N39 PolarHBondContact O-OD1 2.89Å; T35-N39 PolarHBondContact O-N 3.06Å; V36-N39 PolarHBondContact O-N 3.39Å; V37-N39 VanDerWaalsContact C-N 3.34Å; V37-N39 PolarHBondContact O-N 3.05Å; N39-A43 WeakPolarHBondContact O-CB 3.38Å; N39-A43 PolarHBondContact O-N 3.37Å
40	I	48.4	Very low	45.8	Very low	93 Å²	93	85.1 Å²	85.1	48%	0.477	51%	0.508	S	S	.	.	H	α-helix	trans	-64.5	-47.3	176.6	-69.3	166.2	0	0	0	110.6	V36 V37 A43 L44	V36-I40 HydrophobicContact CG1-CD1 3.79Å; V36-I40 WeakPolarHBondContact O-CB 3.44Å; V36-I40 WeakPolarHBondContact O-CD1 3.28Å; V36-I40 WeakPolarHBondContact O-CG1 3.39Å; V36-I40 PolarHBondContact O-N 2.92Å; V37-I40 PolarHBondContact O-N 2.94Å; I40-A43 PolarHBondContact O-N 3.49Å; I40-L44 HydrophobicContact CG2-CD1 3.75Å; I40-L44 WeakPolarHBondContact O-CB 3.38Å; I40-L44 WeakPolarHBondContact O-CG 3.4Å; I40-L44 PolarHBondContact O-N 3.35Å
41	I	45.1	Very low	46.2	Very low	38 Å²	38	85.1 Å²	85.1	20%	0.195	49%	0.492	C	S	.	.	H	α-helix	trans	-75.8	-35.8	-176.2	-56.2	172.5	0	0	0	111.6	V37 Q38 A43 L44 H45 F49 Y54	V37-I41 HydrophobicContact CG1-CD1 3.47Å; V37-I41 VanDerWaalsContact CG1-CD1 3.47Å; V37-I41 HydrophobicContact CG1-CG1 4.12Å; V37-I41 VanDerWaalsContact O-CG1 3.3Å; V37-I41 WeakPolarHBondContact O-CG1 3.38Å; V37-I41 PolarHBondContact O-N 3.18Å; Q38-I41 PolarHBondContact O-N 2.83Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 3.45Å; I41-L44 PolarHBondContact O-N 2.82Å; I41-H45 PolarHBondContact O-N 3.24Å; I41-F49 HydrophobicContact CB-CD2 4.07Å; I41-F49 HydrophobicContact CB-CE2 3.84Å; I41-F49 HydrophobicContact CB-CZ 4.44Å; I41-F49 HydrophobicContact CD1-CE2 3.72Å; I41-F49 HydrophobicContact CD1-CZ 4.17Å; I41-F49 HydrophobicContact CG1-CE2 4.38Å; I41-F49 HydrophobicContact CG2-CD2 3.19Å; I41-F49 HydrophobicContact CG2-CE2 3.32Å; I41-F49 HydrophobicContact CG2-CG 4.14Å; I41-F49 HydrophobicContact CG2-CZ 4.34Å; I41-Y54 HydrophobicContact CD1-CD2 4.06Å; I41-Y54 HydrophobicContact CD1-CE2 3.86Å
42	Y	47.6	Very low	47.5	Very low	137 Å²	137	85.7 Å²	85.7	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-34.7	172.8	-138.7	-87	0	0	0	111.6	Q38 P46	Q38-Y42 WeakPolarHBondContact O-CB 3.45Å; Q38-Y42 PolarHBondContact O-N 3.07Å; Y42-P46 HydrophobicContact CD1-CB 4.32Å; Y42-P46 HydrophobicContact CE1-CB 4.46Å; Y42-P46 WeakPolarHBondContact O-CA 3.36Å; Y42-P46 WeakPolarHBondContact O-CB 3.46Å; Y42-P46 WeakPolarHBondContact O-CD 3.19Å
43	A	51.2	Low	48.6	Very low	82 Å²	82	88.2 Å²	88.2	68%	0.678	48%	0.479	S	S	*	.	H	α-helix	trans	-69.4	-36.5	173.1	0	0	0	0	0	112.7	N39 I40 I41	N39-A43 WeakPolarHBondContact O-CB 3.38Å; N39-A43 PolarHBondContact O-N 3.37Å; I40-A43 PolarHBondContact O-N 3.49Å; I41-A43 VanDerWaalsContact C-N 3.31Å; I41-A43 PolarHBondContact O-N 3.45Å
44	L	49.3	Very low	49.6	Very low	117 Å²	117	84.8 Å²	84.8	61%	0.613	46%	0.46	S	S	*	.	H	α-helix	trans	-78	-35.6	179.1	-70.6	168.5	0	0	0	112.6	I40 I41	I40-L44 HydrophobicContact CG2-CD1 3.75Å; I40-L44 WeakPolarHBondContact O-CB 3.38Å; I40-L44 WeakPolarHBondContact O-CG 3.4Å; I40-L44 PolarHBondContact O-N 3.35Å; I41-L44 PolarHBondContact O-N 2.82Å
45	H	48.8	Very low	50.5	Low	109 Å²	109	90.3 Å²	90.3	51%	0.505	48%	0.478	S	S	.	.			trans	-147.1	72.6	-172.4	-66.6	-66.1	0	0	0	111.9	I41 S47	I41-H45 PolarHBondContact O-N 3.24Å; H45-S47 PolarHBondContact O-N 3.32Å
46	P	49.5	Very low	51.4	Low	82 Å²	82	93.5 Å²	93.5	53%	0.532	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.5	-176.2	22	-31.4	0	0	0	114	Y42	Y42-P46 HydrophobicContact CD1-CB 4.32Å; Y42-P46 HydrophobicContact CE1-CB 4.46Å; Y42-P46 WeakPolarHBondContact O-CA 3.36Å; Y42-P46 WeakPolarHBondContact O-CB 3.46Å; Y42-P46 WeakPolarHBondContact O-CD 3.19Å
47	S	47.6	Very low	52.4	Low	122 Å²	122	91 Å²	91	85%	0.853	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-4.2	-171.4	44.3	0	0	0	0	115.7	H45	H45-S47 PolarHBondContact O-N 3.32Å
48	S	49.3	Very low	53.3	Low	85 Å²	85	91 Å²	91	59%	0.594	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	9.4	-174.8	50.7	0	0	0	0	114.9	N50	S48-N50 PolarHBondContact O-N 3.37Å; S48-N50 VanDerWaalsContact O-N 3.08Å
49	F	45.1	Very low	54.4	Low	49 Å²	49	91.6 Å²	91.6	22%	0.215	49%	0.487	C	S	.	.			trans	-81.1	94.7	-176.3	-163.9	-111	0	0	0	112.8	I41 M51 Y54	I41-F49 HydrophobicContact CB-CD2 4.07Å; I41-F49 HydrophobicContact CB-CE2 3.84Å; I41-F49 HydrophobicContact CB-CZ 4.44Å; I41-F49 HydrophobicContact CD1-CE2 3.72Å; I41-F49 HydrophobicContact CD1-CZ 4.17Å; I41-F49 HydrophobicContact CG1-CE2 4.38Å; I41-F49 HydrophobicContact CG2-CD2 3.19Å; I41-F49 HydrophobicContact CG2-CE2 3.32Å; I41-F49 HydrophobicContact CG2-CG 4.14Å; I41-F49 HydrophobicContact CG2-CZ 4.34Å; F49-M51 HydrophobicContact CD1-CB 4.4Å; F49-M51 HydrophobicContact CE1-CB 4.19Å; F49-M51 HydrophobicContact CE1-CE 4.21Å; F49-M51 HydrophobicContact CE1-SD 3.75Å; F49-M51 HydrophobicContact CZ-SD 4.4Å; F49-M51 PolarHBondContact O-N 3.42Å; F49-Y54 HydrophobicContact CE2-CD2 4.43Å; F49-Y54 HydrophobicContact CE2-CG 4.21Å; F49-Y54 HydrophobicContact CZ-CD1 4.32Å; F49-Y54 AromaticContact CZ-CG 3.98Å; F49-Y54 HydrophobicContact CZ-CG 3.98Å
50	N	58.9	Low	55.3	Low	80 Å²	80	91.1 Å²	91.1	43%	0.428	48%	0.482	S	S	.	.			trans	-80.6	94	166.9	-166.8	-15.4	0	0	0	109.7	S48 H52 Q53 Y54	S48-N50 PolarHBondContact O-N 3.37Å; S48-N50 VanDerWaalsContact O-N 3.08Å; N50-H52 PolarHBondContact O-N 2.97Å; N50-H52 PolarHBondContact OD1-N 2.93Å; N50-Q53 HydrophobicContact CB-CB 4.3Å; N50-Q53 HydrophobicContact CB-CG 4.17Å; N50-Q53 PolarHBondContact O-N 3.19Å; N50-Y54 PolarHBondContact O-N 2.99Å
51	M	49	Very low	56.3	Low	63 Å²	63	90.7 Å²	90.7	31%	0.31	48%	0.48	S	S	.	.	H	α-helix	trans	-50.1	-33.4	179.3	179.3	63.6	100.2	0	0	113.1	Q38 F49 K55	Q38-M51 HydrophobicContact CG-CE 3.95Å; F49-M51 HydrophobicContact CD1-CB 4.4Å; F49-M51 HydrophobicContact CE1-CB 4.19Å; F49-M51 HydrophobicContact CE1-CE 4.21Å; F49-M51 HydrophobicContact CE1-SD 3.75Å; F49-M51 HydrophobicContact CZ-SD 4.4Å; F49-M51 PolarHBondContact O-N 3.42Å; M51-K55 HydrophobicContact CG-CD 4.49Å; M51-K55 WeakPolarHBondContact O-CG 3.37Å; M51-K55 PolarHBondContact O-N 2.86Å; M51-K55 VanDerWaalsContact O-N 3.14Å; M51-K55 HydrophobicContact SD-CG 4.44Å
52	H	59.3	Low	57.4	Low	156 Å²	156	92.3 Å²	92.3	72%	0.722	49%	0.486	S	S	*	.	H	α-helix	trans	-66	-42.9	177.3	-99.3	-75.5	0	0	0	112.7	N50 Y54 K55 E56	N50-H52 PolarHBondContact O-N 2.97Å; N50-H52 PolarHBondContact OD1-N 2.93Å; H52-Y54 PolarHBondContact O-N 3.48Å; H52-K55 PolarHBondContact O-N 2.9Å; H52-E56 WeakPolarHBondContact O-CB 3.32Å; H52-E56 PolarHBondContact O-N 3.14Å
53	Q	61.7	Low	58.4	Low	136 Å²	136	91 Å²	91	64%	0.636	48%	0.483	S	S	*	.	H	α-helix	trans	-67.8	-35.9	-179.4	-71.7	-179.9	-11.2	0	0	112.2	N50 E56 A57	N50-Q53 HydrophobicContact CB-CB 4.3Å; N50-Q53 HydrophobicContact CB-CG 4.17Å; N50-Q53 PolarHBondContact O-N 3.19Å; Q53-E56 PolarHBondContact O-N 3.37Å; Q53-A57 WeakPolarHBondContact O-CB 3.32Å; Q53-A57 PolarHBondContact O-N 3.02Å
54	Y	58.3	Low	59.2	Low	95 Å²	95	93 Å²	93	37%	0.373	48%	0.478	S	S	.	.	H	α-helix	trans	-69.1	-44.5	176.4	-177.9	-94.2	0	0	0	112.1	V37 I41 F49 N50 H52 E56 A57 A58	V37-Y54 HydrophobicContact CG1-CE1 4.03Å; V37-Y54 HydrophobicContact CG1-CE2 4.4Å; V37-Y54 WeakPolarHBondContact CG1-OH 3.2Å; I41-Y54 HydrophobicContact CD1-CD2 4.06Å; I41-Y54 HydrophobicContact CD1-CE2 3.86Å; F49-Y54 HydrophobicContact CE2-CD2 4.43Å; F49-Y54 HydrophobicContact CE2-CG 4.21Å; F49-Y54 HydrophobicContact CZ-CD1 4.32Å; F49-Y54 AromaticContact CZ-CG 3.98Å; F49-Y54 HydrophobicContact CZ-CG 3.98Å; N50-Y54 PolarHBondContact O-N 2.99Å; H52-Y54 PolarHBondContact O-N 3.48Å; Y54-E56 VanDerWaalsContact C-N 3.25Å; Y54-E56 PolarHBondContact O-N 3.46Å; Y54-A57 PolarHBondContact O-N 3.11Å; Y54-A58 HydrophobicContact CE1-CB 4.35Å; Y54-A58 WeakPolarHBondContact O-CB 3.46Å; Y54-A58 PolarHBondContact O-N 3.37Å
55	K	61.6	Low	60.3	Low	136 Å²	136	90.1 Å²	90.1	59%	0.591	46%	0.463	S	S	*	.	H	α-helix	trans	-57	-42.7	174.4	-76.7	-174.4	176.5	-172.2	0	111	M51 H52 F59	M51-K55 HydrophobicContact CG-CD 4.49Å; M51-K55 WeakPolarHBondContact O-CG 3.37Å; M51-K55 PolarHBondContact O-N 2.86Å; M51-K55 VanDerWaalsContact O-N 3.14Å; M51-K55 HydrophobicContact SD-CG 4.44Å; H52-K55 PolarHBondContact O-N 2.9Å; K55-F59 VanDerWaalsContact O-CB 3.25Å; K55-F59 WeakPolarHBondContact O-CB 3.47Å; K55-F59 PolarHBondContact O-N 3.09Å
56	E	66.2	Low	61.3	Low	100 Å²	100	86.9 Å²	86.9	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-63.1	-47.3	175.7	-172.2	58.2	-147	0	0	112.1	H52 Q53 Y54 A58 F59 Q60	H52-E56 WeakPolarHBondContact O-CB 3.32Å; H52-E56 PolarHBondContact O-N 3.14Å; Q53-E56 PolarHBondContact O-N 3.37Å; Y54-E56 VanDerWaalsContact C-N 3.25Å; Y54-E56 PolarHBondContact O-N 3.46Å; E56-A58 PolarHBondContact O-N 3.48Å; E56-F59 WeakPolarHBondContact O-CB 3.22Å; E56-F59 PolarHBondContact O-N 3.42Å; E56-Q60 WeakPolarHBondContact O-CG 3.42Å; E56-Q60 PolarHBondContact O-N 2.94Å; E56-Q60 PolarHBondContact OE1-NE2 3.18Å
57	A	66.1	Low	62.3	Low	59 Å²	59	86.4 Å²	86.4	49%	0.488	45%	0.446	S	S	.	.	H	α-helix	trans	-64.4	-42.3	179.6	0	0	0	0	0	113	Q53 Y54 F59 Q60 L61	Q53-A57 WeakPolarHBondContact O-CB 3.32Å; Q53-A57 PolarHBondContact O-N 3.02Å; Y54-A57 PolarHBondContact O-N 3.11Å; A57-F59 VanDerWaalsContact C-N 3.29Å; A57-F59 PolarHBondContact O-N 3.16Å; A57-Q60 PolarHBondContact O-N 3.46Å; A57-L61 PolarHBondContact O-N 2.98Å
58	A	64.4	Low	63.5	Low	32 Å²	32	85.7 Å²	85.7	26%	0.264	43%	0.432	S	S	.	.	H	α-helix	trans	-63.7	-37.6	175.2	0	0	0	0	0	111.5	Y54 E56 L61 K62	Y54-A58 HydrophobicContact CE1-CB 4.35Å; Y54-A58 WeakPolarHBondContact O-CB 3.46Å; Y54-A58 PolarHBondContact O-N 3.37Å; E56-A58 PolarHBondContact O-N 3.48Å; A58-L61 PolarHBondContact O-N 2.93Å; A58-K62 WeakPolarHBondContact O-CG 3.43Å; A58-K62 PolarHBondContact O-N 2.75Å
59	F	67.5	Low	64.7	Low	66 Å²	66	85.5 Å²	85.5	29%	0.289	42%	0.419	S	S	.	.	H	α-helix	trans	-64.2	-47.5	173.8	177.8	-105	0	0	0	111.9	K55 E56 A57 L61 K62 K63 E888	K55-F59 VanDerWaalsContact O-CB 3.25Å; K55-F59 WeakPolarHBondContact O-CB 3.47Å; K55-F59 PolarHBondContact O-N 3.09Å; E56-F59 WeakPolarHBondContact O-CB 3.22Å; E56-F59 PolarHBondContact O-N 3.42Å; A57-F59 VanDerWaalsContact C-N 3.29Å; A57-F59 PolarHBondContact O-N 3.16Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.05Å; F59-K62 PolarHBondContact O-N 2.88Å; F59-K63 WeakPolarHBondContact O-CB 3.42Å; F59-K63 PolarHBondContact O-N 3.09Å; F59-E888 VanDerWaalsContact CD2-OE1 3.23Å; F59-E888 WeakPolarHBondContact CD2-OE1 3.31Å; F59-E888 WeakPolarHBondContact CE2-OE1 3.45Å; F59-E888 WeakPolarHBondContact CE2-OE2 3.44Å; F59-E888 WeakPolarHBondContact CZ-OE2 3.41Å
60	Q	66.6	Low	65.8	Low	76 Å²	76	85.2 Å²	85.2	36%	0.355	42%	0.422	S	S	.	.	H	α-helix	trans	-59.2	-39.5	176.8	-67.5	-60.7	-25.7	0	0	112.1	E56 A57 K63 Q64	E56-Q60 WeakPolarHBondContact O-CG 3.42Å; E56-Q60 PolarHBondContact O-N 2.94Å; E56-Q60 PolarHBondContact OE1-NE2 3.18Å; A57-Q60 PolarHBondContact O-N 3.46Å; Q60-K63 PolarHBondContact O-N 3.4Å; Q60-Q64 WeakPolarHBondContact O-CG 3.22Å; Q60-Q64 PolarHBondContact O-N 2.67Å
61	L	70.2	Confident	66.4	Low	84 Å²	84	89.9 Å²	89.9	44%	0.44	43%	0.434	S	S	.	.	H	α-helix	trans	-65.9	-45.7	175.6	-173.9	69.7	0	0	0	112	A57 A58 F59 K63 Q64 L65	A57-L61 PolarHBondContact O-N 2.98Å; A58-L61 PolarHBondContact O-N 2.93Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.05Å; L61-K63 VanDerWaalsContact C-N 3.31Å; L61-K63 PolarHBondContact O-N 3.34Å; L61-Q64 PolarHBondContact O-N 3.2Å; L61-L65 HydrophobicContact CG-CD1 4.3Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.38Å
62	K	67.4	Low	67.6	Low	73 Å²	73	92.1 Å²	92.1	32%	0.317	45%	0.447	S	S	.	.	H	α-helix	trans	-58.1	-44.7	174.5	-78	-179	-178.9	-178.5	0	110.9	A58 F59 Q64 L65 F66 F884 L887	A58-K62 WeakPolarHBondContact O-CG 3.43Å; A58-K62 PolarHBondContact O-N 2.75Å; F59-K62 PolarHBondContact O-N 2.88Å; K62-Q64 PolarHBondContact O-N 3.12Å; K62-L65 PolarHBondContact O-N 2.88Å; K62-F66 WeakPolarHBondContact O-CB 3.45Å; K62-F66 PolarHBondContact O-N 2.86Å; K62-F884 HydrophobicContact CB-CE1 4.03Å; K62-F884 HydrophobicContact CB-CZ 3.96Å; K62-F884 VanDerWaalsContact O-CZ 3.22Å; K62-F884 WeakPolarHBondContact O-CZ 3.4Å; K62-L887 HydrophobicContact CD-CD1 4.46Å
63	K	68.1	Low	68.1	Low	109 Å²	109	85.4 Å²	85.4	47%	0.474	42%	0.418	S	S	.	.	H	α-helix	trans	-59.3	-44.6	176.4	-173.4	179	179.7	179.3	0	112	F59 Q60 L61 F66 C67	F59-K63 WeakPolarHBondContact O-CB 3.42Å; F59-K63 PolarHBondContact O-N 3.09Å; Q60-K63 PolarHBondContact O-N 3.4Å; L61-K63 VanDerWaalsContact C-N 3.31Å; L61-K63 PolarHBondContact O-N 3.34Å; K63-F66 PolarHBondContact O-N 3.29Å; K63-C67 PolarHBondContact O-N 2.78Å; K63-C67 PolarHBondContact O-SG 2.98Å
64	Q	69	Low	68.6	Low	123 Å²	123	81.2 Å²	81.2	58%	0.575	40%	0.4	S	S	*	.	H	α-helix	trans	-64.5	-42.5	176.8	-74.5	-179.4	-4.1	0	0	112.8	Q60 L61 K62 F66 C67 L68	Q60-Q64 WeakPolarHBondContact O-CG 3.22Å; Q60-Q64 PolarHBondContact O-N 2.67Å; L61-Q64 PolarHBondContact O-N 3.2Å; K62-Q64 PolarHBondContact O-N 3.12Å; Q64-F66 VanDerWaalsContact C-N 3.33Å; Q64-C67 PolarHBondContact O-N 3.33Å; Q64-L68 WeakPolarHBondContact O-CG 3.47Å; Q64-L68 PolarHBondContact O-N 2.95Å
65	L	72	Confident	69.5	Low	57 Å²	57	80.8 Å²	80.8	30%	0.298	41%	0.407	S	S	.	.	H	α-helix	trans	-63.8	-39.6	175.9	-72.8	170.2	0	0	0	111.7	F13 L61 K62 L68 Y69	F13-L65 HydrophobicContact CD1-CD1 4.2Å; F13-L65 HydrophobicContact CE1-CD1 3.73Å; F13-L65 HydrophobicContact CZ-CD1 4.21Å; L61-L65 HydrophobicContact CG-CD1 4.3Å; L61-L65 WeakPolarHBondContact O-CG 3.47Å; L61-L65 PolarHBondContact O-N 3.38Å; K62-L65 PolarHBondContact O-N 2.88Å; L65-L68 PolarHBondContact O-N 3.39Å; L65-Y69 PolarHBondContact O-N 3.47Å
66	F	70.2	Confident	70	Confident	41 Å²	41	79.2 Å²	79.2	18%	0.18	40%	0.402	C	S	.	.	H	α-helix	trans	-61.9	-47	173.1	-175.5	-108.9	0	0	0	112.1	K62 K63 Q64 L68 Y69 C70 V881 F884	K62-F66 WeakPolarHBondContact O-CB 3.45Å; K62-F66 PolarHBondContact O-N 2.86Å; K63-F66 PolarHBondContact O-N 3.29Å; Q64-F66 VanDerWaalsContact C-N 3.33Å; F66-L68 VanDerWaalsContact C-N 3.27Å; F66-L68 PolarHBondContact O-N 2.82Å; F66-Y69 PolarHBondContact O-N 3.49Å; F66-C70 VanDerWaalsContact CE1-SG 3.56Å; F66-C70 VanDerWaalsContact CZ-SG 3.54Å; F66-C70 PolarHBondContact O-N 3.33Å; F66-C70 PolarHBondContact O-SG 3.4Å; F66-V881 HydrophobicContact CE2-CG1 4.39Å; F66-V881 HydrophobicContact CE2-CG2 4.03Å; F66-V881 HydrophobicContact CZ-CG1 4.04Å; F66-V881 HydrophobicContact CZ-CG2 4.03Å; F66-F884 HydrophobicContact CB-CD1 4.21Å; F66-F884 HydrophobicContact CB-CD2 4.32Å; F66-F884 HydrophobicContact CB-CE1 3.71Å; F66-F884 HydrophobicContact CB-CE2 3.83Å; F66-F884 HydrophobicContact CB-CG 4.5Å; F66-F884 HydrophobicContact CB-CZ 3.53Å; F66-F884 HydrophobicContact CD2-CB 4.22Å; F66-F884 HydrophobicContact CD2-CD1 4.04Å; F66-F884 AromaticContact CD2-CD2 3.38Å; F66-F884 HydrophobicContact CD2-CD2 3.38Å; F66-F884 HydrophobicContact CD2-CE1 4.32Å; F66-F884 AromaticContact CD2-CE2 3.7Å; F66-F884 HydrophobicContact CD2-CE2 3.7Å; F66-F884 AromaticContact CD2-CG 3.58Å; F66-F884 HydrophobicContact CD2-CG 3.58Å; F66-F884 HydrophobicContact CD2-CZ 4.19Å; F66-F884 HydrophobicContact CE2-CB 4.1Å; F66-F884 HydrophobicContact CE2-CD2 4Å; F66-F884 AromaticContact CE2-CG 3.98Å; F66-F884 HydrophobicContact CE2-CG 3.98Å; F66-F884 HydrophobicContact CG-CD1 4.08Å; F66-F884 HydrophobicContact CG-CD2 4.13Å; F66-F884 HydrophobicContact CG-CE1 4.1Å; F66-F884 HydrophobicContact CG-CE2 4.14Å; F66-F884 HydrophobicContact CG-CG 4.11Å; F66-F884 HydrophobicContact CG-CZ 4.16Å
67	C	69.6	Low	70.2	Confident	73 Å²	73	75 Å²	75	49%	0.493	38%	0.382	S	S	.	.	H	α-helix	trans	-57.4	-39.9	175.3	-72.4	0	0	0	0	112.3	K63 Q64 R71	K63-C67 PolarHBondContact O-N 2.78Å; K63-C67 PolarHBondContact O-SG 2.98Å; Q64-C67 PolarHBondContact O-N 3.33Å; C67-R71 WeakPolarHBondContact O-CB 3.37Å; C67-R71 PolarHBondContact O-N 3.38Å
68	L	73.1	Confident	70.5	Confident	106 Å²	106	76.1 Å²	76.1	56%	0.555	38%	0.379	S	S	*	.	H	α-helix	trans	-66.3	-44.6	176	-73.9	170.8	0	0	0	111.9	Q64 L65 F66 R71 D72	Q64-L68 WeakPolarHBondContact O-CG 3.47Å; Q64-L68 PolarHBondContact O-N 2.95Å; L65-L68 PolarHBondContact O-N 3.39Å; F66-L68 VanDerWaalsContact C-N 3.27Å; F66-L68 PolarHBondContact O-N 2.82Å; L68-R71 PolarHBondContact O-N 2.78Å; L68-D72 PolarHBondContact O-N 2.84Å
69	Y	74.3	Confident	71.2	Confident	81 Å²	81	77.1 Å²	77.1	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-46.8	174.6	177.8	-93	0	0	0	111.6	L65 F66 R71 D72 A73 V880	L65-Y69 PolarHBondContact O-N 3.47Å; F66-Y69 PolarHBondContact O-N 3.49Å; Y69-R71 VanDerWaalsContact C-N 3.28Å; Y69-R71 PolarHBondContact O-N 2.8Å; Y69-D72 PolarHBondContact O-N 2.92Å; Y69-A73 HydrophobicContact CE1-CB 4.49Å; Y69-A73 WeakPolarHBondContact O-CB 3.37Å; Y69-A73 PolarHBondContact O-N 3.41Å; Y69-V880 HydrophobicContact CD1-CG1 3.76Å; Y69-V880 HydrophobicContact CE1-CB 3.87Å; Y69-V880 HydrophobicContact CE1-CG1 3.57Å; Y69-V880 HydrophobicContact CE1-CG2 4.08Å; Y69-V880 HydrophobicContact CE2-CG2 4.34Å; Y69-V880 HydrophobicContact CG-CG1 4.38Å
70	C	68.7	Low	71.4	Confident	43 Å²	43	76.4 Å²	76.4	29%	0.291	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-38.5	176.6	-68.6	0	0	0	0	112	F66 L74	F66-C70 VanDerWaalsContact CE1-SG 3.56Å; F66-C70 VanDerWaalsContact CZ-SG 3.54Å; F66-C70 PolarHBondContact O-N 3.33Å; F66-C70 PolarHBondContact O-SG 3.4Å; C70-L74 VanDerWaalsContact O-CB 3.3Å; C70-L74 WeakPolarHBondContact O-CB 3.41Å; C70-L74 PolarHBondContact O-N 3.45Å
71	R	70.6	Confident	71.8	Confident	178 Å²	178	74.6 Å²	74.6	67%	0.672	37%	0.373	S	S	*	.	H	α-helix	trans	-66.7	-42	177.5	-171.4	178.7	-177.9	174.7	2.1	112.3	C67 L68 Y69 L74 V75	C67-R71 WeakPolarHBondContact O-CB 3.37Å; C67-R71 PolarHBondContact O-N 3.38Å; L68-R71 PolarHBondContact O-N 2.78Å; Y69-R71 VanDerWaalsContact C-N 3.28Å; Y69-R71 PolarHBondContact O-N 2.8Å; R71-L74 WeakPolarHBondContact O-CB 3.35Å; R71-L74 PolarHBondContact O-N 2.79Å; R71-V75 WeakPolarHBondContact O-CG2 3.37Å; R71-V75 PolarHBondContact O-N 2.98Å
72	D	73.8	Confident	72.3	Confident	111 Å²	111	77 Å²	77	59%	0.594	38%	0.381	S	S	*	.	H	α-helix	trans	-68.8	-40.9	176.5	-83.4	0.8	0	0	0	111.4	L68 Y69 L74 V75 Q76	L68-D72 PolarHBondContact O-N 2.84Å; Y69-D72 PolarHBondContact O-N 2.92Å; D72-L74 VanDerWaalsContact C-N 3.29Å; D72-L74 PolarHBondContact O-N 3.22Å; D72-V75 PolarHBondContact O-N 3.4Å; D72-Q76 PolarHBondContact O-N 2.81Å; D72-Q76 VanDerWaalsContact O-N 3.11Å
73	A	71	Confident	73.1	Confident	14 Å²	14	79.3 Å²	79.3	12%	0.116	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-38	174	0	0	0	0	0	111.9	Y69 Q76 W77 I877	Y69-A73 HydrophobicContact CE1-CB 4.49Å; Y69-A73 WeakPolarHBondContact O-CB 3.37Å; Y69-A73 PolarHBondContact O-N 3.41Å; A73-Q76 PolarHBondContact O-N 2.82Å; A73-W77 WeakPolarHBondContact O-CB 3.36Å; A73-W77 PolarHBondContact O-N 3.2Å; A73-I877 HydrophobicContact CB-CD1 4.05Å; A73-I877 HydrophobicContact CB-CG1 4.31Å
74	L	72.1	Confident	73.6	Confident	48 Å²	48	74.7 Å²	74.7	25%	0.251	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-41.7	176.3	-176.7	68.1	0	0	0	112.4	C70 R71 D72 W77 N78 W951 V955	C70-L74 VanDerWaalsContact O-CB 3.3Å; C70-L74 WeakPolarHBondContact O-CB 3.41Å; C70-L74 PolarHBondContact O-N 3.45Å; R71-L74 WeakPolarHBondContact O-CB 3.35Å; R71-L74 PolarHBondContact O-N 2.79Å; D72-L74 VanDerWaalsContact C-N 3.29Å; D72-L74 PolarHBondContact O-N 3.22Å; L74-W77 PolarHBondContact O-N 2.88Å; L74-N78 PolarHBondContact O-N 3.35Å; L74-W951 HydrophobicContact CD1-CH2 3.9Å; L74-W951 HydrophobicContact CD1-CZ3 3.5Å; L74-V955 HydrophobicContact CD1-CG1 4.18Å; L74-V955 HydrophobicContact CD1-CG2 3.5Å; L74-V955 VanDerWaalsContact CD1-CG2 3.5Å; L74-V955 HydrophobicContact CD2-CG1 3.88Å
75	V	76.5	Confident	74.1	Confident	87 Å²	87	71.9 Å²	71.9	53%	0.527	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-46.6	177.5	174.1	0	0	0	0	110.8	R71 D72 W77 N78 C79	R71-V75 WeakPolarHBondContact O-CG2 3.37Å; R71-V75 PolarHBondContact O-N 2.98Å; D72-V75 PolarHBondContact O-N 3.4Å; V75-W77 VanDerWaalsContact C-N 3.26Å; V75-W77 PolarHBondContact O-N 2.62Å; V75-N78 PolarHBondContact O-N 2.85Å; V75-C79 PolarHBondContact O-N 3.08Å
76	Q	72.1	Confident	74.8	Confident	102 Å²	102	74 Å²	74	48%	0.477	36%	0.364	S	S	.	.	H	α-helix	trans	-58.8	-43.8	176.1	-71.7	-177.4	-6.8	0	0	110.8	D72 A73 N78 C79 Y80	D72-Q76 PolarHBondContact O-N 2.81Å; D72-Q76 VanDerWaalsContact O-N 3.11Å; A73-Q76 PolarHBondContact O-N 2.82Å; Q76-N78 PolarHBondContact O-N 3.48Å; Q76-C79 WeakPolarHBondContact O-CB 3.26Å; Q76-C79 PolarHBondContact O-N 3.38Å; Q76-Y80 HydrophobicContact CB-CE2 4.24Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.2Å; Q76-Y80 PolarHBondContact O-N 3.42Å
77	W	70	Confident	75.5	Confident	13 Å²	13	72.3 Å²	72.3	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-48.7	177.3	-175.8	-82.8	0	0	0	112.9	A73 L74 V75 C79 Y80 N81 F870 W951	A73-W77 WeakPolarHBondContact O-CB 3.36Å; A73-W77 PolarHBondContact O-N 3.2Å; L74-W77 PolarHBondContact O-N 2.88Å; V75-W77 VanDerWaalsContact C-N 3.26Å; V75-W77 PolarHBondContact O-N 2.62Å; W77-C79 PolarHBondContact O-N 3.46Å; W77-Y80 CarbonylContact O-C 3.03Å; W77-Y80 WeakPolarHBondContact O-CA 3.49Å; W77-Y80 PolarHBondContact O-N 2.95Å; W77-N81 WeakPolarHBondContact O-CB 3.33Å; W77-N81 PolarHBondContact O-N 3.35Å; W77-F870 AromaticContact CH2-CD2 3.58Å; W77-F870 HydrophobicContact CH2-CD2 3.58Å; W77-F870 AromaticContact CH2-CE2 2.93Å; W77-F870 HydrophobicContact CH2-CE2 2.93Å; W77-F870 AromaticContact CH2-CZ 3.55Å; W77-F870 HydrophobicContact CH2-CZ 3.55Å; W77-F870 HydrophobicContact CZ2-CD2 4.01Å; W77-F870 AromaticContact CZ2-CE2 3.36Å; W77-F870 HydrophobicContact CZ2-CE2 3.36Å; W77-F870 HydrophobicContact CZ2-CZ 4.26Å; W77-F870 AromaticContact CZ3-CD2 3.96Å; W77-F870 HydrophobicContact CZ3-CD2 3.96Å; W77-F870 AromaticContact CZ3-CE2 3.72Å; W77-F870 HydrophobicContact CZ3-CE2 3.72Å; W77-F870 HydrophobicContact CZ3-CZ 4.34Å; W77-W951 HydrophobicContact CB-CH2 3.31Å; W77-W951 HydrophobicContact CB-CZ2 4.03Å; W77-W951 HydrophobicContact CB-CZ3 3.82Å; W77-W951 AromaticContact CD1-CD2 3.65Å; W77-W951 AromaticContact CD1-CE2 3.7Å; W77-W951 AromaticContact CD1-CE3 3.23Å; W77-W951 AromaticContact CD1-CH2 3.03Å; W77-W951 AromaticContact CD1-CZ2 3.44Å; W77-W951 VanDerWaalsContact CD1-CZ2 3.44Å; W77-W951 AromaticContact CD1-CZ3 2.88Å; W77-W951 HydrophobicContact CD2-CD2 4.28Å; W77-W951 AromaticContact CD2-CE2 3.55Å; W77-W951 HydrophobicContact CD2-CE3 4.45Å; W77-W951 AromaticContact CD2-CH2 3.28Å; W77-W951 HydrophobicContact CD2-CH2 3.28Å; W77-W951 AromaticContact CD2-CZ2 2.99Å; W77-W951 HydrophobicContact CD2-CZ2 2.99Å; W77-W951 AromaticContact CD2-CZ3 4Å; W77-W951 HydrophobicContact CD2-CZ3 4Å; W77-W951 AromaticContact CE2-CD2 3.52Å; W77-W951 AromaticContact CE2-CE2 2.97Å; W77-W951 AromaticContact CE2-CE3 3.98Å; W77-W951 AromaticContact CE2-CH2 3.58Å; W77-W951 AromaticContact CE2-CZ2 3.03Å; W77-W951 AromaticContact CE2-CZ3 3.99Å; W77-W951 AromaticContact CE2-NE1 3.34Å; W77-W951 VanDerWaalsContact CE2-NE1 3.34Å; W77-W951 HydrophobicContact CE3-CH2 4.02Å; W77-W951 AromaticContact CE3-CZ2 3.49Å; W77-W951 HydrophobicContact CE3-CZ2 3.49Å; W77-W951 VanDerWaalsContact CE3-CZ2 3.49Å; W77-W951 HydrophobicContact CG-CD2 4.32Å; W77-W951 AromaticContact CG-CE2 3.93Å; W77-W951 HydrophobicContact CG-CE3 4.02Å; W77-W951 AromaticContact CG-CH2 2.88Å; W77-W951 HydrophobicContact CG-CH2 2.88Å; W77-W951 AromaticContact CG-CZ2 3.24Å; W77-W951 HydrophobicContact CG-CZ2 3.24Å; W77-W951 AromaticContact CG-CZ3 3.31Å; W77-W951 HydrophobicContact CG-CZ3 3.31Å; W77-W951 AromaticContact CH2-CE2 3.71Å; W77-W951 AromaticContact CH2-CZ2 3.79Å; W77-W951 HydrophobicContact CH2-CZ2 3.79Å; W77-W951 AromaticContact CH2-NE1 3.35Å; W77-W951 AromaticContact CZ2-CD1 3.58Å; W77-W951 AromaticContact CZ2-CD2 3.86Å; W77-W951 HydrophobicContact CZ2-CD2 3.86Å; W77-W951 AromaticContact CZ2-CE2 3.11Å; W77-W951 HydrophobicContact CZ2-CG 4.16Å; W77-W951 HydrophobicContact CZ2-CH2 4.44Å; W77-W951 AromaticContact CZ2-CZ2 3.48Å; W77-W951 HydrophobicContact CZ2-CZ2 3.48Å; W77-W951 VanDerWaalsContact CZ2-CZ2 3.48Å; W77-W951 AromaticContact CZ2-NE1 2.87Å; W77-W951 AromaticContact CZ3-CZ2 3.86Å; W77-W951 HydrophobicContact CZ3-CZ2 3.86Å; W77-W951 AromaticContact NE1-CD2 3.11Å; W77-W951 AromaticContact NE1-CE2 3.13Å; W77-W951 AromaticContact NE1-CE3 3.21Å; W77-W951 AromaticContact NE1-CG 3.88Å; W77-W951 AromaticContact NE1-CH2 3.45Å; W77-W951 AromaticContact NE1-CZ2 3.33Å; W77-W951 VanDerWaalsContact NE1-CZ2 3.33Å; W77-W951 AromaticContact NE1-CZ3 3.36Å; W77-W951 AromaticContact NE1-NE1 3.77Å
78	N	73.5	Confident	76.1	Confident	81 Å²	81	69.5 Å²	69.5	43%	0.433	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-38.3	-179.3	-73.4	-20.6	0	0	0	111.5	L74 V75 Q76 N81 E82	L74-N78 PolarHBondContact O-N 3.35Å; V75-N78 PolarHBondContact O-N 2.85Å; Q76-N78 PolarHBondContact O-N 3.48Å; N78-N81 PolarHBondContact O-N 2.95Å; N78-E82 PolarHBondContact O-N 2.96Å; N78-E82 VanDerWaalsContact O-N 3.07Å
79	C	77.8	Confident	76.7	Confident	54 Å²	54	68.5 Å²	68.5	37%	0.365	33%	0.331	S	S	.	.	H	α-helix	trans	-66.4	-38	173.5	-66.8	0	0	0	0	113.4	V75 Q76 W77 R83	V75-C79 PolarHBondContact O-N 3.08Å; Q76-C79 WeakPolarHBondContact O-CB 3.26Å; Q76-C79 PolarHBondContact O-N 3.38Å; W77-C79 PolarHBondContact O-N 3.46Å; C79-R83 WeakPolarHBondContact O-CG 3.48Å; C79-R83 PolarHBondContact O-N 3.12Å
80	Y	73.5	Confident	77.4	Confident	50 Å²	50	65.9 Å²	65.9	20%	0.196	33%	0.326	C	S	.	.	H	α-helix	trans	-69.1	-40.1	173.9	-74	-65.5	0	0	0	112	Q76 W77 E82 R83 L84 N869 H873	Q76-Y80 HydrophobicContact CB-CE2 4.24Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.2Å; Q76-Y80 PolarHBondContact O-N 3.42Å; W77-Y80 CarbonylContact O-C 3.03Å; W77-Y80 WeakPolarHBondContact O-CA 3.49Å; W77-Y80 PolarHBondContact O-N 2.95Å; Y80-E82 VanDerWaalsContact C-N 3.33Å; Y80-E82 PolarHBondContact O-N 3.14Å; Y80-R83 PolarHBondContact O-N 3.21Å; Y80-R83 VanDerWaalsContact O-N 3.16Å; Y80-L84 WeakPolarHBondContact O-CB 3.35Å; Y80-L84 PolarHBondContact O-N 3.18Å; Y80-N869 HydrophobicContact CE1-CB 4.26Å; Y80-H873 AromaticContact CE2-CD2 3.41Å; Y80-H873 VanDerWaalsContact CE2-CD2 3.41Å; Y80-H873 WeakPolarHBondContact CE2-CD2 3.44Å; Y80-H873 AromaticContact CE2-CE1 3.52Å; Y80-H873 AromaticContact CE2-CG 3.88Å; Y80-H873 AromaticContact CE2-ND1 3.91Å; Y80-H873 AromaticContact CE2-NE2 3.12Å; Y80-H873 WeakPolarHBondContact CE2-NE2 3.37Å; Y80-H873 AromaticContact CZ-CE1 3.28Å; Y80-H873 AromaticContact CZ-ND1 3.89Å; Y80-H873 AromaticContact CZ-NE2 3.3Å; Y80-H873 VanDerWaalsContact CZ-NE2 3.3Å; Y80-H873 PolarHBondContact OH-CE1 3.23Å; Y80-H873 PolarHBondContact OH-NE2 3.4Å
81	N	73.7	Confident	78.1	Confident	39 Å²	39	65 Å²	65	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-58.7	-46.9	178	-167.7	36	0	0	0	110.1	W77 N78 R83 L84 W85	W77-N81 WeakPolarHBondContact O-CB 3.33Å; W77-N81 PolarHBondContact O-N 3.35Å; N78-N81 PolarHBondContact O-N 2.95Å; N81-R83 PolarHBondContact O-N 3.41Å; N81-L84 PolarHBondContact O-N 3.27Å; N81-W85 WeakPolarHBondContact O-CB 3.33Å; N81-W85 PolarHBondContact O-N 3.2Å; N81-W85 VanDerWaalsContact OD1-CD1 3.27Å; N81-W85 PolarHBondContact OD1-NE1 3.25Å
82	E	80.6	Confident	78.8	Confident	133 Å²	133	61.6 Å²	61.6	62%	0.621	30%	0.304	S	S	*	.	H	α-helix	trans	-59.1	-44.3	173.6	-83.1	-173.8	150.7	0	0	113.1	N78 Y80 W85 N86	N78-E82 PolarHBondContact O-N 2.96Å; N78-E82 VanDerWaalsContact O-N 3.07Å; Y80-E82 VanDerWaalsContact C-N 3.33Å; Y80-E82 PolarHBondContact O-N 3.14Å; E82-W85 PolarHBondContact O-N 3.4Å; E82-N86 WeakPolarHBondContact O-CB 3.16Å; E82-N86 PolarHBondContact O-N 3.26Å; E82-N86 PolarHBondContact O-ND2 3.29Å
83	R	84.2	Confident	79.4	Confident	122 Å²	122	59.7 Å²	59.7	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-65	-43.1	178.5	-68.8	177.8	-149.8	168.2	7.6	112.1	C79 Y80 N81 N86 A87	C79-R83 WeakPolarHBondContact O-CG 3.48Å; C79-R83 PolarHBondContact O-N 3.12Å; Y80-R83 PolarHBondContact O-N 3.21Å; Y80-R83 VanDerWaalsContact O-N 3.16Å; N81-R83 PolarHBondContact O-N 3.41Å; R83-N86 PolarHBondContact O-N 3.11Å; R83-A87 WeakPolarHBondContact O-CB 3.25Å; R83-A87 PolarHBondContact O-N 3.15Å
84	L	80.2	Confident	80	Confident	12 Å²	12	59 Å²	59	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-62.6	-44.8	176.2	-179.5	63.7	0	0	0	110.6	Y80 N81 A87 L88 E866 F867	Y80-L84 WeakPolarHBondContact O-CB 3.35Å; Y80-L84 PolarHBondContact O-N 3.18Å; N81-L84 PolarHBondContact O-N 3.27Å; L84-A87 PolarHBondContact O-N 2.92Å; L84-L88 HydrophobicContact CD1-CD1 4.11Å; L84-L88 HydrophobicContact CD1-CG 4.26Å; L84-L88 HydrophobicContact CG-CD1 3.88Å; L84-L88 HydrophobicContact CG-CG 4.44Å; L84-L88 WeakPolarHBondContact O-CB 3.3Å; L84-L88 VanDerWaalsContact O-CG 3.28Å; L84-L88 WeakPolarHBondContact O-CG 3.2Å; L84-L88 PolarHBondContact O-N 3.09Å; L84-E866 HydrophobicContact CB-CB 4.39Å; L84-E866 HydrophobicContact CD1-CB 3.81Å; L84-F867 HydrophobicContact CD1-CD1 4.19Å; L84-F867 HydrophobicContact CD1-CD2 4.07Å; L84-F867 HydrophobicContact CD1-CE1 4Å; L84-F867 HydrophobicContact CD1-CE2 3.91Å; L84-F867 HydrophobicContact CD1-CG 4.22Å; L84-F867 HydrophobicContact CD1-CZ 3.86Å; L84-F867 HydrophobicContact CD2-CD1 4.33Å; L84-F867 HydrophobicContact CD2-CE1 3.79Å; L84-F867 HydrophobicContact CD2-CZ 4.17Å
85	W	78.6	Confident	80.5	Confident	64 Å²	64	57.4 Å²	57.4	24%	0.242	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-48.4	173.9	-92	106.2	0	0	0	111.7	N81 E82 A87 L88 E89 L944 Y948	N81-W85 WeakPolarHBondContact O-CB 3.33Å; N81-W85 PolarHBondContact O-N 3.2Å; N81-W85 VanDerWaalsContact OD1-CD1 3.27Å; N81-W85 PolarHBondContact OD1-NE1 3.25Å; E82-W85 PolarHBondContact O-N 3.4Å; W85-A87 PolarHBondContact O-N 3.46Å; W85-L88 PolarHBondContact O-N 3.3Å; W85-E89 VanDerWaalsContact O-CB 3.28Å; W85-E89 WeakPolarHBondContact O-CB 3.45Å; W85-E89 PolarHBondContact O-N 3.08Å; W85-L944 HydrophobicContact CH2-CD2 4.44Å; W85-L944 HydrophobicContact CZ3-CD2 4.49Å; W85-Y948 AromaticContact CE2-CD2 3.8Å; W85-Y948 AromaticContact CZ2-CD2 3.6Å; W85-Y948 HydrophobicContact CZ2-CD2 3.6Å; W85-Y948 HydrophobicContact CZ2-CE2 4.48Å; W85-Y948 HydrophobicContact CZ2-CG 4.43Å; W85-Y948 AromaticContact NE1-CD2 3.74Å
86	N	86.7	Confident	80.8	Confident	101 Å²	101	56.9 Å²	56.9	54%	0.54	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-40.6	177.6	-71.5	-39.3	0	0	0	112.4	E82 R83 A90	E82-N86 WeakPolarHBondContact O-CB 3.16Å; E82-N86 PolarHBondContact O-N 3.26Å; E82-N86 PolarHBondContact O-ND2 3.29Å; R83-N86 PolarHBondContact O-N 3.11Å; N86-A90 WeakPolarHBondContact O-CB 3.24Å; N86-A90 PolarHBondContact O-N 3.34Å
87	A	84.9	Confident	81.5	Confident	7 Å²	7	58.2 Å²	58.2	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-41.8	176.8	0	0	0	0	0	111.8	R83 L84 W85 Y91 V863 E866	R83-A87 WeakPolarHBondContact O-CB 3.25Å; R83-A87 PolarHBondContact O-N 3.15Å; L84-A87 PolarHBondContact O-N 2.92Å; W85-A87 PolarHBondContact O-N 3.46Å; A87-Y91 WeakPolarHBondContact O-CB 3.26Å; A87-Y91 PolarHBondContact O-N 2.93Å; A87-V863 HydrophobicContact CB-CG2 3.94Å; A87-V863 WeakPolarHBondContact O-CG2 3.22Å; A87-E866 HydrophobicContact CB-CG 4.19Å
88	L	82.6	Confident	82.1	Confident	14 Å²	14	58 Å²	58	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-67.4	-40.8	176.7	-75.6	169.5	0	0	0	112	L84 W85 Y91 R92 V863 F867 I913 M947	L84-L88 HydrophobicContact CD1-CD1 4.11Å; L84-L88 HydrophobicContact CD1-CG 4.26Å; L84-L88 HydrophobicContact CG-CD1 3.88Å; L84-L88 HydrophobicContact CG-CG 4.44Å; L84-L88 WeakPolarHBondContact O-CB 3.3Å; L84-L88 VanDerWaalsContact O-CG 3.28Å; L84-L88 WeakPolarHBondContact O-CG 3.2Å; L84-L88 PolarHBondContact O-N 3.09Å; W85-L88 PolarHBondContact O-N 3.3Å; L88-Y91 PolarHBondContact O-N 3.26Å; L88-R92 VanDerWaalsContact O-CB 3.28Å; L88-R92 WeakPolarHBondContact O-CB 3.37Å; L88-R92 PolarHBondContact O-N 3.29Å; L88-V863 HydrophobicContact CD2-CG1 3.76Å; L88-V863 HydrophobicContact CD2-CG2 3.99Å; L88-V863 HydrophobicContact CG-CG2 4.32Å; L88-F867 HydrophobicContact CD2-CE2 4.39Å; L88-I913 HydrophobicContact CD2-CD1 4.24Å; L88-M947 HydrophobicContact CD1-CE 3.49Å; L88-M947 VanDerWaalsContact CD1-CE 3.49Å; L88-M947 HydrophobicContact CD1-SD 4.23Å
89	E	85.7	Confident	82.5	Confident	84 Å²	84	54.8 Å²	54.8	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-46.1	175.1	173.9	148.8	-122.8	0	0	111.2	W85 Y91 R92 D93	W85-E89 VanDerWaalsContact O-CB 3.28Å; W85-E89 WeakPolarHBondContact O-CB 3.45Å; W85-E89 PolarHBondContact O-N 3.08Å; E89-Y91 VanDerWaalsContact C-N 3.35Å; E89-Y91 PolarHBondContact O-N 2.81Å; E89-R92 WeakPolarHBondContact O-CB 3.35Å; E89-R92 PolarHBondContact O-N 3.28Å; E89-R92 IonicContact OE1-CZ 3.86Å; E89-R92 IonicContact OE1-NH1 3.97Å; E89-R92 PolarHBondContact OE1-NH1 3.2Å; E89-R92 IonicContact OE1-NH2 2.86Å; E89-R92 PolarHBondContact OE1-NH2 2.95Å; E89-D93 WeakPolarHBondContact O-CB 3.05Å; E89-D93 VanDerWaalsContact O-CG 3.26Å; E89-D93 PolarHBondContact O-N 3.03Å
90	A	87.7	Confident	82.9	Confident	26 Å²	26	56.8 Å²	56.8	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-39.6	176.2	0	0	0	0	0	112.3	N86 D93 S94 Y859	N86-A90 WeakPolarHBondContact O-CB 3.24Å; N86-A90 PolarHBondContact O-N 3.34Å; A90-D93 PolarHBondContact O-N 2.9Å; A90-S94 WeakPolarHBondContact O-CB 3.43Å; A90-S94 PolarHBondContact O-N 3.04Å; A90-S94 PolarHBondContact O-OG 3.21Å; A90-Y859 HydrophobicContact CB-CD1 3.44Å; A90-Y859 VanDerWaalsContact CB-CD1 3.44Å; A90-Y859 HydrophobicContact CB-CE1 3.53Å; A90-Y859 HydrophobicContact CB-CG 4.1Å
91	Y	85.1	Confident	83.5	Confident	26 Å²	26	55.1 Å²	55.1	10%	0.102	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-48	173	179.4	-116.9	0	0	0	111.5	A87 L88 E89 D93 S94 V95 A856 L860 V863 I913 G917	A87-Y91 WeakPolarHBondContact O-CB 3.26Å; A87-Y91 PolarHBondContact O-N 2.93Å; L88-Y91 PolarHBondContact O-N 3.26Å; E89-Y91 VanDerWaalsContact C-N 3.35Å; E89-Y91 PolarHBondContact O-N 2.81Å; Y91-D93 VanDerWaalsContact C-N 3.32Å; Y91-D93 PolarHBondContact O-N 2.91Å; Y91-S94 PolarHBondContact O-N 2.69Å; Y91-S94 PolarHBondContact O-OG 2.86Å; Y91-V95 HydrophobicContact CD1-CG2 4.34Å; Y91-V95 HydrophobicContact CD2-CG2 3.93Å; Y91-V95 HydrophobicContact CE1-CG2 3.96Å; Y91-V95 HydrophobicContact CE2-CG2 3.49Å; Y91-V95 VanDerWaalsContact CE2-CG2 3.49Å; Y91-V95 HydrophobicContact CG-CG2 4.33Å; Y91-V95 WeakPolarHBondContact O-CB 3.37Å; Y91-V95 VanDerWaalsContact O-CG2 3.27Å; Y91-V95 WeakPolarHBondContact O-CG2 3.07Å; Y91-V95 PolarHBondContact O-N 3.38Å; Y91-A856 WeakPolarHBondContact CD2-O 3.45Å; Y91-A856 HydrophobicContact CE2-CB 4.35Å; Y91-A856 WeakPolarHBondContact CE2-O 3.16Å; Y91-L860 HydrophobicContact CD2-CB 3.96Å; Y91-L860 HydrophobicContact CD2-CD1 4.48Å; Y91-L860 HydrophobicContact CE1-CD1 4.15Å; Y91-L860 HydrophobicContact CE2-CB 3.64Å; Y91-L860 HydrophobicContact CE2-CD1 3.91Å; Y91-L860 HydrophobicContact CE2-CG 4.28Å; Y91-V863 HydrophobicContact CG-CG2 4.38Å; Y91-I913 HydrophobicContact CD1-CG2 4.42Å; Y91-I913 HydrophobicContact CE1-CG2 4.01Å; Y91-G917 WeakPolarHBondContact OH-CA 3.46Å
92	R	84.3	Confident	84	Confident	106 Å²	106	54.4 Å²	54.4	40%	0.4	26%	0.264	S	S	.	.	H	α-helix	trans	-52.2	-51	174.5	179	-161.7	72.1	-159	-0	110.7	L88 E89 S94 V95 M96	L88-R92 VanDerWaalsContact O-CB 3.28Å; L88-R92 WeakPolarHBondContact O-CB 3.37Å; L88-R92 PolarHBondContact O-N 3.29Å; E89-R92 WeakPolarHBondContact O-CB 3.35Å; E89-R92 PolarHBondContact O-N 3.28Å; E89-R92 IonicContact OE1-CZ 3.86Å; E89-R92 IonicContact OE1-NH1 3.97Å; E89-R92 PolarHBondContact OE1-NH1 3.2Å; E89-R92 IonicContact OE1-NH2 2.86Å; E89-R92 PolarHBondContact OE1-NH2 2.95Å; R92-S94 PolarHBondContact O-N 3.02Å; R92-V95 PolarHBondContact O-N 3.01Å; R92-M96 VanDerWaalsContact O-CG 3.29Å; R92-M96 WeakPolarHBondContact O-CG 2.88Å; R92-M96 PolarHBondContact O-N 3.22Å
93	D	86.1	Confident	84.2	Confident	70 Å²	70	51 Å²	51	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-38.7	-177	-69.6	-2.8	0	0	0	112.1	E89 A90 Y91 M96 K97	E89-D93 WeakPolarHBondContact O-CB 3.05Å; E89-D93 VanDerWaalsContact O-CG 3.26Å; E89-D93 PolarHBondContact O-N 3.03Å; A90-D93 PolarHBondContact O-N 2.9Å; Y91-D93 VanDerWaalsContact C-N 3.32Å; Y91-D93 PolarHBondContact O-N 2.91Å; D93-M96 PolarHBondContact O-N 2.83Å; D93-K97 WeakPolarHBondContact O-CG 3.35Å; D93-K97 PolarHBondContact O-N 3.38Å; D93-K97 VanDerWaalsContact O-N 3.11Å
94	S	84.4	Confident	84.3	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-39.5	174.3	71.3	0	0	0	0	112.7	A90 Y91 R92 K97 V98 A856	A90-S94 WeakPolarHBondContact O-CB 3.43Å; A90-S94 PolarHBondContact O-N 3.04Å; A90-S94 PolarHBondContact O-OG 3.21Å; Y91-S94 PolarHBondContact O-N 2.69Å; Y91-S94 PolarHBondContact O-OG 2.86Å; R92-S94 PolarHBondContact O-N 3.02Å; S94-K97 WeakPolarHBondContact O-CB 3.44Å; S94-K97 PolarHBondContact O-N 3.41Å; S94-K97 VanDerWaalsContact O-N 3.16Å; S94-V98 PolarHBondContact O-N 3.2Å; S94-A856 VanDerWaalsContact OG-CA 3.24Å; S94-A856 WeakPolarHBondContact OG-CA 3.43Å; S94-A856 WeakPolarHBondContact OG-CB 3.47Å
95	V	81.8	Confident	84.5	Confident	14 Å²	14	47 Å²	47	9%	0.085	25%	0.246	C	C	.	.	H	α-helix	trans	-68.6	-35.6	175.8	168.2	0	0	0	0	111.5	Y91 R92 K97 V98 S99 A856 L935	Y91-V95 HydrophobicContact CD1-CG2 4.34Å; Y91-V95 HydrophobicContact CD2-CG2 3.93Å; Y91-V95 HydrophobicContact CE1-CG2 3.96Å; Y91-V95 HydrophobicContact CE2-CG2 3.49Å; Y91-V95 VanDerWaalsContact CE2-CG2 3.49Å; Y91-V95 HydrophobicContact CG-CG2 4.33Å; Y91-V95 WeakPolarHBondContact O-CB 3.37Å; Y91-V95 VanDerWaalsContact O-CG2 3.27Å; Y91-V95 WeakPolarHBondContact O-CG2 3.07Å; Y91-V95 PolarHBondContact O-N 3.38Å; R92-V95 PolarHBondContact O-N 3.01Å; V95-K97 VanDerWaalsContact C-N 3.29Å; V95-K97 PolarHBondContact O-N 2.94Å; V95-V98 WeakPolarHBondContact O-CB 3.41Å; V95-V98 PolarHBondContact O-N 2.95Å; V95-S99 PolarHBondContact O-N 3.4Å; V95-A856 HydrophobicContact CG2-CB 4.17Å; V95-L935 HydrophobicContact CG1-CD2 3.12Å; V95-L935 HydrophobicContact CG1-CG 4.42Å
96	M	84.2	Confident	84.9	Confident	76 Å²	76	46.7 Å²	46.7	37%	0.374	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-40.7	170.3	-69.2	-60.9	-71.4	0	0	111	R92 D93 S99 V100 R939	R92-M96 VanDerWaalsContact O-CG 3.29Å; R92-M96 WeakPolarHBondContact O-CG 2.88Å; R92-M96 PolarHBondContact O-N 3.22Å; D93-M96 PolarHBondContact O-N 2.83Å; M96-S99 PolarHBondContact O-N 2.92Å; M96-V100 VanDerWaalsContact O-CG2 3.28Å; M96-V100 WeakPolarHBondContact O-CG2 3.43Å; M96-V100 PolarHBondContact O-N 3.3Å; M96-R939 PolarHBondContact SD-NE 3.2Å; M96-R939 PolarHBondContact SD-NH2 3.37Å
97	K	85.6	Confident	85	Confident	129 Å²	129	48.5 Å²	48.5	56%	0.561	25%	0.253	S	S	*	.	H	α-helix	trans	-63.7	-40.2	174.1	-65.7	169.7	-174.3	172.8	0	112.2	D93 S94 V95 V100 A101 A852	D93-K97 WeakPolarHBondContact O-CG 3.35Å; D93-K97 PolarHBondContact O-N 3.38Å; D93-K97 VanDerWaalsContact O-N 3.11Å; S94-K97 WeakPolarHBondContact O-CB 3.44Å; S94-K97 PolarHBondContact O-N 3.41Å; S94-K97 VanDerWaalsContact O-N 3.16Å; V95-K97 VanDerWaalsContact C-N 3.29Å; V95-K97 PolarHBondContact O-N 2.94Å; K97-V100 PolarHBondContact O-N 2.88Å; K97-A101 WeakPolarHBondContact O-CB 3.49Å; K97-A101 PolarHBondContact O-N 2.88Å; K97-A852 HydrophobicContact CB-CB 4.32Å
98	V	82.3	Confident	85.2	Confident	9 Å²	9	49.1 Å²	49.1	6%	0.055	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-50.1	173.3	174.8	0	0	0	0	110.3	S94 V95 V100 A101 E102 F849 A852 I853 A856	S94-V98 PolarHBondContact O-N 3.2Å; V95-V98 WeakPolarHBondContact O-CB 3.41Å; V95-V98 PolarHBondContact O-N 2.95Å; V98-V100 VanDerWaalsContact C-N 3.35Å; V98-V100 PolarHBondContact O-N 3.39Å; V98-A101 PolarHBondContact O-N 3.42Å; V98-E102 WeakPolarHBondContact O-CB 3.42Å; V98-E102 PolarHBondContact O-N 3.45Å; V98-F849 HydrophobicContact CG1-CD2 4.16Å; V98-F849 HydrophobicContact CG1-CE2 3.62Å; V98-F849 HydrophobicContact CG1-CZ 4.45Å; V98-A852 HydrophobicContact CB-CB 4.39Å; V98-A852 HydrophobicContact CG2-CB 3.7Å; V98-A852 WeakPolarHBondContact CG2-O 3.1Å; V98-I853 HydrophobicContact CG1-CG1 4.03Å; V98-I853 HydrophobicContact CG2-CG1 4.14Å; V98-A856 HydrophobicContact CG2-CB 4.05Å
99	S	82.8	Confident	85.4	Confident	13 Å²	13	53.2 Å²	53.2	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-39.2	-180	175.4	0	0	0	0	112.8	V95 M96 S103 R939	V95-S99 PolarHBondContact O-N 3.4Å; M96-S99 PolarHBondContact O-N 2.92Å; S99-S103 WeakPolarHBondContact O-CB 3.47Å; S99-S103 PolarHBondContact O-N 2.67Å; S99-S103 PolarHBondContact O-OG 2.94Å; S99-R939 VanDerWaalsContact CB-NH2 3.28Å; S99-R939 PolarHBondContact OG-NH2 2.99Å
100	V	86.8	Confident	85.5	Confident	96 Å²	96	55.7 Å²	55.7	58%	0.582	28%	0.283	S	S	*	.	H	α-helix	trans	-66.8	-44	174.7	169.7	0	0	0	0	110.9	M96 K97 V98 S103 A104	M96-V100 VanDerWaalsContact O-CG2 3.28Å; M96-V100 WeakPolarHBondContact O-CG2 3.43Å; M96-V100 PolarHBondContact O-N 3.3Å; K97-V100 PolarHBondContact O-N 2.88Å; V98-V100 VanDerWaalsContact C-N 3.35Å; V98-V100 PolarHBondContact O-N 3.39Å; V100-S103 PolarHBondContact O-N 3.25Å; V100-A104 WeakPolarHBondContact O-CB 3.44Å; V100-A104 PolarHBondContact O-N 3.1Å
101	A	84.4	Confident	85.6	Confident	15 Å²	15	57.5 Å²	57.5	12%	0.124	29%	0.287	C	S	.	.	H	α-helix	trans	-65.9	-39.3	178	0	0	0	0	0	112.1	K97 V98 A104 I105 F849	K97-A101 WeakPolarHBondContact O-CB 3.49Å; K97-A101 PolarHBondContact O-N 2.88Å; V98-A101 PolarHBondContact O-N 3.42Å; A101-A104 PolarHBondContact O-N 3.02Å; A101-I105 WeakPolarHBondContact O-CG1 3.42Å; A101-I105 PolarHBondContact O-N 3.17Å; A101-F849 HydrophobicContact CB-CB 3.92Å; A101-F849 HydrophobicContact CB-CD2 4.14Å
102	E	84.7	Confident	85.8	Confident	25 Å²	25	56.4 Å²	56.4	12%	0.117	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-49.5	172.7	-170.2	176	-165.5	0	0	111.2	V98 A104 I105 E106 F849	V98-E102 WeakPolarHBondContact O-CB 3.42Å; V98-E102 PolarHBondContact O-N 3.45Å; E102-A104 PolarHBondContact O-N 3.3Å; E102-I105 WeakPolarHBondContact O-CA 3.41Å; E102-I105 WeakPolarHBondContact O-CB 3.34Å; E102-I105 PolarHBondContact O-N 3Å; E102-E106 PolarHBondContact O-N 2.86Å; E102-F849 HydrophobicContact CB-CD2 4.01Å; E102-F849 HydrophobicContact CB-CE2 3.69Å; E102-F849 HydrophobicContact CG-CE2 4.15Å
103	S	84.5	Confident	86	Confident	61 Å²	61	55.6 Å²	55.6	43%	0.427	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-38.3	178.3	-58.4	0	0	0	0	111.5	S99 V100 E106 E107	S99-S103 WeakPolarHBondContact O-CB 3.47Å; S99-S103 PolarHBondContact O-N 2.67Å; S99-S103 PolarHBondContact O-OG 2.94Å; V100-S103 PolarHBondContact O-N 3.25Å; S103-E106 PolarHBondContact O-N 3.5Å; S103-E107 WeakPolarHBondContact O-CB 3.22Å; S103-E107 PolarHBondContact O-N 3.2Å
104	A	87.7	Confident	86	Confident	31 Å²	31	53.3 Å²	53.3	26%	0.256	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-38.6	174.7	0	0	0	0	0	112.2	V100 A101 E102 I108	V100-A104 WeakPolarHBondContact O-CB 3.44Å; V100-A104 PolarHBondContact O-N 3.1Å; A101-A104 PolarHBondContact O-N 3.02Å; E102-A104 PolarHBondContact O-N 3.3Å; A104-I108 WeakPolarHBondContact O-CB 3.29Å; A104-I108 WeakPolarHBondContact O-CD1 3.26Å; A104-I108 WeakPolarHBondContact O-CG1 3.43Å; A104-I108 PolarHBondContact O-N 3.49Å
105	I	84.8	Confident	86.2	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-48.4	172.7	-66.7	165.2	0	0	0	110	A101 E102 E107 I108 E109 I846 F849	A101-I105 WeakPolarHBondContact O-CG1 3.42Å; A101-I105 PolarHBondContact O-N 3.17Å; E102-I105 WeakPolarHBondContact O-CA 3.41Å; E102-I105 WeakPolarHBondContact O-CB 3.34Å; E102-I105 PolarHBondContact O-N 3Å; I105-E107 VanDerWaalsContact C-N 3.31Å; I105-E107 PolarHBondContact O-N 3.29Å; I105-I108 CarbonylContact O-C 3.57Å; I105-I108 PolarHBondContact O-N 2.87Å; I105-E109 HydrophobicContact CG2-CG 4.22Å; I105-E109 WeakPolarHBondContact O-CB 3.46Å; I105-E109 WeakPolarHBondContact O-CG 3.47Å; I105-E109 PolarHBondContact O-N 3.15Å; I105-I846 HydrophobicContact CD1-CG1 4Å; I105-I846 HydrophobicContact CG1-CG1 4.29Å; I105-F849 HydrophobicContact CD1-CB 3.5Å; I105-F849 HydrophobicContact CD1-CD1 4.16Å; I105-F849 HydrophobicContact CD1-CD2 4.38Å; I105-F849 HydrophobicContact CD1-CG 3.78Å
106	E	85.3	Confident	86.6	Confident	57 Å²	57	58.1 Å²	58.1	27%	0.266	29%	0.288	S	S	.	.	H	α-helix	trans	-59.6	-40.8	178.5	-71.3	-170.4	178.9	0	0	112.4	E102 S103 E109 K110	E102-E106 PolarHBondContact O-N 2.86Å; S103-E106 PolarHBondContact O-N 3.5Å; E106-E109 PolarHBondContact O-N 3.21Å; E106-K110 WeakPolarHBondContact O-CB 3.42Å; E106-K110 WeakPolarHBondContact O-CD 3.34Å; E106-K110 WeakPolarHBondContact O-CG 3.42Å; E106-K110 PolarHBondContact O-N 2.83Å; E106-K110 IonicContact OE2-NZ 3.95Å
107	E	88.7	Confident	86.8	Confident	140 Å²	140	57.2 Å²	57.2	65%	0.654	29%	0.285	S	S	*	.	H	α-helix	trans	-65.8	-43.4	177.2	-171.7	172.8	-163.4	0	0	111.1	S103 I105 K110 E111	S103-E107 WeakPolarHBondContact O-CB 3.22Å; S103-E107 PolarHBondContact O-N 3.2Å; I105-E107 VanDerWaalsContact C-N 3.31Å; I105-E107 PolarHBondContact O-N 3.29Å; E107-K110 PolarHBondContact O-N 3.3Å; E107-E111 WeakPolarHBondContact O-CB 3.16Å; E107-E111 PolarHBondContact O-N 2.91Å
108	I	89.2	Confident	86.9	Confident	19 Å²	19	51.3 Å²	51.3	10%	0.097	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-41	174	-71.1	164.6	0	0	0	111.2	A104 I105 E111 L112 M838 K841 R842 S845	A104-I108 WeakPolarHBondContact O-CB 3.29Å; A104-I108 WeakPolarHBondContact O-CD1 3.26Å; A104-I108 WeakPolarHBondContact O-CG1 3.43Å; A104-I108 PolarHBondContact O-N 3.49Å; I105-I108 CarbonylContact O-C 3.57Å; I105-I108 PolarHBondContact O-N 2.87Å; I108-E111 PolarHBondContact O-N 3.49Å; I108-L112 HydrophobicContact CG2-CD1 3.99Å; I108-L112 HydrophobicContact CG2-CG 4.38Å; I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 WeakPolarHBondContact O-CG 3.42Å; I108-L112 PolarHBondContact O-N 3.29Å; I108-M838 HydrophobicContact CB-CE 4.12Å; I108-M838 HydrophobicContact CG1-CE 3.96Å; I108-M838 HydrophobicContact CG2-CE 3.83Å; I108-K841 HydrophobicContact CD1-CB 4.24Å; I108-R842 HydrophobicContact CG2-CB 3.51Å; I108-R842 HydrophobicContact CG2-CG 4Å; I108-S845 WeakPolarHBondContact CD1-OG 3.29Å
109	E	87.5	Confident	87.1	Confident	101 Å²	101	52.1 Å²	52.1	47%	0.472	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-40.6	177.5	-77	-176.5	167.2	0	0	112.1	I105 E106 E111 L112 Q113	I105-E109 HydrophobicContact CG2-CG 4.22Å; I105-E109 WeakPolarHBondContact O-CB 3.46Å; I105-E109 WeakPolarHBondContact O-CG 3.47Å; I105-E109 PolarHBondContact O-N 3.15Å; E106-E109 PolarHBondContact O-N 3.21Å; E109-E111 VanDerWaalsContact C-N 3.32Å; E109-L112 PolarHBondContact O-N 3.31Å; E109-Q113 WeakPolarHBondContact O-CB 3.16Å; E109-Q113 PolarHBondContact O-N 2.69Å
110	K	88.6	Confident	87.4	Confident	135 Å²	135	55.9 Å²	55.9	59%	0.587	28%	0.281	S	S	*	.	H	α-helix	trans	-61.3	-42.2	172.5	-74.6	165.4	-171.9	159.6	0	111.1	E106 E107 Q113 L114	E106-K110 WeakPolarHBondContact O-CB 3.42Å; E106-K110 WeakPolarHBondContact O-CD 3.34Å; E106-K110 WeakPolarHBondContact O-CG 3.42Å; E106-K110 PolarHBondContact O-N 2.83Å; E106-K110 IonicContact OE2-NZ 3.95Å; E107-K110 PolarHBondContact O-N 3.3Å; K110-Q113 PolarHBondContact O-N 3.14Å; K110-L114 WeakPolarHBondContact O-CB 3.14Å; K110-L114 PolarHBondContact O-N 3.43Å
111	E	88.3	Confident	87.4	Confident	64 Å²	64	52.7 Å²	52.7	30%	0.299	26%	0.259	S	S	.	.	H	α-helix	trans	-68.7	-42.6	177.2	-161.3	63.2	-149.6	0	0	111.6	E107 I108 E109 Q113 L114 L115 K806 M838	E107-E111 WeakPolarHBondContact O-CB 3.16Å; E107-E111 PolarHBondContact O-N 2.91Å; I108-E111 PolarHBondContact O-N 3.49Å; E109-E111 VanDerWaalsContact C-N 3.32Å; E111-Q113 VanDerWaalsContact C-N 3.35Å; E111-Q113 PolarHBondContact O-N 3.13Å; E111-L114 PolarHBondContact O-N 3.45Å; E111-L115 WeakPolarHBondContact O-CG 3.48Å; E111-L115 PolarHBondContact O-N 3.42Å; E111-K806 IonicContact OE1-NZ 3.81Å; E111-K806 IonicContact OE2-NZ 3.66Å; E111-K806 PolarHBondContact OE2-NZ 3.22Å; E111-M838 HydrophobicContact CB-CE 3.84Å; E111-M838 HydrophobicContact CG-CE 4Å
112	L	89.6	Confident	87.5	Confident	3 Å²	3	52 Å²	52	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-44	173.3	-84.7	171.4	0	0	0	111.8	I108 E109 L114 L115 R116 I835 M838 R842	I108-L112 HydrophobicContact CG2-CD1 3.99Å; I108-L112 HydrophobicContact CG2-CG 4.38Å; I108-L112 WeakPolarHBondContact O-CB 3.43Å; I108-L112 WeakPolarHBondContact O-CG 3.42Å; I108-L112 PolarHBondContact O-N 3.29Å; E109-L112 PolarHBondContact O-N 3.31Å; L112-L114 VanDerWaalsContact C-N 3.31Å; L112-L115 PolarHBondContact O-N 3.22Å; L112-R116 VanDerWaalsContact O-CG 3.22Å; L112-R116 WeakPolarHBondContact O-CG 3.4Å; L112-R116 PolarHBondContact O-N 3.47Å; L112-I835 HydrophobicContact CD2-CG2 4.18Å; L112-M838 HydrophobicContact CD2-CB 3.51Å; L112-M838 HydrophobicContact CG-CB 3.86Å; L112-R842 HydrophobicContact CD1-CB 4.13Å; L112-R842 HydrophobicContact CD1-CG 4.37Å
113	Q	88.9	Confident	87.5	Confident	90 Å²	90	53 Å²	53	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-44.6	176.3	-175.2	57.6	33.8	0	0	110.3	E109 K110 E111 L115 R116 D117	E109-Q113 WeakPolarHBondContact O-CB 3.16Å; E109-Q113 PolarHBondContact O-N 2.69Å; K110-Q113 PolarHBondContact O-N 3.14Å; E111-Q113 VanDerWaalsContact C-N 3.35Å; E111-Q113 PolarHBondContact O-N 3.13Å; Q113-L115 PolarHBondContact O-N 3.06Å; Q113-R116 WeakPolarHBondContact O-CB 3.32Å; Q113-R116 PolarHBondContact O-N 3.18Å; Q113-D117 PolarHBondContact NE2-OD1 3.46Å; Q113-D117 WeakPolarHBondContact O-CB 3.03Å; Q113-D117 PolarHBondContact O-N 2.96Å
114	L	86.5	Confident	87.6	Confident	21 Å²	21	55.5 Å²	55.5	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-38.2	177.7	-172.8	136.8	0	0	0	112.8	K110 E111 L112 R116 D117 R118 K806	K110-L114 WeakPolarHBondContact O-CB 3.14Å; K110-L114 PolarHBondContact O-N 3.43Å; E111-L114 PolarHBondContact O-N 3.45Å; L112-L114 VanDerWaalsContact C-N 3.31Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-D117 PolarHBondContact O-N 3.36Å; L114-R118 VanDerWaalsContact O-CB 3.26Å; L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 PolarHBondContact O-N 3.28Å; L114-K806 HydrophobicContact CD1-CD 3.46Å; L114-K806 VanDerWaalsContact CD1-CD 3.46Å; L114-K806 HydrophobicContact CD1-CG 4.2Å; L114-K806 HydrophobicContact CD2-CB 4.02Å; L114-K806 HydrophobicContact CD2-CD 3.53Å; L114-K806 HydrophobicContact CD2-CG 4.35Å; L114-K806 HydrophobicContact CG-CD 4.07Å
115	L	88.7	Confident	87.4	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-37.5	174.4	-70.5	172.5	0	0	0	111.7	E111 L112 Q113 R118 N119 T831 E834 I835 M838	E111-L115 WeakPolarHBondContact O-CG 3.48Å; E111-L115 PolarHBondContact O-N 3.42Å; L112-L115 PolarHBondContact O-N 3.22Å; Q113-L115 PolarHBondContact O-N 3.06Å; L115-R118 WeakPolarHBondContact O-CB 3.37Å; L115-R118 PolarHBondContact O-N 2.99Å; L115-N119 PolarHBondContact O-N 3.17Å; L115-T831 HydrophobicContact CB-CG2 4.38Å; L115-T831 HydrophobicContact CD2-CG2 4.19Å; L115-T831 WeakPolarHBondContact O-CG2 3.43Å; L115-E834 HydrophobicContact CD1-CB 4.02Å; L115-E834 HydrophobicContact CD2-CB 4.13Å; L115-E834 WeakPolarHBondContact CD2-OE2 3.17Å; L115-I835 HydrophobicContact CB-CD1 4.17Å; L115-I835 HydrophobicContact CB-CG1 3.54Å; L115-I835 HydrophobicContact CD1-CG1 4.2Å; L115-I835 HydrophobicContact CG-CG1 4.48Å; L115-M838 HydrophobicContact CD1-CB 4.3Å; L115-M838 HydrophobicContact CD1-CG 3.73Å
116	R	90.4	Very high	87.2	Confident	108 Å²	108	58 Å²	58	41%	0.408	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-46.8	172.7	-70.7	165.5	-177.8	174.7	0.1	111.4	L112 Q113 L114 R118 N119 I120 I835	L112-R116 VanDerWaalsContact O-CG 3.22Å; L112-R116 WeakPolarHBondContact O-CG 3.4Å; L112-R116 PolarHBondContact O-N 3.47Å; Q113-R116 WeakPolarHBondContact O-CB 3.32Å; Q113-R116 PolarHBondContact O-N 3.18Å; L114-R116 VanDerWaalsContact C-N 3.34Å; R116-R118 VanDerWaalsContact C-N 3.26Å; R116-R118 PolarHBondContact O-N 2.98Å; R116-N119 WeakPolarHBondContact O-CB 3.27Å; R116-N119 PolarHBondContact O-N 2.9Å; R116-N119 VanDerWaalsContact O-N 3.11Å; R116-I120 WeakPolarHBondContact O-CG1 3.45Å; R116-I120 PolarHBondContact O-N 2.91Å; R116-I835 HydrophobicContact CG-CD1 4.35Å
117	D	87.9	Confident	86.9	Confident	57 Å²	57	58.7 Å²	58.7	31%	0.305	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-38.8	176.2	-62.3	-21.3	0	0	0	110.2	Q113 L114 N119 I120 Y121 L803	Q113-D117 PolarHBondContact NE2-OD1 3.46Å; Q113-D117 WeakPolarHBondContact O-CB 3.03Å; Q113-D117 PolarHBondContact O-N 2.96Å; L114-D117 PolarHBondContact O-N 3.36Å; D117-N119 VanDerWaalsContact C-N 3.33Å; D117-N119 PolarHBondContact O-N 3.44Å; D117-I120 WeakPolarHBondContact O-CB 3.46Å; D117-I120 PolarHBondContact O-N 3.45Å; D117-Y121 WeakPolarHBondContact O-CB 3.45Å; D117-Y121 PolarHBondContact O-N 3.48Å; D117-L803 HydrophobicContact CB-CD1 3.48Å; D117-L803 VanDerWaalsContact CB-CD1 3.48Å
118	R	86.6	Confident	86.5	Confident	6 Å²	6	55.3 Å²	55.3	2%	0.023	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-43	173.6	173.5	179.2	165.3	-161.7	-10.4	111.4	L114 L115 R116 I120 Y121 L122 L803 L807 T831 E834	L114-R118 VanDerWaalsContact O-CB 3.26Å; L114-R118 WeakPolarHBondContact O-CB 3.47Å; L114-R118 PolarHBondContact O-N 3.28Å; L115-R118 WeakPolarHBondContact O-CB 3.37Å; L115-R118 PolarHBondContact O-N 2.99Å; R116-R118 VanDerWaalsContact C-N 3.26Å; R116-R118 PolarHBondContact O-N 2.98Å; R118-I120 VanDerWaalsContact C-N 3.34Å; R118-Y121 PolarHBondContact O-N 3.27Å; R118-L122 HydrophobicContact CG-CD1 3.94Å; R118-L122 HydrophobicContact CG-CG 4.3Å; R118-L122 WeakPolarHBondContact O-CB 3.49Å; R118-L122 WeakPolarHBondContact O-CG 3.24Å; R118-L122 PolarHBondContact O-N 2.84Å; R118-L803 HydrophobicContact CB-CD2 4.27Å; R118-L807 HydrophobicContact CG-CD2 3.78Å; R118-L807 HydrophobicContact CG-CG 4.09Å; R118-T831 HydrophobicContact CB-CG2 4.28Å; R118-T831 HydrophobicContact CG-CG2 3.99Å; R118-T831 PolarHBondContact NE-OG1 3Å; R118-T831 PolarHBondContact NH2-OG1 2.84Å; R118-E834 IonicContact CZ-OE2 2.87Å; R118-E834 IonicContact NH1-OE1 2.75Å; R118-E834 IonicContact NH1-OE2 3.27Å; R118-E834 PolarHBondContact NH1-OE2 3.19Å; R118-E834 IonicContact NH2-OE2 3.21Å
119	N	88.2	Confident	85.9	Confident	25 Å²	25	61 Å²	61	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-40.5	174.7	-99.2	-11.9	0	0	0	112.6	L115 R116 D117 L122 A123 T831 D832 I835	L115-N119 PolarHBondContact O-N 3.17Å; R116-N119 WeakPolarHBondContact O-CB 3.27Å; R116-N119 PolarHBondContact O-N 2.9Å; R116-N119 VanDerWaalsContact O-N 3.11Å; D117-N119 VanDerWaalsContact C-N 3.33Å; D117-N119 PolarHBondContact O-N 3.44Å; N119-L122 PolarHBondContact O-N 3.3Å; N119-A123 WeakPolarHBondContact O-CB 3.49Å; N119-A123 PolarHBondContact O-N 3.26Å; N119-T831 VanDerWaalsContact OD1-CB 3.28Å; N119-T831 WeakPolarHBondContact OD1-CB 3.41Å; N119-T831 WeakPolarHBondContact OD1-CG2 3.35Å; N119-D832 PolarHBondContact ND2-OD1 3.37Å; N119-I835 VanDerWaalsContact ND2-CD1 3.25Å; N119-I835 WeakPolarHBondContact ND2-CD1 3.48Å
120	I	88.2	Confident	85.5	Confident	92 Å²	92	63.2 Å²	63.2	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-50.2	174.2	-64	166.9	0	0	0	109.9	R116 D117 R118 L122 A123 E124	R116-I120 WeakPolarHBondContact O-CG1 3.45Å; R116-I120 PolarHBondContact O-N 2.91Å; D117-I120 WeakPolarHBondContact O-CB 3.46Å; D117-I120 PolarHBondContact O-N 3.45Å; R118-I120 VanDerWaalsContact C-N 3.34Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 2.67Å; I120-A123 WeakPolarHBondContact O-CB 3.29Å; I120-A123 PolarHBondContact O-N 3.16Å; I120-A123 VanDerWaalsContact O-N 3.09Å; I120-E124 WeakPolarHBondContact O-CG 3.48Å; I120-E124 PolarHBondContact O-N 3.35Å
121	Y	86.9	Confident	85.1	Confident	29 Å²	29	57.4 Å²	57.4	11%	0.114	30%	0.304	C	S	.	.	H	α-helix	trans	-59.4	-40.3	178.7	-174.8	-100.5	0	0	0	112.8	D117 R118 A125 H131 I133 L803 E804 L807	D117-Y121 WeakPolarHBondContact O-CB 3.45Å; D117-Y121 PolarHBondContact O-N 3.48Å; R118-Y121 PolarHBondContact O-N 3.27Å; Y121-A125 WeakPolarHBondContact O-CB 3.45Å; Y121-A125 PolarHBondContact O-N 2.93Å; Y121-H131 AromaticContact CD1-CE1 3.82Å; Y121-H131 AromaticContact CD2-CE1 3.64Å; Y121-H131 AromaticContact CD2-NE2 3.82Å; Y121-H131 AromaticContact CE1-CE1 3.45Å; Y121-H131 VanDerWaalsContact CE1-CE1 3.45Å; Y121-H131 WeakPolarHBondContact CE1-CE1 3.35Å; Y121-H131 AromaticContact CE2-CE1 3.2Å; Y121-H131 WeakPolarHBondContact CE2-CE1 3.33Å; Y121-H131 AromaticContact CE2-NE2 3.55Å; Y121-H131 AromaticContact CG-CE1 3.93Å; Y121-H131 AromaticContact CZ-CE1 3.1Å; Y121-H131 AromaticContact CZ-ND1 3.88Å; Y121-H131 AromaticContact CZ-NE2 3.92Å; Y121-H131 PolarHBondContact OH-CE1 3.4Å; Y121-I133 HydrophobicContact CD1-CD1 4.3Å; Y121-I133 HydrophobicContact CE1-CB 3.92Å; Y121-I133 HydrophobicContact CE1-CD1 3.93Å; Y121-I133 HydrophobicContact CE1-CG1 4.03Å; Y121-I133 PolarHBondContact OH-N 2.91Å; Y121-L803 HydrophobicContact CD1-CD2 3.83Å; Y121-L803 HydrophobicContact CD2-CD2 4.48Å; Y121-L803 HydrophobicContact CE1-CD2 4.45Å; Y121-L803 HydrophobicContact CG-CD2 3.83Å; Y121-E804 PolarHBondContact OH-OE1 3.22Å; Y121-E804 VanDerWaalsContact OH-OE1 3.08Å; Y121-L807 HydrophobicContact CD1-CD1 3.41Å; Y121-L807 VanDerWaalsContact CD1-CD1 3.41Å; Y121-L807 HydrophobicContact CE1-CD1 3.51Å; Y121-L807 HydrophobicContact CG-CD1 4.48Å
122	L	85.7	Confident	84.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-70.3	-34.9	175.2	-69.6	174	0	0	0	112.3	R118 N119 I120 K126 I133 L807 L824 L827 M828	R118-L122 HydrophobicContact CG-CD1 3.94Å; R118-L122 HydrophobicContact CG-CG 4.3Å; R118-L122 WeakPolarHBondContact O-CB 3.49Å; R118-L122 WeakPolarHBondContact O-CG 3.24Å; R118-L122 PolarHBondContact O-N 2.84Å; N119-L122 PolarHBondContact O-N 3.3Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 2.67Å; L122-K126 PolarHBondContact O-N 3.37Å; L122-K126 VanDerWaalsContact O-N 3.14Å; L122-I133 HydrophobicContact CD2-CD1 3.49Å; L122-I133 VanDerWaalsContact CD2-CD1 3.49Å; L122-L807 HydrophobicContact CD2-CD2 4.36Å; L122-L824 HydrophobicContact CD2-CD2 3.93Å; L122-L827 HydrophobicContact CD1-CB 4.08Å; L122-M828 HydrophobicContact CB-CG 3.63Å; L122-M828 HydrophobicContact CB-SD 4.34Å; L122-M828 HydrophobicContact CD1-CG 4.04Å; L122-M828 HydrophobicContact CG-CG 4.47Å
123	A	85.4	Confident	84.4	Confident	48 Å²	48	57.4 Å²	57.4	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-40.7	175	0	0	0	0	0	111.9	N119 I120 K126 M828	N119-A123 WeakPolarHBondContact O-CB 3.49Å; N119-A123 PolarHBondContact O-N 3.26Å; I120-A123 WeakPolarHBondContact O-CB 3.29Å; I120-A123 PolarHBondContact O-N 3.16Å; I120-A123 VanDerWaalsContact O-N 3.09Å; A123-K126 WeakPolarHBondContact O-CB 3.28Å; A123-K126 PolarHBondContact O-N 3.22Å; A123-M828 HydrophobicContact CB-CE 3.96Å
124	E	86.2	Confident	84	Confident	113 Å²	113	56.5 Å²	56.5	53%	0.528	30%	0.304	S	S	.	.	H	α-helix	trans	-62.2	-46.2	173.1	-71.6	175.5	177.1	0	0	111.2	I120 K126 G127 D128	I120-E124 WeakPolarHBondContact O-CG 3.48Å; I120-E124 PolarHBondContact O-N 3.35Å; E124-K126 PolarHBondContact O-N 2.75Å; E124-G127 WeakPolarHBondContact O-CA 3.43Å; E124-G127 PolarHBondContact O-N 3.32Å; E124-D128 PolarHBondContact O-N 3.45Å; E124-D128 VanDerWaalsContact O-N 3.16Å
125	A	84.2	Confident	83.8	Confident	3 Å²	3	58.9 Å²	58.9	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-57.7	-30	175.2	0	0	0	0	0	113.9	Y121 G127 H131 I133 L824	Y121-A125 WeakPolarHBondContact O-CB 3.45Å; Y121-A125 PolarHBondContact O-N 2.93Å; A125-G127 PolarHBondContact O-N 3.01Å; A125-H131 HydrophobicContact CB-CB 4.21Å; A125-H131 WeakPolarHBondContact CB-ND1 3.47Å; A125-I133 HydrophobicContact CB-CG2 3.82Å; A125-L824 HydrophobicContact CB-CD1 4.14Å; A125-L824 HydrophobicContact CB-CD2 4.21Å
126	K	79.7	Confident	83.4	Confident	99 Å²	99	58.6 Å²	58.6	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-67.3	-28	176.3	-170.3	179.6	178.1	179.1	0	111.9	L122 A123 E124 L824	L122-K126 PolarHBondContact O-N 3.37Å; L122-K126 VanDerWaalsContact O-N 3.14Å; A123-K126 WeakPolarHBondContact O-CB 3.28Å; A123-K126 PolarHBondContact O-N 3.22Å; E124-K126 PolarHBondContact O-N 2.75Å; K126-L824 HydrophobicContact CB-CD1 4.24Å
127	G	78.8	Confident	82.8	Confident	72 Å²	72	56.6 Å²	56.6	74%	0.742	32%	0.321	S	S	*	.	H	α-helix	trans	-90.4	-24	179.4	0	0	0	0	0	114.8	E124 A125	E124-G127 WeakPolarHBondContact O-CA 3.43Å; E124-G127 PolarHBondContact O-N 3.32Å; A125-G127 PolarHBondContact O-N 3.01Å
128	D	80.8	Confident	82.4	Confident	69 Å²	69	60.5 Å²	60.5	37%	0.369	34%	0.337	S	S	.	.			trans	-118.3	119.3	-174.5	-179.3	16.9	0	0	0	112.6	E124 N130 H131 F134	E124-D128 PolarHBondContact O-N 3.45Å; E124-D128 VanDerWaalsContact O-N 3.16Å; D128-N130 VanDerWaalsContact C-N 3.3Å; D128-N130 PolarHBondContact O-N 3.46Å; D128-N130 PolarHBondContact OD1-N 3.43Å; D128-H131 HydrophobicContact CB-CB 4.25Å; D128-H131 WeakPolarHBondContact O-CB 3.37Å; D128-H131 PolarHBondContact O-N 2.96Å; D128-H131 PolarHBondContact OD2-N 3.11Å; D128-F134 WeakPolarHBondContact O-CE2 3.36Å
129	I	76.1	Confident	82.3	Confident	139 Å²	139	62.7 Å²	62.7	71%	0.713	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.5	178.4	-61.6	168.2	0	0	0	111.4	H131 F134	I129-H131 VanDerWaalsContact C-N 3.3Å; I129-F134 WeakPolarHBondContact O-CD2 3.46Å
130	N	78.9	Confident	82	Confident	146 Å²	146	62.4 Å²	62.4	78%	0.781	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	11.2	-179.8	-65.1	-37.3	0	0	0	113	D128	D128-N130 VanDerWaalsContact C-N 3.3Å; D128-N130 PolarHBondContact O-N 3.46Å; D128-N130 PolarHBondContact OD1-N 3.43Å
131	H	81.9	Confident	81.7	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.065	34%	0.34	C	S	.	.			trans	-61.6	139	-173.6	-167.3	-102.4	0	0	0	112.4	Y121 A125 D128 I129 I133 F134	Y121-H131 AromaticContact CD1-CE1 3.82Å; Y121-H131 AromaticContact CD2-CE1 3.64Å; Y121-H131 AromaticContact CD2-NE2 3.82Å; Y121-H131 AromaticContact CE1-CE1 3.45Å; Y121-H131 VanDerWaalsContact CE1-CE1 3.45Å; Y121-H131 WeakPolarHBondContact CE1-CE1 3.35Å; Y121-H131 AromaticContact CE2-CE1 3.2Å; Y121-H131 WeakPolarHBondContact CE2-CE1 3.33Å; Y121-H131 AromaticContact CE2-NE2 3.55Å; Y121-H131 AromaticContact CG-CE1 3.93Å; Y121-H131 AromaticContact CZ-CE1 3.1Å; Y121-H131 AromaticContact CZ-ND1 3.88Å; Y121-H131 AromaticContact CZ-NE2 3.92Å; Y121-H131 PolarHBondContact OH-CE1 3.4Å; A125-H131 HydrophobicContact CB-CB 4.21Å; A125-H131 WeakPolarHBondContact CB-ND1 3.47Å; D128-H131 HydrophobicContact CB-CB 4.25Å; D128-H131 WeakPolarHBondContact O-CB 3.37Å; D128-H131 PolarHBondContact O-N 2.96Å; D128-H131 PolarHBondContact OD2-N 3.11Å; I129-H131 VanDerWaalsContact C-N 3.3Å; H131-I133 HydrophobicContact CB-CG2 4.2Å; H131-I133 WeakPolarHBondContact ND1-CB 3.49Å; H131-I133 VanDerWaalsContact ND1-CG2 3.25Å; H131-I133 WeakPolarHBondContact ND1-CG2 3.48Å; H131-I133 PolarHBondContact ND1-N 3Å; H131-I133 PolarHBondContact O-N 2.9Å; H131-F134 HydrophobicContact CB-CD2 4.18Å; H131-F134 HydrophobicContact CB-CE2 3.99Å; H131-F134 WeakPolarHBondContact O-CD2 3.49Å; H131-F134 PolarHBondContact O-N 3.39Å; H131-F134 VanDerWaalsContact O-N 3.14Å
132	P	82.2	Confident	81.4	Confident	59 Å²	59	63 Å²	63	38%	0.383	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.4	-176	-24.4	33.5	0	0	0	115	F134 T135 L136 R139	P132-F134 PolarHBondContact O-N 2.95Å; P132-T135 PolarHBondContact O-N 3.04Å; P132-T135 PolarHBondContact O-OG1 2.9Å; P132-T135 VanDerWaalsContact O-OG1 3.09Å; P132-L136 PolarHBondContact O-N 2.76Å; P132-L136 VanDerWaalsContact O-N 3.12Å; P132-R139 VanDerWaalsContact CB-NH2 3.32Å; P132-R139 PolarHBondContact O-NH2 2.84Å
133	I	81.1	Confident	81.4	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-57.4	-33.3	176.4	-160	170.2	0	0	0	112.8	Y121 L122 A125 H131 T135 L136 L824	Y121-I133 HydrophobicContact CD1-CD1 4.3Å; Y121-I133 HydrophobicContact CE1-CB 3.92Å; Y121-I133 HydrophobicContact CE1-CD1 3.93Å; Y121-I133 HydrophobicContact CE1-CG1 4.03Å; Y121-I133 PolarHBondContact OH-N 2.91Å; L122-I133 HydrophobicContact CD2-CD1 3.49Å; L122-I133 VanDerWaalsContact CD2-CD1 3.49Å; A125-I133 HydrophobicContact CB-CG2 3.82Å; H131-I133 HydrophobicContact CB-CG2 4.2Å; H131-I133 WeakPolarHBondContact ND1-CB 3.49Å; H131-I133 VanDerWaalsContact ND1-CG2 3.25Å; H131-I133 WeakPolarHBondContact ND1-CG2 3.48Å; H131-I133 PolarHBondContact ND1-N 3Å; H131-I133 PolarHBondContact O-N 2.9Å; I133-T135 VanDerWaalsContact C-N 3.29Å; I133-T135 PolarHBondContact O-N 3.14Å; I133-L136 VanDerWaalsContact O-CB 3.24Å; I133-L136 WeakPolarHBondContact O-CB 3.38Å; I133-L136 PolarHBondContact O-N 2.93Å; I133-L824 HydrophobicContact CD1-CD2 4.23Å
134	F	80.1	Confident	81.3	Confident	72 Å²	72	69.5 Å²	69.5	32%	0.316	37%	0.37	S	S	.	.	H	α-helix	trans	-74.2	-21.3	-177.4	-58.5	-60.8	0	0	0	112.7	D128 I129 H131 P132 P819 L824	D128-F134 WeakPolarHBondContact O-CE2 3.36Å; I129-F134 WeakPolarHBondContact O-CD2 3.46Å; H131-F134 HydrophobicContact CB-CD2 4.18Å; H131-F134 HydrophobicContact CB-CE2 3.99Å; H131-F134 WeakPolarHBondContact O-CD2 3.49Å; H131-F134 PolarHBondContact O-N 3.39Å; H131-F134 VanDerWaalsContact O-N 3.14Å; P132-F134 PolarHBondContact O-N 2.95Å; F134-P819 HydrophobicContact CD1-CB 3.93Å; F134-P819 HydrophobicContact CD1-CG 3.37Å; F134-P819 HydrophobicContact CE1-CB 3.74Å; F134-P819 HydrophobicContact CE1-CG 3.43Å; F134-P819 VanDerWaalsContact CE1-CG 3.43Å; F134-P819 HydrophobicContact CG-CG 4.33Å; F134-P819 HydrophobicContact CZ-CG 4.44Å; F134-L824 HydrophobicContact CZ-CD1 4.31Å
135	T	81.5	Confident	81.2	Confident	71 Å²	71	67.2 Å²	67.2	44%	0.436	37%	0.366	S	S	.	.	H	α-helix	trans	-99.8	-4.5	173.2	64.3	0	0	0	0	113	P132 I133 S137 Q138 R139	P132-T135 PolarHBondContact O-N 3.04Å; P132-T135 PolarHBondContact O-OG1 2.9Å; P132-T135 VanDerWaalsContact O-OG1 3.09Å; I133-T135 VanDerWaalsContact C-N 3.29Å; I133-T135 PolarHBondContact O-N 3.14Å; T135-S137 VanDerWaalsContact C-N 3.32Å; T135-S137 PolarHBondContact O-N 3.27Å; T135-Q138 PolarHBondContact O-N 3.37Å; T135-Q138 VanDerWaalsContact O-N 3.08Å; T135-R139 PolarHBondContact O-N 3.45Å; T135-R139 VanDerWaalsContact O-N 3.15Å; T135-R139 PolarHBondContact OG1-NE 3.17Å
136	L	81	Confident	81.2	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-57.6	-41.4	-174.4	178.1	57.4	0	0	0	112.5	P132 I133 Q138 R139 F140 L800 E804 L807 L811	P132-L136 PolarHBondContact O-N 2.76Å; P132-L136 VanDerWaalsContact O-N 3.12Å; I133-L136 VanDerWaalsContact O-CB 3.24Å; I133-L136 WeakPolarHBondContact O-CB 3.38Å; I133-L136 PolarHBondContact O-N 2.93Å; L136-Q138 PolarHBondContact O-N 3.38Å; L136-R139 PolarHBondContact O-N 3.3Å; L136-F140 VanDerWaalsContact O-CB 3.26Å; L136-F140 WeakPolarHBondContact O-CB 3.32Å; L136-F140 PolarHBondContact O-N 3.5Å; L136-L800 HydrophobicContact CD1-CD2 3.81Å; L136-E804 HydrophobicContact CD1-CB 3.61Å; L136-E804 HydrophobicContact CD1-CG 3.92Å; L136-E804 HydrophobicContact CD2-CB 4.21Å; L136-E804 HydrophobicContact CD2-CG 4.24Å; L136-L807 HydrophobicContact CD2-CB 4.16Å; L136-L811 HydrophobicContact CD2-CD1 3.74Å
137	S	78.2	Confident	81.4	Confident	66 Å²	66	67 Å²	67	46%	0.462	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-34.8	179.1	-174	0	0	0	0	112.7	T135 G141	T135-S137 VanDerWaalsContact C-N 3.32Å; T135-S137 PolarHBondContact O-N 3.27Å; S137-G141 PolarHBondContact O-N 3.12Å; S137-G141 VanDerWaalsContact O-N 3.11Å
138	Q	79.5	Confident	81.7	Confident	139 Å²	139	66.2 Å²	66.2	65%	0.65	36%	0.355	S	S	*	.	H	α-helix	trans	-75.6	-46.5	178.5	-174	-179.7	-1.6	0	0	111.1	T135 L136 G141 Q142	T135-Q138 PolarHBondContact O-N 3.37Å; T135-Q138 VanDerWaalsContact O-N 3.08Å; L136-Q138 PolarHBondContact O-N 3.38Å; Q138-G141 PolarHBondContact O-N 3.14Å; Q138-Q142 PolarHBondContact O-N 3.42Å
139	R	83.6	Confident	81.8	Confident	53 Å²	53	68.6 Å²	68.6	20%	0.2	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-45.2	177.1	-70.8	-170.4	-75.5	137.3	2	111.6	P132 T135 L136 G141 Q142 Y143 K799 L800 E804	P132-R139 VanDerWaalsContact CB-NH2 3.32Å; P132-R139 PolarHBondContact O-NH2 2.84Å; T135-R139 PolarHBondContact O-N 3.45Å; T135-R139 VanDerWaalsContact O-N 3.15Å; T135-R139 PolarHBondContact OG1-NE 3.17Å; L136-R139 PolarHBondContact O-N 3.3Å; R139-G141 PolarHBondContact O-N 3.09Å; R139-Q142 PolarHBondContact O-N 2.99Å; R139-Y143 PolarHBondContact O-N 3.41Å; R139-K799 PolarHBondContact NH1-O 2.86Å; R139-L800 HydrophobicContact CB-CD2 3.92Å; R139-E804 IonicContact CZ-OE1 2.91Å; R139-E804 IonicContact CZ-OE2 3.53Å; R139-E804 IonicContact NH1-OE1 3.73Å; R139-E804 PolarHBondContact NH1-OE1 3.47Å; R139-E804 IonicContact NH1-OE2 3.81Å; R139-E804 PolarHBondContact NH1-OE2 2.93Å; R139-E804 IonicContact NH2-OE1 2.92Å; R139-E804 PolarHBondContact NH2-OE1 3.49Å; R139-E804 IonicContact NH2-OE2 2.67Å
140	F	81.7	Confident	81.9	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-67.8	-35	178.1	-170.1	-100.9	0	0	0	112.8	L136 Q142 Y143 R144 L800 L805 S808	L136-F140 VanDerWaalsContact O-CB 3.26Å; L136-F140 WeakPolarHBondContact O-CB 3.32Å; L136-F140 PolarHBondContact O-N 3.5Å; F140-Q142 VanDerWaalsContact C-N 3.3Å; F140-Q142 PolarHBondContact O-N 2.98Å; F140-Y143 HydrophobicContact CD2-CD1 4.28Å; F140-Y143 HydrophobicContact CE2-CD1 4.16Å; F140-Y143 PolarHBondContact O-N 2.76Å; F140-R144 HydrophobicContact CD1-CG 3.72Å; F140-R144 HydrophobicContact CE1-CG 3.4Å; F140-R144 HydrophobicContact CG-CG 4.47Å; F140-R144 HydrophobicContact CZ-CG 3.87Å; F140-R144 WeakPolarHBondContact O-CB 3.22Å; F140-R144 WeakPolarHBondContact O-CG 3.26Å; F140-R144 PolarHBondContact O-N 2.83Å; F140-L800 HydrophobicContact CD2-CD1 4.31Å; F140-L805 HydrophobicContact CD2-CD2 4.19Å; F140-L805 HydrophobicContact CE2-CD2 3.93Å; F140-S808 WeakPolarHBondContact CD1-OG 3.37Å; F140-S808 VanDerWaalsContact CE1-OG 3.26Å; F140-S808 WeakPolarHBondContact CE1-OG 3.36Å; F140-S808 WeakPolarHBondContact CG-OG 3.47Å
141	G	81.7	Confident	81.9	Confident	39 Å²	39	57.2 Å²	57.2	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-38.5	173.6	0	0	0	0	0	113.1	S137 Q138 R139 S145	S137-G141 PolarHBondContact O-N 3.12Å; S137-G141 VanDerWaalsContact O-N 3.11Å; Q138-G141 PolarHBondContact O-N 3.14Å; R139-G141 PolarHBondContact O-N 3.09Å; G141-S145 PolarHBondContact O-N 2.95Å
142	Q	82	Confident	81.8	Confident	94 Å²	94	63.5 Å²	63.5	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-65.9	-48.6	174.3	-69.4	177.8	-14.8	0	0	111.4	Q138 R139 F140 R144 S145 I146	Q138-Q142 PolarHBondContact O-N 3.42Å; R139-Q142 PolarHBondContact O-N 2.99Å; F140-Q142 VanDerWaalsContact C-N 3.3Å; F140-Q142 PolarHBondContact O-N 2.98Å; Q142-R144 PolarHBondContact O-N 3.4Å; Q142-S145 WeakPolarHBondContact O-CB 3.41Å; Q142-S145 PolarHBondContact O-N 2.87Å; Q142-I146 PolarHBondContact O-N 3.42Å
143	Y	85	Confident	81.1	Confident	38 Å²	38	61.9 Å²	61.9	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-55.8	-49.6	176	171.3	-101.8	0	0	0	112.5	R139 F140 S145 I146 D147 L793 E796 Y797 L800 L805	R139-Y143 PolarHBondContact O-N 3.41Å; F140-Y143 HydrophobicContact CD2-CD1 4.28Å; F140-Y143 HydrophobicContact CE2-CD1 4.16Å; F140-Y143 PolarHBondContact O-N 2.76Å; Y143-S145 VanDerWaalsContact C-N 3.3Å; Y143-S145 PolarHBondContact O-N 3.37Å; Y143-I146 PolarHBondContact O-N 3.23Å; Y143-I146 VanDerWaalsContact O-N 3.12Å; Y143-D147 PolarHBondContact O-N 3.48Å; Y143-L793 HydrophobicContact CD2-CD1 3.79Å; Y143-L793 HydrophobicContact CE2-CD1 3.45Å; Y143-L793 VanDerWaalsContact CE2-CD1 3.45Å; Y143-L793 HydrophobicContact CE2-CG 4.16Å; Y143-E796 HydrophobicContact CD2-CB 4.31Å; Y143-Y797 AromaticContact CE2-CD2 3.84Å; Y143-Y797 HydrophobicContact CE2-CD2 3.84Å; Y143-Y797 HydrophobicContact CE2-CG 4.4Å; Y143-L800 HydrophobicContact CD1-CD1 4.17Å; Y143-L800 HydrophobicContact CD2-CD1 4.26Å; Y143-L800 HydrophobicContact CG-CD1 3.77Å; Y143-L805 HydrophobicContact CD1-CD2 4.22Å; Y143-L805 HydrophobicContact CE1-CD2 3.98Å
144	R	83	Confident	80.6	Confident	148 Å²	148	64.5 Å²	64.5	56%	0.558	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-36.2	179	-79.2	-104.5	-76.4	-148.1	-6.2	113.8	F140 Q142 I146 A148	F140-R144 HydrophobicContact CD1-CG 3.72Å; F140-R144 HydrophobicContact CE1-CG 3.4Å; F140-R144 HydrophobicContact CG-CG 4.47Å; F140-R144 HydrophobicContact CZ-CG 3.87Å; F140-R144 WeakPolarHBondContact O-CB 3.22Å; F140-R144 WeakPolarHBondContact O-CG 3.26Å; F140-R144 PolarHBondContact O-N 2.83Å; Q142-R144 PolarHBondContact O-N 3.4Å; R144-I146 VanDerWaalsContact C-N 3.31Å; R144-I146 PolarHBondContact O-N 3.41Å; R144-A148 WeakPolarHBondContact O-CB 3.33Å; R144-A148 PolarHBondContact O-N 3.37Å
145	S	85.6	Confident	80.3	Confident	65 Å²	65	63.9 Å²	63.9	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-63.6	-38.9	177.4	-179	0	0	0	0	111.8	G141 Q142 Y143 K149	G141-S145 PolarHBondContact O-N 2.95Å; Q142-S145 WeakPolarHBondContact O-CB 3.41Å; Q142-S145 PolarHBondContact O-N 2.87Å; Y143-S145 VanDerWaalsContact C-N 3.3Å; Y143-S145 PolarHBondContact O-N 3.37Å; S145-K149 WeakPolarHBondContact O-CG 3.48Å; S145-K149 PolarHBondContact O-N 3.46Å
146	I	82.6	Confident	79.6	Confident	30 Å²	30	68 Å²	68	15%	0.154	36%	0.36	C	S	.	.	H	α-helix	trans	-76.9	-41.2	179.1	-56.8	-176.1	0	0	0	110.6	Q142 Y143 R144 A148 K149 S150 I789 V792 L793 E796	Q142-I146 PolarHBondContact O-N 3.42Å; Y143-I146 PolarHBondContact O-N 3.23Å; Y143-I146 VanDerWaalsContact O-N 3.12Å; R144-I146 VanDerWaalsContact C-N 3.31Å; R144-I146 PolarHBondContact O-N 3.41Å; I146-A148 VanDerWaalsContact C-N 3.32Å; I146-A148 PolarHBondContact O-N 3.04Å; I146-K149 WeakPolarHBondContact O-CB 3.46Å; I146-K149 PolarHBondContact O-N 3.47Å; I146-K149 VanDerWaalsContact O-N 3.14Å; I146-S150 PolarHBondContact O-N 2.95Å; I146-I789 HydrophobicContact CG2-CG2 4.1Å; I146-V792 HydrophobicContact CD1-CG1 3.59Å; I146-L793 HydrophobicContact CB-CD1 4.22Å; I146-L793 HydrophobicContact CG2-CB 3.96Å; I146-L793 HydrophobicContact CG2-CD1 4.05Å; I146-E796 HydrophobicContact CD1-CG 3.59Å
147	D	84.2	Confident	78.3	Confident	68 Å²	68	69.7 Å²	69.7	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-58.5	-43.2	175.8	-173.2	50.8	0	0	0	111.7	Y143 K149 S150 G151 L793	Y143-D147 PolarHBondContact O-N 3.48Å; D147-K149 VanDerWaalsContact C-N 3.34Å; D147-K149 PolarHBondContact O-N 3.21Å; D147-S150 WeakPolarHBondContact O-CB 3.26Å; D147-S150 PolarHBondContact O-N 3.15Å; D147-G151 PolarHBondContact O-N 3.45Å; D147-L793 HydrophobicContact CB-CD1 3.85Å
148	A	86.1	Confident	77.6	Confident	54 Å²	54	72.2 Å²	72.2	45%	0.446	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-40	175.4	0	0	0	0	0	112.9	R144 I146 G151 Q152	R144-A148 WeakPolarHBondContact O-CB 3.33Å; R144-A148 PolarHBondContact O-N 3.37Å; I146-A148 VanDerWaalsContact C-N 3.32Å; I146-A148 PolarHBondContact O-N 3.04Å; A148-G151 PolarHBondContact O-N 3.07Å; A148-Q152 WeakPolarHBondContact O-CG 3.44Å; A148-Q152 PolarHBondContact O-N 3.19Å; A148-Q152 VanDerWaalsContact O-N 3.09Å
149	K	81.6	Confident	76.7	Confident	120 Å²	120	68.3 Å²	68.3	52%	0.522	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-41.5	174.8	-70.5	177.2	-178.2	179.7	0	111.5	S145 I146 D147 Q152 L153 I789	S145-K149 WeakPolarHBondContact O-CG 3.48Å; S145-K149 PolarHBondContact O-N 3.46Å; I146-K149 WeakPolarHBondContact O-CB 3.46Å; I146-K149 PolarHBondContact O-N 3.47Å; I146-K149 VanDerWaalsContact O-N 3.14Å; D147-K149 VanDerWaalsContact C-N 3.34Å; D147-K149 PolarHBondContact O-N 3.21Å; K149-Q152 PolarHBondContact O-N 3.43Å; K149-L153 PolarHBondContact O-N 2.91Å; K149-I789 HydrophobicContact CB-CD1 4.35Å
150	S	77.9	Confident	75	Confident	8 Å²	8	67.9 Å²	67.9	6%	0.056	37%	0.366	C	S	.	.	H	α-helix	trans	-58.6	-47.4	174.6	-171.1	0	0	0	0	111.2	I146 D147 Q152 L153 L154	I146-S150 PolarHBondContact O-N 2.95Å; D147-S150 WeakPolarHBondContact O-CB 3.26Å; D147-S150 PolarHBondContact O-N 3.15Å; S150-Q152 PolarHBondContact O-N 3.33Å; S150-L153 PolarHBondContact O-N 3.15Å; S150-L154 WeakPolarHBondContact O-CB 3.34Å; S150-L154 PolarHBondContact O-N 3.27Å
151	G	78.8	Confident	73.3	Confident	38 Å²	38	70 Å²	70	39%	0.392	38%	0.382	S	S	.	.	H	α-helix	trans	-60.7	-42.3	178.3	0	0	0	0	0	113.8	D147 A148 L153 L154 A155	D147-G151 PolarHBondContact O-N 3.45Å; A148-G151 PolarHBondContact O-N 3.07Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 2.84Å; G151-L154 PolarHBondContact O-N 2.84Å; G151-A155 WeakPolarHBondContact O-CB 3.37Å; G151-A155 PolarHBondContact O-N 3.29Å
152	Q	81.2	Confident	71.9	Confident	146 Å²	146	73.9 Å²	73.9	68%	0.682	39%	0.39	S	S	*	.	H	α-helix	trans	-61.9	-41.8	175.7	-74.1	177.7	3.7	0	0	112.2	A148 K149 S150 A155 R156	A148-Q152 WeakPolarHBondContact O-CG 3.44Å; A148-Q152 PolarHBondContact O-N 3.19Å; A148-Q152 VanDerWaalsContact O-N 3.09Å; K149-Q152 PolarHBondContact O-N 3.43Å; S150-Q152 PolarHBondContact O-N 3.33Å; Q152-A155 PolarHBondContact O-N 2.84Å; Q152-R156 PolarHBondContact O-N 3.45Å; Q152-R156 VanDerWaalsContact O-N 3.16Å
153	L	67.9	Low	70.1	Confident	25 Å²	25	73.8 Å²	73.8	13%	0.131	39%	0.389	C	S	.	.	H	α-helix	trans	-71.3	-40.9	-179.2	-157.5	84.9	0	0	0	111.6	K149 S150 G151 A155 R156 L157 L782 N785 Y786 I789	K149-L153 PolarHBondContact O-N 2.91Å; S150-L153 PolarHBondContact O-N 3.15Å; G151-L153 VanDerWaalsContact C-N 3.34Å; G151-L153 PolarHBondContact O-N 2.84Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.3Å; L153-R156 WeakPolarHBondContact O-CB 3.39Å; L153-R156 PolarHBondContact O-N 3.27Å; L153-L157 PolarHBondContact O-N 2.9Å; L153-L782 HydrophobicContact CD1-CD2 4.09Å; L153-L782 WeakPolarHBondContact CD2-O 3.28Å; L153-N785 HydrophobicContact CD1-CB 4.3Å; L153-N785 VanDerWaalsContact CD2-C 3.45Å; L153-N785 HydrophobicContact CD2-CB 3.8Å; L153-Y786 VanDerWaalsContact CD2-CB 3.45Å; L153-Y786 HydrophobicContact CD2-CD2 4.12Å; L153-Y786 HydrophobicContact CD2-CG 4.29Å; L153-I789 HydrophobicContact CD2-CD1 4.38Å
154	L	70.3	Confident	68.1	Low	61 Å²	61	76.8 Å²	76.8	32%	0.319	40%	0.4	S	S	.	.	H	α-helix	trans	-62	-40.4	173.9	-174.6	65.4	0	0	0	111.9	S150 G151 R156 L157 K158 Y786	S150-L154 WeakPolarHBondContact O-CB 3.34Å; S150-L154 PolarHBondContact O-N 3.27Å; G151-L154 PolarHBondContact O-N 2.84Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.4Å; L154-L157 PolarHBondContact O-N 2.82Å; L154-K158 WeakPolarHBondContact O-CB 3.35Å; L154-K158 WeakPolarHBondContact O-CG 3.42Å; L154-K158 PolarHBondContact O-N 3.37Å; L154-Y786 HydrophobicContact CB-CE2 3.98Å; L154-Y786 HydrophobicContact CD1-CE2 4.1Å
155	A	73.6	Confident	66	Low	59 Å²	59	73.7 Å²	73.7	49%	0.488	40%	0.395	S	S	.	.	H	α-helix	trans	-60.9	-40	174.7	0	0	0	0	0	111.6	G151 Q152 L153 K158 A159	G151-A155 WeakPolarHBondContact O-CB 3.37Å; G151-A155 PolarHBondContact O-N 3.29Å; Q152-A155 PolarHBondContact O-N 2.84Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.3Å; A155-K158 PolarHBondContact O-N 2.97Å; A155-A159 PolarHBondContact O-N 3.34Å
156	R	65.4	Low	64	Low	159 Å²	159	77.7 Å²	77.7	60%	0.6	41%	0.406	S	S	*	.	H	α-helix	trans	-65.9	-43.1	176.1	-164	155.8	-179.6	140.6	-3.4	111.9	Q152 L153 L154 A159 T160	Q152-R156 PolarHBondContact O-N 3.45Å; Q152-R156 VanDerWaalsContact O-N 3.16Å; L153-R156 WeakPolarHBondContact O-CB 3.39Å; L153-R156 PolarHBondContact O-N 3.27Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.4Å; R156-A159 PolarHBondContact O-N 2.82Å; R156-T160 PolarHBondContact O-N 3.28Å; R156-T160 PolarHBondContact O-OG1 3.18Å
157	L	53.8	Low	61.9	Low	35 Å²	35	80.1 Å²	80.1	18%	0.183	42%	0.419	C	S	.	.	H	α-helix	trans	-61.8	-42.8	174.2	-73.5	169.5	0	0	0	112.5	L153 L154 T160 S161 L782 V783 Y786	L153-L157 PolarHBondContact O-N 2.9Å; L154-L157 PolarHBondContact O-N 2.82Å; L157-T160 PolarHBondContact O-N 3.44Å; L157-S161 PolarHBondContact O-N 3.12Å; L157-L782 HydrophobicContact CD2-CB 3.94Å; L157-V783 HydrophobicContact CD2-CG2 3.98Å; L157-Y786 HydrophobicContact CD1-CD2 4.39Å; L157-Y786 HydrophobicContact CD1-CG 4.1Å
158	K	63.7	Low	59.8	Low	119 Å²	119	78.4 Å²	78.4	52%	0.517	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-41.3	176.5	-77.8	-177.2	178.7	-178.2	0	112.4	L154 A155 T160 S161 Q162	L154-K158 WeakPolarHBondContact O-CB 3.35Å; L154-K158 WeakPolarHBondContact O-CG 3.42Å; L154-K158 PolarHBondContact O-N 3.37Å; A155-K158 PolarHBondContact O-N 2.97Å; K158-T160 VanDerWaalsContact C-N 3.3Å; K158-T160 PolarHBondContact O-N 2.87Å; K158-S161 PolarHBondContact O-N 2.74Å; K158-Q162 WeakPolarHBondContact O-CB 3.39Å; K158-Q162 WeakPolarHBondContact O-CG 3.29Å; K158-Q162 PolarHBondContact O-N 3.23Å
159	A	60.8	Low	57.7	Low	57 Å²	57	82 Å²	82	47%	0.471	42%	0.422	S	S	.	.	H	α-helix	trans	-60.9	-40.6	176.2	0	0	0	0	0	111.6	A155 R156 F163	A155-A159 PolarHBondContact O-N 3.34Å; R156-A159 PolarHBondContact O-N 2.82Å; A159-F163 WeakPolarHBondContact O-CB 3.5Å; A159-F163 PolarHBondContact O-N 3.42Å
160	T	48	Very low	56	Low	45 Å²	45	78 Å²	78	28%	0.276	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-44.5	173.5	-23.6	0	0	0	0	111.4	R156 L157 K158 F163 Y164	R156-T160 PolarHBondContact O-N 3.28Å; R156-T160 PolarHBondContact O-OG1 3.18Å; L157-T160 PolarHBondContact O-N 3.44Å; K158-T160 VanDerWaalsContact C-N 3.3Å; K158-T160 PolarHBondContact O-N 2.87Å; T160-F163 PolarHBondContact O-N 2.91Å; T160-Y164 HydrophobicContact CG2-CE2 3.91Å; T160-Y164 WeakPolarHBondContact O-CD2 3.28Å; T160-Y164 WeakPolarHBondContact O-CE2 3.42Å; T160-Y164 PolarHBondContact O-N 2.79Å
161	S	46.4	Very low	54.4	Low	61 Å²	61	86.8 Å²	86.8	43%	0.427	44%	0.443	S	S	.	.	H	α-helix	trans	-62.8	-49.1	177.9	-169.2	0	0	0	0	113.1	L157 K158 F163 Y164 D165	L157-S161 PolarHBondContact O-N 3.12Å; K158-S161 PolarHBondContact O-N 2.74Å; S161-F163 PolarHBondContact O-N 3.29Å; S161-Y164 WeakPolarHBondContact O-CA 3.28Å; S161-Y164 WeakPolarHBondContact O-CB 3.49Å; S161-Y164 PolarHBondContact O-N 3.25Å; S161-D165 PolarHBondContact O-N 2.63Å
162	Q	51.5	Low	52.8	Low	121 Å²	121	89.2 Å²	89.2	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-62.3	-32.3	-179.1	-74.3	176.8	-15.8	0	0	112.3	K158 D165 H166	K158-Q162 WeakPolarHBondContact O-CB 3.39Å; K158-Q162 WeakPolarHBondContact O-CG 3.29Å; K158-Q162 PolarHBondContact O-N 3.23Å; Q162-D165 PolarHBondContact O-N 2.96Å; Q162-H166 PolarHBondContact O-N 2.85Å; Q162-H166 PolarHBondContact O-ND1 3.5Å
163	F	44.6	Very low	51.2	Low	93 Å²	93	82.7 Å²	82.7	41%	0.408	42%	0.415	S	S	.	.	H	α-helix	trans	-65.6	-39.3	172.9	176.4	-96.6	0	0	0	112.4	A159 T160 S161 H166 L167	A159-F163 WeakPolarHBondContact O-CB 3.5Å; A159-F163 PolarHBondContact O-N 3.42Å; T160-F163 PolarHBondContact O-N 2.91Å; S161-F163 PolarHBondContact O-N 3.29Å; F163-H166 PolarHBondContact O-N 3.38Å; F163-L167 PolarHBondContact O-N 3.37Å
164	Y	42.3	Very low	50.4	Low	100 Å²	100	85.3 Å²	85.3	39%	0.392	43%	0.429	S	S	.	.	H	α-helix	trans	-64.3	-42.8	171.9	-69.2	-69.2	0	0	0	111.4	T160 S161 H166 L167 V168	T160-Y164 HydrophobicContact CG2-CE2 3.91Å; T160-Y164 WeakPolarHBondContact O-CD2 3.28Å; T160-Y164 WeakPolarHBondContact O-CE2 3.42Å; T160-Y164 PolarHBondContact O-N 2.79Å; S161-Y164 WeakPolarHBondContact O-CA 3.28Å; S161-Y164 WeakPolarHBondContact O-CB 3.49Å; S161-Y164 PolarHBondContact O-N 3.25Å; Y164-H166 VanDerWaalsContact C-N 3.32Å; Y164-H166 PolarHBondContact O-N 3.48Å; Y164-L167 WeakPolarHBondContact O-CB 3.24Å; Y164-L167 PolarHBondContact O-N 3.43Å; Y164-L167 VanDerWaalsContact O-N 3.12Å; Y164-V168 WeakPolarHBondContact O-CG2 3.44Å; Y164-V168 PolarHBondContact O-N 2.96Å
165	D	39.9	Very low	49.5	Very low	83 Å²	83	86.1 Å²	86.1	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-61.6	-37.8	177.7	-65.5	-31	0	0	0	112.5	S161 Q162 L167 N169	S161-D165 PolarHBondContact O-N 2.63Å; Q162-D165 PolarHBondContact O-N 2.96Å; D165-L167 VanDerWaalsContact C-N 3.35Å; D165-N169 PolarHBondContact O-N 3.49Å; D165-N169 PolarHBondContact O-ND2 3.22Å
166	H	43.3	Very low	48.4	Very low	150 Å²	150	85 Å²	85	69%	0.694	42%	0.419	S	S	*	.	H	α-helix	trans	-69.4	-31.4	175.6	-80.8	29.8	0	0	0	113	Q162 F163 Y164	Q162-H166 PolarHBondContact O-N 2.85Å; Q162-H166 PolarHBondContact O-ND1 3.5Å; F163-H166 PolarHBondContact O-N 3.38Å; Y164-H166 VanDerWaalsContact C-N 3.32Å; Y164-H166 PolarHBondContact O-N 3.48Å
167	L	37.8	Very low	47.8	Very low	80 Å²	80	80 Å²	80	42%	0.419	40%	0.402	S	S	.	.	H	α-helix	trans	-71.8	-39.2	176.2	-159.1	95.9	0	0	0	111.7	F163 Y164 D165 N169	F163-L167 PolarHBondContact O-N 3.37Å; Y164-L167 WeakPolarHBondContact O-CB 3.24Å; Y164-L167 PolarHBondContact O-N 3.43Å; Y164-L167 VanDerWaalsContact O-N 3.12Å; D165-L167 VanDerWaalsContact C-N 3.35Å; L167-N169 VanDerWaalsContact C-N 3.33Å
168	V	41.1	Very low	48	Very low	32 Å²	32	83 Å²	83	19%	0.194	42%	0.418	C	S	.	.	H	α-helix	trans	-68.4	-32.8	179.8	172.2	0	0	0	0	111.9	Y164 S376	Y164-V168 WeakPolarHBondContact O-CG2 3.44Å; Y164-V168 PolarHBondContact O-N 2.96Å; V168-S376 VanDerWaalsContact CG2-O 3.27Å; V168-S376 WeakPolarHBondContact CG2-O 3.43Å
169	N	42.6	Very low	47.5	Very low	129 Å²	129	79.5 Å²	79.5	69%	0.69	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	12.9	-177.9	-67.4	-45	0	0	0	114.3	D165 L167	D165-N169 PolarHBondContact O-N 3.49Å; D165-N169 PolarHBondContact O-ND2 3.22Å; L167-N169 VanDerWaalsContact C-N 3.33Å
170	S	45.6	Very low	47.2	Very low	38 Å²	38	77.1 Å²	77.1	27%	0.266	39%	0.388	S	S	.	.			trans	-73	140.1	178.5	81.9	0	0	0	0	111.4	E172 C173	S170-E172 PolarHBondContact O-N 2.75Å; S170-C173 WeakPolarHBondContact O-CB 3.48Å; S170-C173 PolarHBondContact O-N 3.04Å
171	Y	44.2	Very low	47.6	Very low	191 Å²	191	76.4 Å²	76.4	75%	0.749	38%	0.382	S	S	*	.	H	α-helix	trans	-50.9	-23.9	176.7	-179.5	-99.9	0	0	0	113.9
172	E	45.9	Very low	48.3	Very low	89 Å²	89	77.4 Å²	77.4	42%	0.416	38%	0.383	S	S	.	.	H	α-helix	trans	-76.8	-28	179.7	-64.6	164.9	153.7	0	0	112.7	S170 L176 I302	S170-E172 PolarHBondContact O-N 2.75Å; E172-L176 PolarHBondContact O-N 3.45Å; E172-I302 HydrophobicContact CB-CD1 4.31Å; E172-I302 VanDerWaalsContact OE2-CG1 3.25Å; E172-I302 WeakPolarHBondContact OE2-CG1 3.41Å
173	C	46	Very low	48.6	Very low	10 Å²	10	72 Å²	72	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-70.2	-35.4	177.7	-169.2	0	0	0	0	112.1	S170 L176 K177 V378	S170-C173 WeakPolarHBondContact O-CB 3.48Å; S170-C173 PolarHBondContact O-N 3.04Å; C173-L176 PolarHBondContact O-N 2.94Å; C173-K177 WeakPolarHBondContact O-CG 3.5Å; C173-K177 PolarHBondContact O-N 3.38Å; C173-V378 HydrophobicContact CB-CG2 4.48Å; C173-V378 VanDerWaalsContact SG-CG2 3.56Å
174	D	51.3	Low	49.1	Very low	79 Å²	79	68.4 Å²	68.4	42%	0.422	34%	0.342	S	S	.	.	H	α-helix	trans	-71.8	-35.3	178.4	-72	-23.2	0	0	0	111.9	K177 N178	D174-K177 PolarHBondContact O-N 2.83Å; D174-K177 IonicContact OD1-NZ 3.52Å; D174-K177 PolarHBondContact OD1-NZ 2.98Å; D174-N178 VanDerWaalsContact O-CG 3.26Å; D174-N178 PolarHBondContact O-N 2.9Å; D174-N178 PolarHBondContact O-ND2 3.16Å
175	N	52.6	Low	49.9	Very low	78 Å²	78	65.9 Å²	65.9	42%	0.417	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-43.7	171.8	-75	-24.9	0	0	0	111.7	N178 S179	N175-N178 PolarHBondContact O-N 3.39Å; N175-S179 PolarHBondContact O-N 3.42Å; N175-S179 PolarHBondContact O-OG 3.23Å
176	L	50.4	Low	51	Low	35 Å²	35	63.9 Å²	63.9	18%	0.183	32%	0.323	C	S	.	.	H	α-helix	trans	-60.9	-46.1	175.1	-176.2	65.9	0	0	0	111.1	E172 C173 N178 S179 L180 V378 V382	E172-L176 PolarHBondContact O-N 3.45Å; C173-L176 PolarHBondContact O-N 2.94Å; L176-N178 VanDerWaalsContact C-N 3.35Å; L176-N178 PolarHBondContact O-N 3.44Å; L176-S179 PolarHBondContact O-N 3.48Å; L176-L180 HydrophobicContact CD1-CD1 4.34Å; L176-L180 HydrophobicContact CD1-CG 4.42Å; L176-L180 HydrophobicContact CG-CD1 3.97Å; L176-L180 HydrophobicContact CG-CG 4.46Å; L176-L180 WeakPolarHBondContact O-CG 3.38Å; L176-L180 PolarHBondContact O-N 3.49Å; L176-V378 HydrophobicContact CD2-CG1 3.78Å; L176-V382 HydrophobicContact CD2-CG2 3.97Å
177	K	52.1	Low	51.6	Low	54 Å²	54	56.8 Å²	56.8	24%	0.235	29%	0.29	C	S	.	.	H	α-helix	trans	-55.8	-46.9	176.1	-77.3	175.3	-173.7	163.1	0	112.4	C173 D174 L180 L181 L381	C173-K177 WeakPolarHBondContact O-CG 3.5Å; C173-K177 PolarHBondContact O-N 3.38Å; D174-K177 PolarHBondContact O-N 2.83Å; D174-K177 IonicContact OD1-NZ 3.52Å; D174-K177 PolarHBondContact OD1-NZ 2.98Å; K177-L180 PolarHBondContact O-N 3.18Å; K177-L181 PolarHBondContact O-N 3.42Å; K177-L381 HydrophobicContact CD-CD1 4.12Å; K177-L381 HydrophobicContact CG-CD1 3.63Å; K177-L381 HydrophobicContact CG-CD2 4.27Å
178	N	57.3	Low	52.5	Low	98 Å²	98	53.8 Å²	53.8	52%	0.524	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-41.8	-178.7	-70.8	-28.8	0	0	0	112.1	D174 N175 L176 L180 L181 L182	D174-N178 VanDerWaalsContact O-CG 3.26Å; D174-N178 PolarHBondContact O-N 2.9Å; D174-N178 PolarHBondContact O-ND2 3.16Å; N175-N178 PolarHBondContact O-N 3.39Å; L176-N178 VanDerWaalsContact C-N 3.35Å; L176-N178 PolarHBondContact O-N 3.44Å; N178-L180 VanDerWaalsContact C-N 3.35Å; N178-L180 PolarHBondContact O-N 2.95Å; N178-L181 PolarHBondContact O-N 2.89Å; N178-L182 PolarHBondContact O-N 3.18Å
179	S	54	Low	53.5	Low	47 Å²	47	56.6 Å²	56.6	33%	0.329	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-39.6	175.6	-63.6	0	0	0	0	112.4	N175 L176 T183	N175-S179 PolarHBondContact O-N 3.42Å; N175-S179 PolarHBondContact O-OG 3.23Å; L176-S179 PolarHBondContact O-N 3.48Å; S179-T183 PolarHBondContact O-N 3.42Å; S179-T183 VanDerWaalsContact O-N 3.11Å; S179-T183 PolarHBondContact O-OG1 2.9Å
180	L	54.4	Low	54.2	Low	6 Å²	6	50.5 Å²	50.5	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-44.2	176.2	-65.7	170.5	0	0	0	111	L176 K177 N178 L182 T183 Y184 L322 L381 F385	L176-L180 HydrophobicContact CD1-CD1 4.34Å; L176-L180 HydrophobicContact CD1-CG 4.42Å; L176-L180 HydrophobicContact CG-CD1 3.97Å; L176-L180 HydrophobicContact CG-CG 4.46Å; L176-L180 WeakPolarHBondContact O-CG 3.38Å; L176-L180 PolarHBondContact O-N 3.49Å; K177-L180 PolarHBondContact O-N 3.18Å; N178-L180 VanDerWaalsContact C-N 3.35Å; N178-L180 PolarHBondContact O-N 2.95Å; L180-L182 PolarHBondContact O-N 3.28Å; L180-T183 WeakPolarHBondContact O-CB 3.25Å; L180-T183 PolarHBondContact O-N 2.91Å; L180-T183 VanDerWaalsContact O-N 3.16Å; L180-Y184 PolarHBondContact O-N 3.36Å; L180-L322 HydrophobicContact CD2-CD2 4.48Å; L180-L381 HydrophobicContact CD1-CD2 3.38Å; L180-F385 HydrophobicContact CB-CD2 3.68Å; L180-F385 HydrophobicContact CB-CE2 3.85Å; L180-F385 HydrophobicContact CB-CG 4.11Å; L180-F385 HydrophobicContact CB-CZ 4.39Å; L180-F385 HydrophobicContact CD1-CB 4.31Å; L180-F385 HydrophobicContact CD1-CG 4.34Å; L180-F385 HydrophobicContact CD2-CB 4.26Å; L180-F385 HydrophobicContact CD2-CD1 3.33Å; L180-F385 HydrophobicContact CD2-CD2 3.94Å; L180-F385 HydrophobicContact CD2-CE1 3.48Å; L180-F385 VanDerWaalsContact CD2-CE1 3.48Å; L180-F385 HydrophobicContact CD2-CE2 4.1Å; L180-F385 HydrophobicContact CD2-CG 3.54Å; L180-F385 HydrophobicContact CD2-CZ 3.87Å; L180-F385 HydrophobicContact CG-CD1 4.42Å; L180-F385 HydrophobicContact CG-CD2 4.26Å; L180-F385 HydrophobicContact CG-CG 4.18Å; L180-F385 WeakPolarHBondContact O-CE2 3.4Å
181	L	56.7	Low	54.7	Low	30 Å²	30	49 Å²	49	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-44.3	177.2	-175.2	67.1	0	0	0	112.3	K177 N178 T183 Y184 Q185 W436	K177-L181 PolarHBondContact O-N 3.42Å; N178-L181 PolarHBondContact O-N 2.89Å; L181-T183 VanDerWaalsContact C-N 3.31Å; L181-T183 PolarHBondContact O-N 3.31Å; L181-Y184 PolarHBondContact O-N 3.48Å; L181-Q185 WeakPolarHBondContact O-CG 3.23Å; L181-Q185 PolarHBondContact O-N 3.48Å; L181-W436 HydrophobicContact CD1-CZ2 4.2Å
182	L	61.4	Low	55.4	Low	82 Å²	82	40.1 Å²	40.1	43%	0.429	21%	0.207	S	C	.	.	H	α-helix	trans	-61.7	-40.1	176.3	-176.6	65.3	0	0	0	111.9	N178 L180 Q185 N186	N178-L182 PolarHBondContact O-N 3.18Å; L180-L182 PolarHBondContact O-N 3.28Å; L182-Q185 PolarHBondContact O-N 2.93Å; L182-N186 PolarHBondContact O-N 3.46Å; L182-N186 PolarHBondContact O-ND2 3.14Å
183	T	57.2	Low	56	Low	9 Å²	9	35.9 Å²	35.9	6%	0.055	19%	0.187	C	C	.	.	H	α-helix	trans	-65	-41	177.8	-54.2	0	0	0	0	111.5	S179 L180 L181 N186 L187 F290 F385 F389	S179-T183 PolarHBondContact O-N 3.42Å; S179-T183 VanDerWaalsContact O-N 3.11Å; S179-T183 PolarHBondContact O-OG1 2.9Å; L180-T183 WeakPolarHBondContact O-CB 3.25Å; L180-T183 PolarHBondContact O-N 2.91Å; L180-T183 VanDerWaalsContact O-N 3.16Å; L181-T183 VanDerWaalsContact C-N 3.31Å; L181-T183 PolarHBondContact O-N 3.31Å; T183-N186 PolarHBondContact O-N 3.28Å; T183-L187 PolarHBondContact O-N 2.93Å; T183-L187 VanDerWaalsContact O-N 3.1Å; T183-F290 HydrophobicContact CG2-CE2 4.4Å; T183-F290 WeakPolarHBondContact OG1-CE2 3.01Å; T183-F385 HydrophobicContact CG2-CZ 3.74Å; T183-F389 HydrophobicContact CG2-CD2 4.18Å; T183-F389 HydrophobicContact CG2-CE2 3.69Å
184	Y	55.5	Low	56.3	Low	17 Å²	17	35.4 Å²	35.4	7%	0.067	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-45.6	173.4	176	-91.2	0	0	0	112	L180 L181 N186 L187 R188 V388 L392 L439	L180-Y184 PolarHBondContact O-N 3.36Å; L181-Y184 PolarHBondContact O-N 3.48Å; Y184-N186 VanDerWaalsContact C-N 3.33Å; Y184-N186 PolarHBondContact O-N 2.85Å; Y184-L187 PolarHBondContact O-N 2.71Å; Y184-L187 VanDerWaalsContact O-N 3.15Å; Y184-R188 PolarHBondContact O-N 2.95Å; Y184-V388 HydrophobicContact CD2-CG1 3.86Å; Y184-V388 HydrophobicContact CE2-CG1 3.59Å; Y184-L392 HydrophobicContact CD2-CD1 3.9Å; Y184-L392 HydrophobicContact CE2-CD1 3.42Å; Y184-L392 VanDerWaalsContact CE2-CD1 3.42Å; Y184-L439 HydrophobicContact CD1-CD1 4.35Å; Y184-L439 HydrophobicContact CE1-CD1 3.78Å
185	Q	59.5	Low	56.5	Low	46 Å²	46	32 Å²	32	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-57.4	-46.4	177.5	-74.5	174.5	-11.2	0	0	111.6	L181 L182 L187 R188 H189 V434	L181-Q185 WeakPolarHBondContact O-CG 3.23Å; L181-Q185 PolarHBondContact O-N 3.48Å; L182-Q185 PolarHBondContact O-N 2.93Å; Q185-L187 VanDerWaalsContact C-N 3.3Å; Q185-L187 PolarHBondContact O-N 2.91Å; Q185-R188 PolarHBondContact O-N 2.88Å; Q185-H189 PolarHBondContact O-CD2 3.21Å; Q185-H189 PolarHBondContact O-N 3.02Å; Q185-V434 HydrophobicContact CG-CB 4.04Å; Q185-V434 HydrophobicContact CG-CG1 4.44Å; Q185-V434 HydrophobicContact CG-CG2 4.42Å; Q185-V434 PolarHBondContact NE2-O 2.85Å
186	N	61.3	Low	56.8	Low	42 Å²	42	32.3 Å²	32.3	23%	0.225	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-39.6	176.9	-71.4	-33.3	0	0	0	112.4	L182 T183 Y184 H189 L190 L285 P286	L182-N186 PolarHBondContact O-N 3.46Å; L182-N186 PolarHBondContact O-ND2 3.14Å; T183-N186 PolarHBondContact O-N 3.28Å; Y184-N186 VanDerWaalsContact C-N 3.33Å; Y184-N186 PolarHBondContact O-N 2.85Å; N186-H189 PolarHBondContact O-N 2.98Å; N186-L190 PolarHBondContact O-N 2.89Å; N186-L285 HydrophobicContact CB-CD2 4.29Å; N186-P286 WeakPolarHBondContact ND2-CD 3.26Å
187	L	57	Low	57	Low	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-72.1	-34.8	178.8	-157.9	142.1	0	0	0	112.3	T183 Y184 Q185 L190 L191 L285 F389 L392 L393 I396	T183-L187 PolarHBondContact O-N 2.93Å; T183-L187 VanDerWaalsContact O-N 3.1Å; Y184-L187 PolarHBondContact O-N 2.71Å; Y184-L187 VanDerWaalsContact O-N 3.15Å; Q185-L187 VanDerWaalsContact C-N 3.3Å; Q185-L187 PolarHBondContact O-N 2.91Å; L187-L190 WeakPolarHBondContact O-CB 3.12Å; L187-L190 PolarHBondContact O-N 3.17Å; L187-L191 PolarHBondContact O-N 3.01Å; L187-L285 HydrophobicContact CB-CD2 4.34Å; L187-L285 HydrophobicContact CD1-CD2 4.41Å; L187-F389 HydrophobicContact CD1-CD1 4.44Å; L187-F389 HydrophobicContact CD1-CD2 3.59Å; L187-F389 HydrophobicContact CD1-CE1 4.11Å; L187-F389 HydrophobicContact CD1-CE2 3.16Å; L187-F389 HydrophobicContact CD1-CG 4.2Å; L187-F389 HydrophobicContact CD1-CZ 3.45Å; L187-F389 VanDerWaalsContact CD1-CZ 3.45Å; L187-F389 HydrophobicContact CG-CE2 4.47Å; L187-L392 HydrophobicContact CD2-CB 3.14Å; L187-L392 HydrophobicContact CD2-CD1 3.87Å; L187-L392 HydrophobicContact CD2-CG 4.13Å; L187-L393 HydrophobicContact CD1-CB 4.48Å; L187-L393 HydrophobicContact CD1-CD1 4.39Å; L187-I396 HydrophobicContact CD2-CD1 3.58Å; L187-I396 HydrophobicContact CG-CD1 3.87Å
188	R	56.4	Low	57.1	Low	16 Å²	16	28.2 Å²	28.2	6%	0.06	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-44.3	169.5	-173.7	179.7	-179.6	171.8	2.2	111.4	Y184 Q185 L190 L191 A192 F428 S431 D442	Y184-R188 PolarHBondContact O-N 2.95Å; Q185-R188 PolarHBondContact O-N 2.88Å; R188-L190 VanDerWaalsContact C-N 3.27Å; R188-L190 PolarHBondContact O-N 3.41Å; R188-L191 PolarHBondContact O-N 3.35Å; R188-A192 WeakPolarHBondContact O-CB 3.49Å; R188-A192 PolarHBondContact O-N 3.34Å; R188-F428 PolarHBondContact NH2-O 3.49Å; R188-S431 PolarHBondContact NH2-OG 3.48Å; R188-D442 IonicContact CZ-OD2 3.68Å; R188-D442 IonicContact NH1-OD2 2.81Å; R188-D442 IonicContact NH2-OD2 3.85Å; R188-D442 PolarHBondContact NH2-OD2 2.93Å
189	H	61.7	Low	57	Low	91 Å²	91	26.4 Å²	26.4	42%	0.421	14%	0.139	S	C	.	.	H	α-helix	trans	-63.6	-32.1	175.9	-72	-53.4	0	0	0	113	Q185 N186 S193 R281	Q185-H189 PolarHBondContact O-CD2 3.21Å; Q185-H189 PolarHBondContact O-N 3.02Å; N186-H189 PolarHBondContact O-N 2.98Å; H189-S193 PolarHBondContact O-N 2.87Å; H189-R281 WeakPolarHBondContact O-CD 3.41Å; H189-R281 PolarHBondContact O-NH1 3.26Å
190	L	57.6	Low	57.2	Low	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-67.1	-49.8	172.3	179.9	59.8	0	0	0	111.2	N186 L187 R188 A192 S193 T194 V278 R281 L285 F332 I396	N186-L190 PolarHBondContact O-N 2.89Å; L187-L190 WeakPolarHBondContact O-CB 3.12Å; L187-L190 PolarHBondContact O-N 3.17Å; R188-L190 VanDerWaalsContact C-N 3.27Å; R188-L190 PolarHBondContact O-N 3.41Å; L190-A192 VanDerWaalsContact C-N 3.29Å; L190-A192 PolarHBondContact O-N 3.4Å; L190-S193 PolarHBondContact O-N 2.94Å; L190-S193 VanDerWaalsContact O-N 3.13Å; L190-T194 PolarHBondContact O-N 3.36Å; L190-T194 PolarHBondContact O-OG1 3.27Å; L190-V278 HydrophobicContact CD1-CG1 3.9Å; L190-V278 WeakPolarHBondContact CD1-O 3.39Å; L190-R281 HydrophobicContact CD1-CB 4.42Å; L190-L285 HydrophobicContact CD2-CD1 3.68Å; L190-F332 HydrophobicContact CD2-CE1 4.25Å; L190-I396 HydrophobicContact CB-CD1 4.25Å; L190-I396 HydrophobicContact CD2-CD1 4.07Å; L190-I396 HydrophobicContact CD2-CG2 4.2Å; L190-I396 HydrophobicContact CG-CD1 4.08Å; L190-I396 HydrophobicContact CG-CG2 4.26Å
191	L	56	Low	57.2	Low	8 Å²	8	25.8 Å²	25.8	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-54.8	-45.7	175.6	179.3	68.6	0	0	0	111.9	L187 R188 S193 T194 M195 L392 L395 I396 L399	L187-L191 PolarHBondContact O-N 3.01Å; R188-L191 PolarHBondContact O-N 3.35Å; L191-S193 VanDerWaalsContact C-N 3.33Å; L191-S193 PolarHBondContact O-N 3.4Å; L191-T194 WeakPolarHBondContact O-CB 3.01Å; L191-T194 PolarHBondContact O-N 2.91Å; L191-T194 VanDerWaalsContact O-N 3.16Å; L191-M195 HydrophobicContact CG-SD 4.34Å; L191-M195 WeakPolarHBondContact O-CG 3.2Å; L191-M195 PolarHBondContact O-N 2.92Å; L191-L392 HydrophobicContact CD2-CD2 4.18Å; L191-L395 HydrophobicContact CD1-CD2 3.95Å; L191-L395 HydrophobicContact CD1-CG 4.13Å; L191-L395 HydrophobicContact CD2-CD2 4.12Å; L191-I396 HydrophobicContact CB-CD1 4.03Å; L191-I396 HydrophobicContact CB-CG1 3.85Å; L191-I396 HydrophobicContact CD1-CG1 3.72Å; L191-I396 HydrophobicContact CG-CG1 4.39Å; L191-L399 HydrophobicContact CD1-CD1 3.64Å
192	A	58.2	Low	57.1	Low	4 Å²	4	25.4 Å²	25.4	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-56	-45.7	176.8	0	0	0	0	0	112.3	R188 L190 M195 E196 N429	R188-A192 WeakPolarHBondContact O-CB 3.49Å; R188-A192 PolarHBondContact O-N 3.34Å; L190-A192 VanDerWaalsContact C-N 3.29Å; L190-A192 PolarHBondContact O-N 3.4Å; A192-M195 WeakPolarHBondContact O-CB 3.18Å; A192-M195 PolarHBondContact O-N 3.49Å; A192-E196 PolarHBondContact O-N 3.46Å; A192-E196 VanDerWaalsContact O-N 3.09Å; A192-N429 WeakPolarHBondContact CB-ND2 3.38Å; A192-N429 WeakPolarHBondContact CB-OD1 3.46Å
193	S	58.5	Low	56.9	Low	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.3	-35.3	176.1	-75.6	0	0	0	0	113	H189 L190 L191 M195 E196 T277 V278 R281	H189-S193 PolarHBondContact O-N 2.87Å; L190-S193 PolarHBondContact O-N 2.94Å; L190-S193 VanDerWaalsContact O-N 3.13Å; L191-S193 VanDerWaalsContact C-N 3.33Å; L191-S193 PolarHBondContact O-N 3.4Å; S193-M195 PolarHBondContact O-N 3.45Å; S193-E196 WeakPolarHBondContact O-CB 3.47Å; S193-E196 PolarHBondContact O-N 3.16Å; S193-E196 VanDerWaalsContact O-N 3.14Å; S193-E196 PolarHBondContact OG-OE2 3.35Å; S193-T277 WeakPolarHBondContact OG-CG2 3.34Å; S193-V278 WeakPolarHBondContact O-CG2 3.27Å; S193-R281 VanDerWaalsContact OG-CD 3.28Å; S193-R281 WeakPolarHBondContact OG-CD 3.47Å; S193-R281 PolarHBondContact OG-NE 2.85Å; S193-R281 PolarHBondContact OG-NH1 2.97Å
194	T	53.9	Low	56.9	Low	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.9	-35.5	173.3	-59	0	0	0	0	110.2	L190 L191 L197 L399 T400 I404	L190-T194 PolarHBondContact O-N 3.36Å; L190-T194 PolarHBondContact O-OG1 3.27Å; L191-T194 WeakPolarHBondContact O-CB 3.01Å; L191-T194 PolarHBondContact O-N 2.91Å; L191-T194 VanDerWaalsContact O-N 3.16Å; T194-L197 VanDerWaalsContact O-CB 3.29Å; T194-L197 WeakPolarHBondContact O-CB 3.39Å; T194-L197 PolarHBondContact O-N 3.48Å; T194-L399 HydrophobicContact CG2-CB 4.06Å; T194-T400 VanDerWaalsContact CG2-OG1 3.24Å; T194-T400 WeakPolarHBondContact CG2-OG1 3.48Å; T194-I404 HydrophobicContact CG2-CD1 3.9Å; T194-I404 WeakPolarHBondContact O-CD1 3.35Å
195	M	54.6	Low	56.7	Low	6 Å²	6	23.7 Å²	23.7	3%	0.03	12%	0.119	C	C	.	.	H	α-helix	trans	-71.8	-31.2	174.7	-70	173.4	38.4	0	0	113.9	L191 A192 S193 L197 M198 P199 L425 M426	L191-M195 HydrophobicContact CG-SD 4.34Å; L191-M195 WeakPolarHBondContact O-CG 3.2Å; L191-M195 PolarHBondContact O-N 2.92Å; A192-M195 WeakPolarHBondContact O-CB 3.18Å; A192-M195 PolarHBondContact O-N 3.49Å; S193-M195 PolarHBondContact O-N 3.45Å; M195-L197 PolarHBondContact O-N 3.4Å; M195-L197 VanDerWaalsContact O-N 3.14Å; M195-M198 HydrophobicContact CB-CE 4.14Å; M195-M198 HydrophobicContact CG-CE 4.02Å; M195-M198 PolarHBondContact O-N 3.13Å; M195-P199 WeakPolarHBondContact O-CD 3.33Å; M195-L425 HydrophobicContact CE-CB 3.48Å; M195-L425 VanDerWaalsContact CE-CB 3.48Å; M195-L425 VanDerWaalsContact CE-O 3.3Å; M195-L425 WeakPolarHBondContact CE-O 3.38Å; M195-L425 HydrophobicContact SD-CB 3.92Å; M195-L425 HydrophobicContact SD-CD2 4.5Å; M195-M426 HydrophobicContact CE-CG 4.48Å; M195-M426 HydrophobicContact CE-SD 4.18Å
196	E	58.4	Low	56.6	Low	85 Å²	85	28.1 Å²	28.1	40%	0.397	13%	0.133	S	C	.	.	H	α-helix	trans	-59.6	-20.9	174.6	-72.7	167.6	175.9	0	0	112.5	A192 S193 P199	A192-E196 PolarHBondContact O-N 3.46Å; A192-E196 VanDerWaalsContact O-N 3.09Å; S193-E196 WeakPolarHBondContact O-CB 3.47Å; S193-E196 PolarHBondContact O-N 3.16Å; S193-E196 VanDerWaalsContact O-N 3.14Å; S193-E196 PolarHBondContact OG-OE2 3.35Å; E196-P199 WeakPolarHBondContact O-CD 3.49Å
197	L	55.5	Low	56.2	Low	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.5	-41.3	172.4	-65.4	172.8	0	0	0	112	T194 M195 A200 Y201 A274 F275 V278 I404	T194-L197 VanDerWaalsContact O-CB 3.29Å; T194-L197 WeakPolarHBondContact O-CB 3.39Å; T194-L197 PolarHBondContact O-N 3.48Å; M195-L197 PolarHBondContact O-N 3.4Å; M195-L197 VanDerWaalsContact O-N 3.14Å; L197-A200 PolarHBondContact O-N 3.27Å; L197-Y201 HydrophobicContact CB-CD2 3.99Å; L197-Y201 HydrophobicContact CB-CE2 4.06Å; L197-Y201 HydrophobicContact CD2-CE2 4.42Å; L197-Y201 WeakPolarHBondContact O-CB 3.48Å; L197-Y201 WeakPolarHBondContact O-CD2 3.22Å; L197-Y201 PolarHBondContact O-N 3.07Å; L197-A274 HydrophobicContact CD2-CB 3.73Å; L197-F275 HydrophobicContact CD1-CD1 3.95Å; L197-F275 HydrophobicContact CD1-CE1 3.52Å; L197-F275 HydrophobicContact CD1-CE2 4.29Å; L197-F275 HydrophobicContact CD1-CZ 3.7Å; L197-F275 HydrophobicContact CD2-CB 4.27Å; L197-F275 HydrophobicContact CD2-CD1 3.87Å; L197-F275 HydrophobicContact CD2-CD2 3.36Å; L197-F275 HydrophobicContact CD2-CE1 3.96Å; L197-F275 HydrophobicContact CD2-CE2 3.44Å; L197-F275 VanDerWaalsContact CD2-CE2 3.44Å; L197-F275 HydrophobicContact CD2-CG 3.57Å; L197-F275 HydrophobicContact CD2-CZ 3.75Å; L197-F275 HydrophobicContact CG-CE1 4.41Å; L197-F275 HydrophobicContact CG-CE2 4.44Å; L197-F275 HydrophobicContact CG-CZ 4.33Å; L197-V278 HydrophobicContact CD1-CG2 4.16Å; L197-V278 HydrophobicContact CG-CG2 4.27Å; L197-I404 HydrophobicContact CB-CD1 3.93Å; L197-I404 HydrophobicContact CD1-CD1 3.74Å; L197-I404 HydrophobicContact CG-CD1 4.45Å
198	M	54.4	Low	56	Low	4 Å²	4	30 Å²	30	2%	0.02	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-48.3	-171.2	-79.7	-173.8	-75.8	0	0	113.8	M195 Y201 I202 I404 L407 L421 L422 L425	M195-M198 HydrophobicContact CB-CE 4.14Å; M195-M198 HydrophobicContact CG-CE 4.02Å; M195-M198 PolarHBondContact O-N 3.13Å; M198-Y201 PolarHBondContact O-N 3.27Å; M198-I202 VanDerWaalsContact O-CG1 3.29Å; M198-I202 WeakPolarHBondContact O-CG1 3.49Å; M198-I202 PolarHBondContact O-N 3.04Å; M198-I404 HydrophobicContact CG-CG1 4.07Å; M198-L407 HydrophobicContact CG-CD1 3.84Å; M198-L407 HydrophobicContact SD-CD1 3.78Å; M198-L421 HydrophobicContact SD-CD2 4.18Å; M198-L422 HydrophobicContact CB-CD1 4.47Å; M198-L422 HydrophobicContact CB-CD2 3.63Å; M198-L422 HydrophobicContact CB-CG 4.29Å; M198-L422 HydrophobicContact CE-CD2 3.91Å; M198-L422 HydrophobicContact SD-CD2 4.18Å; M198-L425 HydrophobicContact CE-CD1 3.32Å; M198-L425 HydrophobicContact SD-CD1 4.2Å
199	P	54.9	Low	55.5	Low	60 Å²	60	30.8 Å²	30.8	39%	0.39	15%	0.146	S	C	.	.	H	α-helix	trans	-63.4	-40.7	174.8	-20.2	32.2	0	0	0	112.6	M195 E196 Y201 I202 E203 L422	M195-P199 WeakPolarHBondContact O-CD 3.33Å; E196-P199 WeakPolarHBondContact O-CD 3.49Å; P199-Y201 VanDerWaalsContact C-N 3.3Å; P199-Y201 PolarHBondContact O-N 2.96Å; P199-I202 PolarHBondContact O-N 3.27Å; P199-E203 PolarHBondContact O-N 3.22Å; P199-L422 HydrophobicContact CG-CD1 4.24Å; P199-L422 HydrophobicContact CG-CD2 3.9Å
200	A	58.5	Low	54.8	Low	11 Å²	11	31.1 Å²	31.1	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-41.6	177.8	0	0	0	0	0	111.3	L197 E203 L204 V271	L197-A200 PolarHBondContact O-N 3.27Å; A200-E203 PolarHBondContact O-N 2.83Å; A200-L204 PolarHBondContact O-N 3.49Å; A200-V271 HydrophobicContact CB-CG2 3.74Å
201	Y	54.4	Low	54.1	Low	29 Å²	29	37 Å²	37	11%	0.114	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-43.1	174.4	-87.8	-66	0	0	0	113.4	L197 M198 P199 E203 L204 Q205 V271 F275 I404 F408	L197-Y201 HydrophobicContact CB-CD2 3.99Å; L197-Y201 HydrophobicContact CB-CE2 4.06Å; L197-Y201 HydrophobicContact CD2-CE2 4.42Å; L197-Y201 WeakPolarHBondContact O-CB 3.48Å; L197-Y201 WeakPolarHBondContact O-CD2 3.22Å; L197-Y201 PolarHBondContact O-N 3.07Å; M198-Y201 PolarHBondContact O-N 3.27Å; P199-Y201 VanDerWaalsContact C-N 3.3Å; P199-Y201 PolarHBondContact O-N 2.96Å; Y201-E203 VanDerWaalsContact C-N 3.27Å; Y201-E203 PolarHBondContact O-N 3.42Å; Y201-L204 PolarHBondContact O-N 2.93Å; Y201-Q205 PolarHBondContact O-N 3.16Å; Y201-Q205 VanDerWaalsContact O-N 3.12Å; Y201-V271 HydrophobicContact CD1-CG1 4.31Å; Y201-V271 HydrophobicContact CD1-CG2 4.27Å; Y201-V271 HydrophobicContact CD2-CG1 4.48Å; Y201-V271 HydrophobicContact CE1-CG1 3.88Å; Y201-V271 HydrophobicContact CE2-CG1 4.03Å; Y201-V271 HydrophobicContact CG-CG2 4.36Å; Y201-F275 AromaticContact CE2-CE2 3.53Å; Y201-F275 HydrophobicContact CE2-CE2 3.53Å; Y201-F275 AromaticContact CE2-CZ 3.76Å; Y201-F275 HydrophobicContact CE2-CZ 3.76Å; Y201-F275 AromaticContact CZ-CE2 3.52Å; Y201-F275 AromaticContact CZ-CZ 3.87Å; Y201-F275 WeakPolarHBondContact OH-CE2 3.4Å; Y201-F275 WeakPolarHBondContact OH-CZ 3.37Å; Y201-I404 HydrophobicContact CD2-CG2 3.77Å; Y201-I404 HydrophobicContact CE2-CG2 3.36Å; Y201-F408 HydrophobicContact CD1-CD2 4.03Å; Y201-F408 HydrophobicContact CD1-CE2 4.25Å; Y201-F408 HydrophobicContact CE1-CD2 4.27Å; Y201-F408 HydrophobicContact CE1-CE2 4.47Å
202	I	53.9	Low	53.6	Low	21 Å²	21	38.3 Å²	38.3	11%	0.108	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-35.7	176.9	-68.8	167.4	0	0	0	111.6	M198 P199 R415 I418 L422	M198-I202 VanDerWaalsContact O-CG1 3.29Å; M198-I202 WeakPolarHBondContact O-CG1 3.49Å; M198-I202 PolarHBondContact O-N 3.04Å; P199-I202 PolarHBondContact O-N 3.27Å; I202-R415 PolarHBondContact O-NH2 3.01Å; I202-I418 HydrophobicContact CD1-CG2 3.49Å; I202-I418 VanDerWaalsContact CD1-CG2 3.49Å; I202-I418 HydrophobicContact CG1-CG2 4.21Å; I202-L422 HydrophobicContact CD1-CD1 3.3Å
203	E	58.3	Low	53	Low	59 Å²	59	41.9 Å²	41.9	28%	0.276	20%	0.2	S	C	.	.	H	α-helix	trans	-69.7	-45.9	177.4	-161.9	61.4	-155.8	0	0	111	P199 A200 Y201 Q205 R206 Y207	P199-E203 PolarHBondContact O-N 3.22Å; A200-E203 PolarHBondContact O-N 2.83Å; Y201-E203 VanDerWaalsContact C-N 3.27Å; Y201-E203 PolarHBondContact O-N 3.42Å; E203-Q205 PolarHBondContact O-N 2.76Å; E203-R206 VanDerWaalsContact CD-NH1 3.34Å; E203-R206 VanDerWaalsContact O-CB 3.31Å; E203-R206 WeakPolarHBondContact O-CB 3.45Å; E203-R206 PolarHBondContact O-N 3.1Å; E203-R206 WeakPolarHBondContact OE1-CD 3.25Å; E203-R206 IonicContact OE1-CZ 3.86Å; E203-R206 IonicContact OE1-NH1 3.16Å; E203-R206 PolarHBondContact OE1-NH1 3.31Å; E203-R206 IonicContact OE2-CZ 3.65Å; E203-R206 IonicContact OE2-NE 3.72Å; E203-R206 PolarHBondContact OE2-NE 2.84Å; E203-R206 IonicContact OE2-NH1 2.81Å; E203-R206 PolarHBondContact OE2-NH1 3.38Å; E203-R206 IonicContact OE2-NH2 2.94Å; E203-Y207 HydrophobicContact CG-CE2 4.32Å; E203-Y207 WeakPolarHBondContact O-CD2 3.39Å
204	L	55.4	Low	52.2	Low	3 Å²	3	46.8 Å²	46.8	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-54	-41.1	174.5	177.3	58.6	0	0	0	112.2	A200 Y201 R206 Y207 C268 V271	A200-L204 PolarHBondContact O-N 3.49Å; Y201-L204 PolarHBondContact O-N 2.93Å; L204-R206 PolarHBondContact O-N 3.27Å; L204-Y207 PolarHBondContact O-N 3.12Å; L204-C268 HydrophobicContact CD1-CB 4.45Å; L204-C268 WeakPolarHBondContact CD1-SG 3.33Å; L204-V271 HydrophobicContact CB-CG2 4.45Å; L204-V271 HydrophobicContact CD2-CG2 4.29Å
205	Q	52.5	Low	51.7	Low	10 Å²	10	50.6 Å²	50.6	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-25.2	179.4	-157.6	-167.4	23.6	0	0	113.8	Y201 E203 Y207 M208	Y201-Q205 PolarHBondContact O-N 3.16Å; Y201-Q205 VanDerWaalsContact O-N 3.12Å; E203-Q205 PolarHBondContact O-N 2.76Å; Q205-Y207 PolarHBondContact O-N 2.64Å; Q205-M208 PolarHBondContact O-N 2.71Å
206	R	56.3	Low	51.1	Low	139 Å²	139	57 Å²	57	53%	0.525	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-30.8	177.9	-70.6	-176.4	172.6	169	-2.5	112.7	E203 L204	E203-R206 VanDerWaalsContact CD-NH1 3.34Å; E203-R206 VanDerWaalsContact O-CB 3.31Å; E203-R206 WeakPolarHBondContact O-CB 3.45Å; E203-R206 PolarHBondContact O-N 3.1Å; E203-R206 WeakPolarHBondContact OE1-CD 3.25Å; E203-R206 IonicContact OE1-CZ 3.86Å; E203-R206 IonicContact OE1-NH1 3.16Å; E203-R206 PolarHBondContact OE1-NH1 3.31Å; E203-R206 IonicContact OE2-CZ 3.65Å; E203-R206 IonicContact OE2-NE 3.72Å; E203-R206 PolarHBondContact OE2-NE 2.84Å; E203-R206 IonicContact OE2-NH1 2.81Å; E203-R206 PolarHBondContact OE2-NH1 3.38Å; E203-R206 IonicContact OE2-NH2 2.94Å; L204-R206 PolarHBondContact O-N 3.27Å
207	Y	54.5	Low	50.4	Low	64 Å²	64	55 Å²	55	25%	0.251	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-5.3	-174.4	-54.7	-76.1	0	0	0	112.7	E203 L204 Q205 Q263 A264	E203-Y207 HydrophobicContact CG-CE2 4.32Å; E203-Y207 WeakPolarHBondContact O-CD2 3.39Å; L204-Y207 PolarHBondContact O-N 3.12Å; Q205-Y207 PolarHBondContact O-N 2.64Å; Y207-Q263 HydrophobicContact CD1-CB 3.78Å; Y207-Q263 HydrophobicContact CD2-CB 4.37Å; Y207-Q263 HydrophobicContact CE1-CB 3.42Å; Y207-Q263 VanDerWaalsContact CE1-CB 3.42Å; Y207-Q263 HydrophobicContact CE1-CG 4.17Å; Y207-Q263 HydrophobicContact CE2-CB 4.05Å; Y207-Q263 HydrophobicContact CG-CB 4.25Å; Y207-A264 HydrophobicContact CG-CB 4.46Å
208	M	51.1	Low	49.9	Very low	20 Å²	20	55.7 Å²	55.7	10%	0.099	27%	0.272	C	S	.	.	S	Bend	trans	-81.2	123.5	174.7	-80.9	-79.3	164.3	0	0	111.4	Q205 F212 R213 W221	Q205-M208 PolarHBondContact O-N 2.71Å; M208-F212 HydrophobicContact SD-CB 4.3Å; M208-R213 PolarHBondContact O-NE 2.88Å; M208-R213 PolarHBondContact O-NH2 2.85Å; M208-R213 VanDerWaalsContact O-NH2 3.14Å; M208-W221 HydrophobicContact CE-CD2 3.78Å; M208-W221 HydrophobicContact CE-CE3 4.35Å; M208-W221 HydrophobicContact CE-CG 4.29Å; M208-W221 HydrophobicContact CE-CH2 4.01Å; M208-W221 HydrophobicContact CE-CZ2 3.38Å; M208-W221 HydrophobicContact CE-CZ3 4.45Å
209	P	47.1	Very low	49.4	Very low	32 Å²	32	63.1 Å²	63.1	21%	0.208	30%	0.3	C	S	.	.			trans	-61.5	150.8	174.9	-13.1	24.7	0	0	0	111.4	E211 F212 I255	P209-E211 WeakPolarHBondContact CB-OE2 3.5Å; P209-E211 PolarHBondContact O-N 3.48Å; P209-F212 HydrophobicContact CB-CD2 3.74Å; P209-F212 HydrophobicContact CB-CE2 4.25Å; P209-F212 HydrophobicContact CG-CD2 3.55Å; P209-F212 HydrophobicContact CG-CE2 3.85Å; P209-F212 PolarHBondContact O-N 3.07Å; P209-F212 VanDerWaalsContact O-N 3.13Å; P209-I255 HydrophobicContact CG-CD1 3.74Å; P209-I255 HydrophobicContact CG-CG1 3.93Å
210	V	47.3	Very low	49.1	Very low	97 Å²	97	63 Å²	63	59%	0.588	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-60.5	-32.6	-173.2	179.8	0	0	0	0	111.6	F212 R213	V210-F212 VanDerWaalsContact C-N 3.33Å; V210-F212 PolarHBondContact O-N 3.2Å; V210-R213 WeakPolarHBondContact O-CB 3.49Å; V210-R213 PolarHBondContact O-N 3.06Å
211	E	43.2	Very low	48.6	Very low	126 Å²	126	63.5 Å²	63.5	59%	0.589	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-68.2	-30.8	179.7	-52.2	88.7	-177.3	0	0	113	P209 R213 N214	P209-E211 WeakPolarHBondContact CB-OE2 3.5Å; P209-E211 PolarHBondContact O-N 3.48Å; E211-R213 VanDerWaalsContact C-N 3.26Å; E211-R213 PolarHBondContact O-N 3.15Å; E211-N214 WeakPolarHBondContact O-CB 3.48Å; E211-N214 PolarHBondContact O-N 3.28Å; E211-N214 PolarHBondContact O-ND2 3.19Å; E211-N214 VanDerWaalsContact O-ND2 3.08Å
212	F	44.6	Very low	48.2	Very low	34 Å²	34	63.6 Å²	63.6	15%	0.149	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-78.7	-6.8	176.5	-66.8	-85.6	0	0	0	113.4	M208 P209 V210 N214 F217	M208-F212 HydrophobicContact SD-CB 4.3Å; P209-F212 HydrophobicContact CB-CD2 3.74Å; P209-F212 HydrophobicContact CB-CE2 4.25Å; P209-F212 HydrophobicContact CG-CD2 3.55Å; P209-F212 HydrophobicContact CG-CE2 3.85Å; P209-F212 PolarHBondContact O-N 3.07Å; P209-F212 VanDerWaalsContact O-N 3.13Å; V210-F212 VanDerWaalsContact C-N 3.33Å; V210-F212 PolarHBondContact O-N 3.2Å; F212-N214 PolarHBondContact O-N 3.02Å; F212-F217 HydrophobicContact CB-CB 4.25Å; F212-F217 HydrophobicContact CD1-CB 4.04Å; F212-F217 AromaticContact CD1-CD1 3.61Å; F212-F217 HydrophobicContact CD1-CD1 3.61Å; F212-F217 HydrophobicContact CD1-CD2 4.16Å; F212-F217 HydrophobicContact CD1-CE1 4.05Å; F212-F217 AromaticContact CD1-CG 3.68Å; F212-F217 HydrophobicContact CD1-CG 3.68Å; F212-F217 HydrophobicContact CD1-CZ 4.49Å; F212-F217 AromaticContact CE1-CD1 3.92Å; F212-F217 HydrophobicContact CE1-CD1 3.92Å; F212-F217 AromaticContact CE1-CE1 3.91Å; F212-F217 HydrophobicContact CE1-CE1 3.91Å; F212-F217 HydrophobicContact CE1-CG 4.38Å; F212-F217 HydrophobicContact CE1-CZ 4.36Å; F212-F217 HydrophobicContact CG-CG 4.47Å; F212-F217 WeakPolarHBondContact O-CB 3.41Å
213	R	45.1	Very low	48	Very low	80 Å²	80	68.5 Å²	68.5	30%	0.302	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-78	-8.9	172.7	-56.5	178.9	-153.8	-179.5	6.7	112.5	M208 V210 E211 V218 A412	M208-R213 PolarHBondContact O-NE 2.88Å; M208-R213 PolarHBondContact O-NH2 2.85Å; M208-R213 VanDerWaalsContact O-NH2 3.14Å; V210-R213 WeakPolarHBondContact O-CB 3.49Å; V210-R213 PolarHBondContact O-N 3.06Å; E211-R213 VanDerWaalsContact C-N 3.26Å; E211-R213 PolarHBondContact O-N 3.15Å; R213-V218 WeakPolarHBondContact O-CG2 3.48Å; R213-A412 HydrophobicContact CB-CB 4.32Å
214	N	42.8	Very low	47.4	Very low	102 Å²	102	66.1 Å²	66.1	55%	0.545	30%	0.304	S	S	.	.	S	Bend	trans	-68.3	144.5	174.8	-71.6	-41.2	0	0	0	111.3	E211 F212 Y216 F217 V218	E211-N214 WeakPolarHBondContact O-CB 3.48Å; E211-N214 PolarHBondContact O-N 3.28Å; E211-N214 PolarHBondContact O-ND2 3.19Å; E211-N214 VanDerWaalsContact O-ND2 3.08Å; F212-N214 PolarHBondContact O-N 3.02Å; N214-Y216 PolarHBondContact O-N 3.01Å; N214-F217 PolarHBondContact O-N 3.02Å; N214-V218 PolarHBondContact O-N 2.98Å
215	S	43.2	Very low	46.9	Very low	80 Å²	80	67.4 Å²	67.4	56%	0.559	31%	0.311	S	S	*	.	H	α-helix	trans	-50.5	-31.1	-170.3	62.7	0	0	0	0	115.2	R219	S215-R219 WeakPolarHBondContact O-CG 3.41Å; S215-R219 PolarHBondContact O-N 3.47Å; S215-R219 VanDerWaalsContact O-N 3.11Å
216	Y	40.6	Very low	46.5	Very low	142 Å²	142	69.8 Å²	69.8	56%	0.557	32%	0.324	S	S	*	.	H	α-helix	trans	-66	-44.2	177.9	-177.6	-99.8	0	0	0	113.1	N214 K220	N214-Y216 PolarHBondContact O-N 3.01Å; Y216-K220 HydrophobicContact CE1-CD 4.38Å; Y216-K220 PolarHBondContact O-N 3.37Å; Y216-K220 WeakPolarHBondContact OH-CE 3.49Å
217	F	44.7	Very low	46	Very low	42 Å²	42	65.5 Å²	65.5	18%	0.184	31%	0.311	C	S	.	.	H	α-helix	trans	-78.7	-33.5	180	-70.4	-71.5	0	0	0	112.1	F212 N214 R219 K220 W221 L247	F212-F217 HydrophobicContact CB-CB 4.25Å; F212-F217 HydrophobicContact CD1-CB 4.04Å; F212-F217 AromaticContact CD1-CD1 3.61Å; F212-F217 HydrophobicContact CD1-CD1 3.61Å; F212-F217 HydrophobicContact CD1-CD2 4.16Å; F212-F217 HydrophobicContact CD1-CE1 4.05Å; F212-F217 AromaticContact CD1-CG 3.68Å; F212-F217 HydrophobicContact CD1-CG 3.68Å; F212-F217 HydrophobicContact CD1-CZ 4.49Å; F212-F217 AromaticContact CE1-CD1 3.92Å; F212-F217 HydrophobicContact CE1-CD1 3.92Å; F212-F217 AromaticContact CE1-CE1 3.91Å; F212-F217 HydrophobicContact CE1-CE1 3.91Å; F212-F217 HydrophobicContact CE1-CG 4.38Å; F212-F217 HydrophobicContact CE1-CZ 4.36Å; F212-F217 HydrophobicContact CG-CG 4.47Å; F212-F217 WeakPolarHBondContact O-CB 3.41Å; N214-F217 PolarHBondContact O-N 3.02Å; F217-R219 VanDerWaalsContact C-N 3.3Å; F217-R219 PolarHBondContact O-N 3.01Å; F217-K220 PolarHBondContact O-N 3.44Å; F217-W221 PolarHBondContact O-N 3.31Å; F217-L247 HydrophobicContact CD1-CD2 4.34Å
218	V	44.7	Very low	45.4	Very low	15 Å²	15	63.8 Å²	63.8	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-57.9	-42.5	170.3	174.8	0	0	0	0	111.1	R213 N214 W221 L222 F408	R213-V218 WeakPolarHBondContact O-CG2 3.48Å; N214-V218 PolarHBondContact O-N 2.98Å; V218-W221 PolarHBondContact O-N 3.25Å; V218-L222 HydrophobicContact CG1-CD1 3.9Å; V218-L222 WeakPolarHBondContact O-CB 3.47Å; V218-L222 PolarHBondContact O-N 3.37Å; V218-F408 HydrophobicContact CB-CD1 4.16Å; V218-F408 HydrophobicContact CB-CE1 4.34Å; V218-F408 HydrophobicContact CG1-CD1 3.48Å; V218-F408 VanDerWaalsContact CG1-CD1 3.48Å; V218-F408 HydrophobicContact CG1-CE1 4.05Å; V218-F408 HydrophobicContact CG1-CG 4.35Å; V218-F408 HydrophobicContact CG2-CD1 3.77Å; V218-F408 HydrophobicContact CG2-CE1 3.88Å
219	R	44.2	Very low	44.8	Very low	160 Å²	160	67.9 Å²	67.9	60%	0.604	33%	0.332	S	S	*	.	H	α-helix	trans	-63.9	-42.6	175	-77	177.7	-171.5	-176.9	2.4	112.9	S215 F217 K223	S215-R219 WeakPolarHBondContact O-CG 3.41Å; S215-R219 PolarHBondContact O-N 3.47Å; S215-R219 VanDerWaalsContact O-N 3.11Å; F217-R219 VanDerWaalsContact C-N 3.3Å; F217-R219 PolarHBondContact O-N 3.01Å; R219-K223 VanDerWaalsContact O-CB 3.3Å; R219-K223 WeakPolarHBondContact O-CB 3.43Å; R219-K223 PolarHBondContact O-N 3.19Å
220	K	47.8	Very low	44.5	Very low	56 Å²	56	72.6 Å²	72.6	24%	0.243	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-41.7	175.4	-81.2	-166.3	179	-172.2	0	111.1	Y216 F217 K223 L224 L247 E250	Y216-K220 HydrophobicContact CE1-CD 4.38Å; Y216-K220 PolarHBondContact O-N 3.37Å; Y216-K220 WeakPolarHBondContact OH-CE 3.49Å; F217-K220 PolarHBondContact O-N 3.44Å; K220-K223 PolarHBondContact O-N 3.38Å; K220-L224 WeakPolarHBondContact O-CB 2.95Å; K220-L224 PolarHBondContact O-N 3.19Å; K220-L247 HydrophobicContact CB-CD1 4.04Å; K220-L247 HydrophobicContact CB-CD2 3.84Å; K220-L247 HydrophobicContact CB-CG 4.49Å; K220-L247 HydrophobicContact CD-CD2 3.42Å; K220-L247 VanDerWaalsContact CD-CD2 3.42Å; K220-L247 HydrophobicContact CD-CG 4.2Å; K220-L247 HydrophobicContact CG-CD2 4.28Å; K220-E250 IonicContact NZ-OE1 3.83Å; K220-E250 IonicContact NZ-OE2 2.64Å; K220-E250 PolarHBondContact NZ-OE2 3.28Å
221	W	48.6	Very low	44.1	Very low	22 Å²	22	70.4 Å²	70.4	8%	0.083	34%	0.338	C	S	.	.	H	α-helix	trans	-66.1	-44.3	175.2	-90.3	104.5	0	0	0	113.2	M208 F217 V218 K223 L224 I225	M208-W221 HydrophobicContact CE-CD2 3.78Å; M208-W221 HydrophobicContact CE-CE3 4.35Å; M208-W221 HydrophobicContact CE-CG 4.29Å; M208-W221 HydrophobicContact CE-CH2 4.01Å; M208-W221 HydrophobicContact CE-CZ2 3.38Å; M208-W221 HydrophobicContact CE-CZ3 4.45Å; F217-W221 PolarHBondContact O-N 3.31Å; V218-W221 PolarHBondContact O-N 3.25Å; W221-K223 VanDerWaalsContact C-N 3.32Å; W221-K223 PolarHBondContact O-N 3.48Å; W221-L224 PolarHBondContact O-N 3.32Å; W221-I225 VanDerWaalsContact O-CG1 3.3Å; W221-I225 WeakPolarHBondContact O-CG1 3.16Å; W221-I225 PolarHBondContact O-N 3.2Å
222	L	45.4	Very low	43.9	Very low	32 Å²	32	73.5 Å²	73.5	17%	0.168	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-42.1	173.5	-93.3	160	0	0	0	111.7	V218 L224 I225 N226	V218-L222 HydrophobicContact CG1-CD1 3.9Å; V218-L222 WeakPolarHBondContact O-CB 3.47Å; V218-L222 PolarHBondContact O-N 3.37Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L222-I225 PolarHBondContact O-N 2.89Å; L222-N226 PolarHBondContact O-N 3.48Å
223	K	50.9	Low	43.9	Very low	124 Å²	124	74.2 Å²	74.2	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-45.2	174	-171.7	-168.5	170.2	-158.6	0	110.8	R219 K220 W221 I225 N226 D227	R219-K223 VanDerWaalsContact O-CB 3.3Å; R219-K223 WeakPolarHBondContact O-CB 3.43Å; R219-K223 PolarHBondContact O-N 3.19Å; K220-K223 PolarHBondContact O-N 3.38Å; W221-K223 VanDerWaalsContact C-N 3.32Å; W221-K223 PolarHBondContact O-N 3.48Å; K223-I225 PolarHBondContact O-N 2.98Å; K223-N226 CarbonylContact O-C 3.59Å; K223-N226 WeakPolarHBondContact O-CB 3.5Å; K223-N226 PolarHBondContact O-N 2.94Å; K223-N226 VanDerWaalsContact O-N 3.13Å; K223-D227 WeakPolarHBondContact CE-OD2 3.41Å; K223-D227 WeakPolarHBondContact O-CB 3.42Å; K223-D227 VanDerWaalsContact O-CG 3.25Å; K223-D227 PolarHBondContact O-N 3.37Å
224	L	46.2	Very low	43.8	Very low	8 Å²	8	76.1 Å²	76.1	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-67.3	-36.8	-179.4	-150.6	151.2	0	0	0	112.3	K220 W221 L222 D227 A228 L240 E243 C244 L247	K220-L224 WeakPolarHBondContact O-CB 2.95Å; K220-L224 PolarHBondContact O-N 3.19Å; W221-L224 PolarHBondContact O-N 3.32Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L224-D227 PolarHBondContact O-N 2.84Å; L224-A228 WeakPolarHBondContact O-CB 3.19Å; L224-A228 PolarHBondContact O-N 3.2Å; L224-L240 HydrophobicContact CD2-CD2 3.53Å; L224-L240 HydrophobicContact CD2-CG 3.66Å; L224-L240 HydrophobicContact CG-CG 4.27Å; L224-E243 HydrophobicContact CD1-CB 3.93Å; L224-C244 HydrophobicContact CD1-CB 4.36Å; L224-C244 HydrophobicContact CD2-CB 4.41Å; L224-C244 WeakPolarHBondContact CD2-SG 3.32Å; L224-L247 HydrophobicContact CD1-CD1 3.42Å; L224-L247 VanDerWaalsContact CD1-CD1 3.42Å
225	I	43.7	Very low	44.4	Very low	30 Å²	30	76.8 Å²	76.8	15%	0.154	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-41.6	169.9	-68.5	166	0	0	0	110.8	W221 L222 K223 A228 I229	W221-I225 VanDerWaalsContact O-CG1 3.3Å; W221-I225 WeakPolarHBondContact O-CG1 3.16Å; W221-I225 PolarHBondContact O-N 3.2Å; L222-I225 PolarHBondContact O-N 2.89Å; K223-I225 PolarHBondContact O-N 2.98Å; I225-A228 WeakPolarHBondContact O-CB 3.44Å; I225-A228 PolarHBondContact O-N 3.37Å; I225-I229 HydrophobicContact CG2-CD1 4.05Å; I225-I229 VanDerWaalsContact O-CG1 3.24Å; I225-I229 WeakPolarHBondContact O-CG1 3.41Å; I225-I229 PolarHBondContact O-N 3.22Å
226	N	43.9	Very low	44.5	Very low	61 Å²	61	76 Å²	76	33%	0.326	37%	0.372	S	S	.	.	H	α-helix	trans	-67	-42.9	174.9	-75.6	-21.6	0	0	0	112.5	L222 K223 A228 I229 E230	L222-N226 PolarHBondContact O-N 3.48Å; K223-N226 CarbonylContact O-C 3.59Å; K223-N226 WeakPolarHBondContact O-CB 3.5Å; K223-N226 PolarHBondContact O-N 2.94Å; K223-N226 VanDerWaalsContact O-N 3.13Å; N226-A228 PolarHBondContact O-N 3.42Å; N226-I229 WeakPolarHBondContact O-CA 3.41Å; N226-I229 WeakPolarHBondContact O-CB 3.3Å; N226-I229 PolarHBondContact O-N 3.41Å; N226-I229 VanDerWaalsContact O-N 3.09Å; N226-E230 PolarHBondContact O-N 3.22Å
227	D	46	Very low	44.6	Very low	48 Å²	48	72.1 Å²	72.1	26%	0.257	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-32.3	174.2	-66.7	-25.8	0	0	0	109.5	K223 L224 E230 V231 L240	K223-D227 WeakPolarHBondContact CE-OD2 3.41Å; K223-D227 WeakPolarHBondContact O-CB 3.42Å; K223-D227 VanDerWaalsContact O-CG 3.25Å; K223-D227 PolarHBondContact O-N 3.37Å; L224-D227 PolarHBondContact O-N 2.84Å; D227-E230 PolarHBondContact O-N 3.37Å; D227-V231 WeakPolarHBondContact O-CG2 3.25Å; D227-V231 PolarHBondContact O-N 2.85Å; D227-L240 HydrophobicContact CB-CD1 3.44Å; D227-L240 VanDerWaalsContact CB-CD1 3.44Å; D227-L240 WeakPolarHBondContact O-CD1 3.34Å
228	A	43.2	Very low	45.1	Very low	28 Å²	28	76.6 Å²	76.6	23%	0.231	39%	0.385	C	S	.	.	H	α-helix	trans	-67.1	-42.9	173.1	0	0	0	0	0	111.9	L224 I225 N226 E230 V231 L240	L224-A228 WeakPolarHBondContact O-CB 3.19Å; L224-A228 PolarHBondContact O-N 3.2Å; I225-A228 WeakPolarHBondContact O-CB 3.44Å; I225-A228 PolarHBondContact O-N 3.37Å; N226-A228 PolarHBondContact O-N 3.42Å; A228-E230 PolarHBondContact O-N 3.48Å; A228-V231 VanDerWaalsContact O-CB 3.32Å; A228-V231 WeakPolarHBondContact O-CB 3.44Å; A228-V231 WeakPolarHBondContact O-CG2 3.24Å; A228-V231 PolarHBondContact O-N 2.89Å; A228-L240 HydrophobicContact CB-CD1 4.29Å; A228-L240 HydrophobicContact CB-CD2 3.49Å; A228-L240 VanDerWaalsContact CB-CD2 3.49Å
229	I	36.9	Very low	45.8	Very low	106 Å²	106	82.4 Å²	82.4	54%	0.544	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-33.2	175.3	-69.6	162.4	0	0	0	110.6	I225 N226	I225-I229 HydrophobicContact CG2-CD1 4.05Å; I225-I229 VanDerWaalsContact O-CG1 3.24Å; I225-I229 WeakPolarHBondContact O-CG1 3.41Å; I225-I229 PolarHBondContact O-N 3.22Å; N226-I229 WeakPolarHBondContact O-CA 3.41Å; N226-I229 WeakPolarHBondContact O-CB 3.3Å; N226-I229 PolarHBondContact O-N 3.41Å; N226-I229 VanDerWaalsContact O-N 3.09Å
230	E	41	Very low	46.1	Very low	131 Å²	131	75.9 Å²	75.9	61%	0.612	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	1.8	178.2	-69.5	-165.3	177.8	0	0	114.9	N226 D227 A228 K232	N226-E230 PolarHBondContact O-N 3.22Å; D227-E230 PolarHBondContact O-N 3.37Å; A228-E230 PolarHBondContact O-N 3.48Å; E230-K232 PolarHBondContact O-N 2.9Å
231	V	39.9	Very low	46.1	Very low	51 Å²	51	78.6 Å²	78.6	31%	0.309	40%	0.4	S	S	.	.			trans	-61	103.3	177.9	170.8	0	0	0	0	110	D227 A228 S233 D236 L240	D227-V231 WeakPolarHBondContact O-CG2 3.25Å; D227-V231 PolarHBondContact O-N 2.85Å; A228-V231 VanDerWaalsContact O-CB 3.32Å; A228-V231 WeakPolarHBondContact O-CB 3.44Å; A228-V231 WeakPolarHBondContact O-CG2 3.24Å; A228-V231 PolarHBondContact O-N 2.89Å; V231-S233 WeakPolarHBondContact CG1-O 3.39Å; V231-D236 HydrophobicContact CB-CB 4.27Å; V231-D236 HydrophobicContact CG1-CB 4.1Å; V231-D236 HydrophobicContact CG2-CB 4.02Å; V231-L240 HydrophobicContact CG2-CD1 4.21Å
232	K	39.1	Very low	46.8	Very low	192 Å²	192	81.3 Å²	81.3	84%	0.835	42%	0.419	S	S	*	.			trans	-99.6	-13.3	175.9	-71.7	171.1	-172.8	171.6	0	112.2	E230 D236	E230-K232 PolarHBondContact O-N 2.9Å; K232-D236 PolarHBondContact N-OD2 3.46Å
233	S	43.5	Very low	47.3	Very low	49 Å²	49	83 Å²	83	34%	0.343	43%	0.426	S	S	.	.	S	Bend	trans	-142.2	158.9	-177.4	78.5	0	0	0	0	113.8	V231 N235 D236 S237	V231-S233 WeakPolarHBondContact CG1-O 3.39Å; S233-N235 PolarHBondContact O-N 3.41Å; S233-N235 PolarHBondContact OG-N 2.87Å; S233-D236 WeakPolarHBondContact CB-OD2 3.46Å; S233-D236 PolarHBondContact N-OD2 3.44Å; S233-D236 WeakPolarHBondContact O-CB 3.46Å; S233-D236 PolarHBondContact O-N 3.19Å; S233-D236 PolarHBondContact OG-N 2.93Å; S233-D236 PolarHBondContact OG-OD1 3.45Å; S233-D236 PolarHBondContact OG-OD2 3.15Å; S233-S237 PolarHBondContact O-N 2.92Å
234	T	44.1	Very low	47.3	Very low	120 Å²	120	78.4 Å²	78.4	74%	0.736	41%	0.409	S	S	*	.	H	α-helix	trans	-61.3	-21.7	174.2	48.7	0	0	0	0	113.7	K238	T234-K238 PolarHBondContact O-N 2.84Å
235	N	54.4	Low	47.6	Very low	116 Å²	116	81.4 Å²	81.4	62%	0.62	43%	0.425	S	S	*	.	H	α-helix	trans	-75.1	-35.2	173.9	-87.6	-3.9	0	0	0	111.8	S233 S237 K238 K239	S233-N235 PolarHBondContact O-N 3.41Å; S233-N235 PolarHBondContact OG-N 2.87Å; N235-S237 VanDerWaalsContact C-N 3.33Å; N235-K238 PolarHBondContact O-N 2.86Å; N235-K239 WeakPolarHBondContact O-CB 3.34Å; N235-K239 PolarHBondContact O-N 3.42Å
236	D	45.7	Very low	48.2	Very low	62 Å²	62	84.1 Å²	84.1	33%	0.332	44%	0.44	S	S	.	.	H	α-helix	trans	-65.3	-40.9	177.1	-51.9	-41	0	0	0	109.9	V231 K232 S233 K238 K239 L240	V231-D236 HydrophobicContact CB-CB 4.27Å; V231-D236 HydrophobicContact CG1-CB 4.1Å; V231-D236 HydrophobicContact CG2-CB 4.02Å; K232-D236 PolarHBondContact N-OD2 3.46Å; S233-D236 WeakPolarHBondContact CB-OD2 3.46Å; S233-D236 PolarHBondContact N-OD2 3.44Å; S233-D236 WeakPolarHBondContact O-CB 3.46Å; S233-D236 PolarHBondContact O-N 3.19Å; S233-D236 PolarHBondContact OG-N 2.93Å; S233-D236 PolarHBondContact OG-OD1 3.45Å; S233-D236 PolarHBondContact OG-OD2 3.15Å; D236-K238 PolarHBondContact O-N 3.12Å; D236-K239 WeakPolarHBondContact O-CB 3.38Å; D236-K239 PolarHBondContact O-N 2.94Å; D236-L240 WeakPolarHBondContact O-CB 3.26Å; D236-L240 PolarHBondContact O-N 2.94Å
237	S	42.9	Very low	48.5	Very low	62 Å²	62	81.9 Å²	81.9	43%	0.434	43%	0.428	S	S	.	.	H	α-helix	trans	-58.9	-44.9	174.1	169	0	0	0	0	113.3	S233 N235 K239 L240 E241	S233-S237 PolarHBondContact O-N 2.92Å; N235-S237 VanDerWaalsContact C-N 3.33Å; S237-K239 VanDerWaalsContact C-N 3.34Å; S237-K239 PolarHBondContact O-N 2.79Å; S237-L240 WeakPolarHBondContact O-CB 3.46Å; S237-L240 PolarHBondContact O-N 2.91Å; S237-E241 WeakPolarHBondContact O-CB 3.33Å; S237-E241 PolarHBondContact O-N 3.37Å
238	K	55.5	Low	48.6	Very low	136 Å²	136	83.2 Å²	83.2	59%	0.591	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-37.8	176.1	-75	-178.3	178	179.1	0	112.5	T234 N235 D236 L240 E241 V242	T234-K238 PolarHBondContact O-N 2.84Å; N235-K238 PolarHBondContact O-N 2.86Å; D236-K238 PolarHBondContact O-N 3.12Å; K238-L240 VanDerWaalsContact C-N 3.32Å; K238-E241 PolarHBondContact O-N 3.34Å; K238-V242 WeakPolarHBondContact O-CG2 3.47Å; K238-V242 PolarHBondContact O-N 2.89Å
239	K	60	Low	49	Very low	136 Å²	136	87.4 Å²	87.4	59%	0.591	45%	0.453	S	S	*	.	H	α-helix	trans	-66.1	-40.7	177.7	-160.5	-175.8	177.9	-163.8	0	110.5	N235 D236 S237 V242 E243	N235-K239 WeakPolarHBondContact O-CB 3.34Å; N235-K239 PolarHBondContact O-N 3.42Å; D236-K239 WeakPolarHBondContact O-CB 3.38Å; D236-K239 PolarHBondContact O-N 2.94Å; S237-K239 VanDerWaalsContact C-N 3.34Å; S237-K239 PolarHBondContact O-N 2.79Å; K239-V242 PolarHBondContact O-N 3.42Å; K239-E243 WeakPolarHBondContact O-CG 3.32Å; K239-E243 PolarHBondContact O-N 2.88Å
240	L	48.9	Very low	49.6	Very low	23 Å²	23	87.7 Å²	87.7	12%	0.12	45%	0.452	C	S	.	.	H	α-helix	trans	-62.9	-43.6	173.6	-143	104.2	0	0	0	112.4	L224 D227 A228 V231 D236 S237 K238 V242 E243 C244	L224-L240 HydrophobicContact CD2-CD2 3.53Å; L224-L240 HydrophobicContact CD2-CG 3.66Å; L224-L240 HydrophobicContact CG-CG 4.27Å; D227-L240 HydrophobicContact CB-CD1 3.44Å; D227-L240 VanDerWaalsContact CB-CD1 3.44Å; D227-L240 WeakPolarHBondContact O-CD1 3.34Å; A228-L240 HydrophobicContact CB-CD1 4.29Å; A228-L240 HydrophobicContact CB-CD2 3.49Å; A228-L240 VanDerWaalsContact CB-CD2 3.49Å; V231-L240 HydrophobicContact CG2-CD1 4.21Å; D236-L240 WeakPolarHBondContact O-CB 3.26Å; D236-L240 PolarHBondContact O-N 2.94Å; S237-L240 WeakPolarHBondContact O-CB 3.46Å; S237-L240 PolarHBondContact O-N 2.91Å; K238-L240 VanDerWaalsContact C-N 3.32Å; L240-V242 VanDerWaalsContact C-N 3.31Å; L240-V242 PolarHBondContact O-N 2.87Å; L240-E243 PolarHBondContact O-N 3.5Å; L240-C244 WeakPolarHBondContact O-CB 3.22Å; L240-C244 PolarHBondContact O-N 2.84Å
241	E	49.4	Very low	49.6	Very low	114 Å²	114	87.5 Å²	87.5	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176	-171.4	-178.3	-176.2	0	0	111.2	S237 K238 C244 N245	S237-E241 WeakPolarHBondContact O-CB 3.33Å; S237-E241 PolarHBondContact O-N 3.37Å; K238-E241 PolarHBondContact O-N 3.34Å; E241-C244 WeakPolarHBondContact O-CB 3.5Å; E241-C244 PolarHBondContact O-N 3.37Å; E241-N245 WeakPolarHBondContact O-CB 3.38Å; E241-N245 VanDerWaalsContact O-CG 3.26Å; E241-N245 PolarHBondContact O-N 3.26Å; E241-N245 PolarHBondContact O-ND2 2.98Å
242	V	62.1	Low	49.6	Very low	79 Å²	79	90.4 Å²	90.4	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-48.6	173.6	172.8	0	0	0	0	111.2	K238 K239 L240 C244 N245 D246	K238-V242 WeakPolarHBondContact O-CG2 3.47Å; K238-V242 PolarHBondContact O-N 2.89Å; K239-V242 PolarHBondContact O-N 3.42Å; L240-V242 VanDerWaalsContact C-N 3.31Å; L240-V242 PolarHBondContact O-N 2.87Å; V242-C244 VanDerWaalsContact C-N 3.26Å; V242-C244 PolarHBondContact O-N 3.11Å; V242-N245 PolarHBondContact O-N 3.26Å; V242-N245 VanDerWaalsContact O-N 3.12Å; V242-D246 WeakPolarHBondContact O-CB 3.33Å; V242-D246 VanDerWaalsContact O-CG 3.28Å; V242-D246 PolarHBondContact O-N 3.41Å
243	E	56.6	Low	49.4	Very low	66 Å²	66	88.4 Å²	88.4	31%	0.308	48%	0.476	S	S	.	.	H	α-helix	trans	-61.7	-34.4	178.1	-74.1	-177.1	-165.5	0	0	112.2	L224 K239 L240 L247	L224-E243 HydrophobicContact CD1-CB 3.93Å; K239-E243 WeakPolarHBondContact O-CG 3.32Å; K239-E243 PolarHBondContact O-N 2.88Å; L240-E243 PolarHBondContact O-N 3.5Å; E243-L247 WeakPolarHBondContact O-CB 3.42Å; E243-L247 PolarHBondContact O-N 3.38Å
244	C	50.5	Low	49	Very low	28 Å²	28	95.1 Å²	95.1	19%	0.189	49%	0.493	C	S	.	.	H	α-helix	trans	-63.7	-49.4	172.3	-104.4	0	0	0	0	111	L224 L240 E241 V242 D246 L247 L248	L224-C244 HydrophobicContact CD1-CB 4.36Å; L224-C244 HydrophobicContact CD2-CB 4.41Å; L224-C244 WeakPolarHBondContact CD2-SG 3.32Å; L240-C244 WeakPolarHBondContact O-CB 3.22Å; L240-C244 PolarHBondContact O-N 2.84Å; E241-C244 WeakPolarHBondContact O-CB 3.5Å; E241-C244 PolarHBondContact O-N 3.37Å; V242-C244 VanDerWaalsContact C-N 3.26Å; V242-C244 PolarHBondContact O-N 3.11Å; C244-D246 VanDerWaalsContact C-N 3.35Å; C244-L247 WeakPolarHBondContact O-CB 3.42Å; C244-L247 PolarHBondContact O-N 3.36Å; C244-L248 VanDerWaalsContact O-CG 3.28Å; C244-L248 WeakPolarHBondContact O-CG 3.33Å; C244-L248 PolarHBondContact O-N 3.43Å
245	N	51.8	Low	48.9	Very low	72 Å²	72	93.6 Å²	93.6	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-64.5	-40.1	179.4	-76	-40.7	0	0	0	111.5	E241 V242 L248 N249	E241-N245 WeakPolarHBondContact O-CB 3.38Å; E241-N245 VanDerWaalsContact O-CG 3.26Å; E241-N245 PolarHBondContact O-N 3.26Å; E241-N245 PolarHBondContact O-ND2 2.98Å; V242-N245 PolarHBondContact O-N 3.26Å; V242-N245 VanDerWaalsContact O-N 3.12Å; N245-L248 PolarHBondContact O-N 2.9Å; N245-N249 VanDerWaalsContact O-CB 3.27Å; N245-N249 WeakPolarHBondContact O-CB 3.16Å; N245-N249 PolarHBondContact O-N 3.42Å; N245-N249 PolarHBondContact O-ND2 3.32Å
246	D	56.8	Low	48.4	Very low	87 Å²	87	95.7 Å²	95.7	47%	0.465	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-42.2	176.3	-71.9	-17.4	0	0	0	111.1	V242 C244 L248 N249 E250	V242-D246 WeakPolarHBondContact O-CB 3.33Å; V242-D246 VanDerWaalsContact O-CG 3.28Å; V242-D246 PolarHBondContact O-N 3.41Å; C244-D246 VanDerWaalsContact C-N 3.35Å; D246-L248 VanDerWaalsContact C-N 3.35Å; D246-L248 PolarHBondContact O-N 3.2Å; D246-N249 CarbonylContact O-C 3.53Å; D246-N249 PolarHBondContact O-N 2.74Å; D246-N249 VanDerWaalsContact O-N 3.13Å; D246-E250 WeakPolarHBondContact O-CB 3.42Å; D246-E250 PolarHBondContact O-N 3.5Å
247	L	51.4	Low	48.4	Very low	13 Å²	13	97.8 Å²	97.8	7%	0.068	50%	0.495	C	S	.	.	H	α-helix	trans	-61.8	-38.9	172.6	-98.6	165.3	0	0	0	113.6	F217 K220 L224 E243 C244 N249	F217-L247 HydrophobicContact CD1-CD2 4.34Å; K220-L247 HydrophobicContact CB-CD1 4.04Å; K220-L247 HydrophobicContact CB-CD2 3.84Å; K220-L247 HydrophobicContact CB-CG 4.49Å; K220-L247 HydrophobicContact CD-CD2 3.42Å; K220-L247 VanDerWaalsContact CD-CD2 3.42Å; K220-L247 HydrophobicContact CD-CG 4.2Å; K220-L247 HydrophobicContact CG-CD2 4.28Å; L224-L247 HydrophobicContact CD1-CD1 3.42Å; L224-L247 VanDerWaalsContact CD1-CD1 3.42Å; E243-L247 WeakPolarHBondContact O-CB 3.42Å; E243-L247 PolarHBondContact O-N 3.38Å; C244-L247 WeakPolarHBondContact O-CB 3.42Å; C244-L247 PolarHBondContact O-N 3.36Å; L247-N249 VanDerWaalsContact C-N 3.28Å
248	L	47.9	Very low	48.9	Very low	77 Å²	77	98.8 Å²	98.8	40%	0.403	51%	0.507	S	S	.	.	H	α-helix	trans	-69.5	-27.8	174.4	-70.6	168.2	0	0	0	112	C244 N245 D246	C244-L248 VanDerWaalsContact O-CG 3.28Å; C244-L248 WeakPolarHBondContact O-CG 3.33Å; C244-L248 PolarHBondContact O-N 3.43Å; N245-L248 PolarHBondContact O-N 2.9Å; D246-L248 VanDerWaalsContact C-N 3.35Å; D246-L248 PolarHBondContact O-N 3.2Å
249	N	50.2	Low	48.8	Very low	116 Å²	116	95.4 Å²	95.4	62%	0.62	50%	0.5	S	S	*	.	H	α-helix	trans	-92.8	-17	-177.6	-70.1	-32.1	0	0	0	114.1	N245 D246 L247 D251	N245-N249 VanDerWaalsContact O-CB 3.27Å; N245-N249 WeakPolarHBondContact O-CB 3.16Å; N245-N249 PolarHBondContact O-N 3.42Å; N245-N249 PolarHBondContact O-ND2 3.32Å; D246-N249 CarbonylContact O-C 3.53Å; D246-N249 PolarHBondContact O-N 2.74Å; D246-N249 VanDerWaalsContact O-N 3.13Å; L247-N249 VanDerWaalsContact C-N 3.28Å; N249-D251 PolarHBondContact O-N 3.2Å; N249-D251 VanDerWaalsContact O-N 3.1Å
250	E	49.9	Very low	48.3	Very low	112 Å²	112	90.2 Å²	90.2	52%	0.523	48%	0.482	S	S	.	.	S	Bend	trans	-71.3	0.2	-169.8	-117.4	-171.5	-179.7	0	0	115.7	K220 D246	K220-E250 IonicContact NZ-OE1 3.83Å; K220-E250 IonicContact NZ-OE2 2.64Å; K220-E250 PolarHBondContact NZ-OE2 3.28Å; D246-E250 WeakPolarHBondContact O-CB 3.42Å; D246-E250 PolarHBondContact O-N 3.5Å
251	D	40.8	Very low	48.4	Very low	127 Å²	127	91.8 Å²	91.8	68%	0.679	50%	0.495	S	S	*	.	S	Bend	trans	-151.3	111.7	154.2	-106.2	-33.1	0	0	0	111.9	N249 L253	N249-D251 PolarHBondContact O-N 3.2Å; N249-D251 VanDerWaalsContact O-N 3.1Å; D251-L253 PolarHBondContact O-N 3.46Å
252	S	40.4	Very low	48.7	Very low	112 Å²	112	91.3 Å²	91.3	78%	0.783	49%	0.493	S	S	*	.			trans	-75	61.3	-172.8	50.5	0	0	0	0	113.1
253	L	34.5	Very low	48.5	Very low	150 Å²	150	91.5 Å²	91.5	79%	0.785	49%	0.489	S	S	*	.	S	Bend	trans	-137.1	83.7	166.4	-81.6	169.5	0	0	0	112.6	D251	D251-L253 PolarHBondContact O-N 3.46Å
254	R	35.3	Very low	48.2	Very low	189 Å²	189	89.2 Å²	89.2	71%	0.713	48%	0.482	S	S	*	.			trans	70.7	65.8	143.2	-57.1	179.6	178.3	-177	3.6	118.6	K256	R254-K256 HydrophobicContact CB-CG 4.16Å; R254-K256 HydrophobicContact CG-CG 4.35Å; R254-K256 PolarHBondContact O-N 3.06Å
255	I	41.1	Very low	48.3	Very low	89 Å²	89	93.2 Å²	93.2	46%	0.456	50%	0.497	S	S	.	.			trans	-82.3	92.9	136.7	-56.5	175.9	0	0	0	105.9	P209 D257	P209-I255 HydrophobicContact CG-CD1 3.74Å; P209-I255 HydrophobicContact CG-CG1 3.93Å; I255-D257 VanDerWaalsContact C-N 3.31Å
256	K	44.9	Very low	48.8	Very low	159 Å²	159	95.7 Å²	95.7	69%	0.691	51%	0.505	S	S	*	.			trans	-79.5	-10.8	-177.7	-81.8	-173.3	174.8	-173	0	114	R254	R254-K256 HydrophobicContact CB-CG 4.16Å; R254-K256 HydrophobicContact CG-CG 4.35Å; R254-K256 PolarHBondContact O-N 3.06Å
257	D	46.6	Very low	48.8	Very low	107 Å²	107	92 Å²	92	57%	0.572	49%	0.486	S	S	*	.			trans	-103.7	106.2	-177.3	-78.8	-32.9	0	0	0	111.4	I255 S259 A260 S261	I255-D257 VanDerWaalsContact C-N 3.31Å; D257-S259 PolarHBondContact O-N 2.97Å; D257-A260 HydrophobicContact CB-CB 4.16Å; D257-A260 PolarHBondContact O-N 3.14Å; D257-A260 VanDerWaalsContact O-N 3.1Å; D257-S261 PolarHBondContact O-N 2.99Å
258	A	53	Low	48.9	Very low	83 Å²	83	92.7 Å²	92.7	69%	0.686	49%	0.491	S	S	*	.	H	α-helix	trans	-56.5	-28.5	171.7	0	0	0	0	0	112.5	S261 E262	A258-S261 PolarHBondContact O-N 3.25Å; A258-E262 PolarHBondContact O-N 2.98Å; A258-E262 VanDerWaalsContact O-N 3.08Å
259	S	53.6	Low	49.4	Very low	65 Å²	65	93.7 Å²	93.7	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-37.1	175.9	56.5	0	0	0	0	113.1	D257 E262 Q263	D257-S259 PolarHBondContact O-N 2.97Å; S259-E262 PolarHBondContact O-N 3.49Å; S259-Q263 WeakPolarHBondContact O-CB 3.27Å; S259-Q263 WeakPolarHBondContact O-CG 3.29Å; S259-Q263 PolarHBondContact O-N 3.19Å; S259-Q263 PolarHBondContact O-OE1 2.95Å
260	A	49	Very low	49.9	Very low	26 Å²	26	91.1 Å²	91.1	22%	0.215	49%	0.485	C	S	.	.	H	α-helix	trans	-70	-35.9	178.2	0	0	0	0	0	111.4	D257 Q263 A264	D257-A260 HydrophobicContact CB-CB 4.16Å; D257-A260 PolarHBondContact O-N 3.14Å; D257-A260 VanDerWaalsContact O-N 3.1Å; A260-Q263 PolarHBondContact O-N 3.44Å; A260-A264 WeakPolarHBondContact O-CB 3.36Å; A260-A264 PolarHBondContact O-N 3.35Å
261	S	50.3	Low	50.1	Low	56 Å²	56	86.1 Å²	86.1	39%	0.392	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-45.6	173.2	178	0	0	0	0	111.7	D257 A258 Q263 A264 Q265	D257-S261 PolarHBondContact O-N 2.99Å; A258-S261 PolarHBondContact O-N 3.25Å; S261-Q263 VanDerWaalsContact C-N 3.33Å; S261-Q263 PolarHBondContact O-N 3.03Å; S261-A264 PolarHBondContact O-N 3.03Å; S261-Q265 PolarHBondContact O-N 3.12Å
262	E	56.6	Low	50.6	Low	105 Å²	105	84.2 Å²	84.2	49%	0.491	45%	0.449	S	S	.	.	H	α-helix	trans	-62.6	-39.1	176.2	-164.9	-166.8	149.9	0	0	111.9	A258 S259 Q265 K266	A258-E262 PolarHBondContact O-N 2.98Å; A258-E262 VanDerWaalsContact O-N 3.08Å; S259-E262 PolarHBondContact O-N 3.49Å; E262-Q265 PolarHBondContact O-N 3Å; E262-K266 WeakPolarHBondContact O-CG 3.46Å; E262-K266 PolarHBondContact O-N 3.2Å; E262-K266 VanDerWaalsContact OE1-CE 3.29Å; E262-K266 WeakPolarHBondContact OE1-CE 3.25Å; E262-K266 IonicContact OE1-NZ 3.57Å; E262-K266 PolarHBondContact OE1-NZ 2.94Å
263	Q	56.6	Low	51.6	Low	82 Å²	82	81.4 Å²	81.4	38%	0.383	43%	0.433	S	S	.	.	H	α-helix	trans	-72.9	-33.3	177.2	-79.2	166	-23.5	0	0	113.5	Y207 S259 A260 S261 K266 S267	Y207-Q263 HydrophobicContact CD1-CB 3.78Å; Y207-Q263 HydrophobicContact CD2-CB 4.37Å; Y207-Q263 HydrophobicContact CE1-CB 3.42Å; Y207-Q263 VanDerWaalsContact CE1-CB 3.42Å; Y207-Q263 HydrophobicContact CE1-CG 4.17Å; Y207-Q263 HydrophobicContact CE2-CB 4.05Å; Y207-Q263 HydrophobicContact CG-CB 4.25Å; S259-Q263 WeakPolarHBondContact O-CB 3.27Å; S259-Q263 WeakPolarHBondContact O-CG 3.29Å; S259-Q263 PolarHBondContact O-N 3.19Å; S259-Q263 PolarHBondContact O-OE1 2.95Å; A260-Q263 PolarHBondContact O-N 3.44Å; S261-Q263 VanDerWaalsContact C-N 3.33Å; S261-Q263 PolarHBondContact O-N 3.03Å; Q263-K266 PolarHBondContact O-N 2.88Å; Q263-S267 WeakPolarHBondContact O-CB 3.44Å; Q263-S267 PolarHBondContact O-N 3.37Å; Q263-S267 PolarHBondContact O-OG 3.01Å
264	A	51.1	Low	52.7	Low	19 Å²	19	74.8 Å²	74.8	16%	0.157	40%	0.399	C	S	.	.	H	α-helix	trans	-62.3	-45.6	169.8	0	0	0	0	0	110.6	Y207 A260 S261 K266 S267 C268	Y207-A264 HydrophobicContact CG-CB 4.46Å; A260-A264 WeakPolarHBondContact O-CB 3.36Å; A260-A264 PolarHBondContact O-N 3.35Å; S261-A264 PolarHBondContact O-N 3.03Å; A264-K266 PolarHBondContact O-N 3.25Å; A264-S267 WeakPolarHBondContact O-CB 3.24Å; A264-S267 PolarHBondContact O-N 2.98Å; A264-S267 VanDerWaalsContact O-N 3.16Å; A264-C268 PolarHBondContact O-N 3.16Å
265	Q	53.4	Low	53.6	Low	112 Å²	112	68 Å²	68	52%	0.523	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-41.7	178.3	-167	172.8	3.2	0	0	112.1	S261 E262 S267 C268 H269	S261-Q265 PolarHBondContact O-N 3.12Å; E262-Q265 PolarHBondContact O-N 3Å; Q265-S267 VanDerWaalsContact C-N 3.33Å; Q265-S267 PolarHBondContact O-N 3.24Å; Q265-C268 WeakPolarHBondContact O-CB 3.34Å; Q265-C268 PolarHBondContact O-N 3.24Å; Q265-H269 PolarHBondContact O-CD2 2.95Å; Q265-H269 PolarHBondContact O-N 3.06Å
266	K	62.3	Low	54.3	Low	123 Å²	123	67.4 Å²	67.4	54%	0.535	38%	0.379	S	S	.	.	H	α-helix	trans	-60.3	-41.9	171.8	-75.4	174.6	-173.8	165	0	112.3	E262 Q263 A264 H269 S270	E262-K266 WeakPolarHBondContact O-CG 3.46Å; E262-K266 PolarHBondContact O-N 3.2Å; E262-K266 VanDerWaalsContact OE1-CE 3.29Å; E262-K266 WeakPolarHBondContact OE1-CE 3.25Å; E262-K266 IonicContact OE1-NZ 3.57Å; E262-K266 PolarHBondContact OE1-NZ 2.94Å; Q263-K266 PolarHBondContact O-N 2.88Å; A264-K266 PolarHBondContact O-N 3.25Å; K266-H269 PolarHBondContact O-N 2.99Å; K266-S270 PolarHBondContact O-N 2.96Å
267	S	56.9	Low	55.1	Low	11 Å²	11	61.8 Å²	61.8	8%	0.077	36%	0.358	C	S	.	.	H	α-helix	trans	-66.9	-39.1	177.2	-57.1	0	0	0	0	112	Q263 A264 Q265 S270 V271	Q263-S267 WeakPolarHBondContact O-CB 3.44Å; Q263-S267 PolarHBondContact O-N 3.37Å; Q263-S267 PolarHBondContact O-OG 3.01Å; A264-S267 WeakPolarHBondContact O-CB 3.24Å; A264-S267 PolarHBondContact O-N 2.98Å; A264-S267 VanDerWaalsContact O-N 3.16Å; Q265-S267 VanDerWaalsContact C-N 3.33Å; Q265-S267 PolarHBondContact O-N 3.24Å; S267-S270 WeakPolarHBondContact O-CB 3.47Å; S267-S270 PolarHBondContact O-N 3.33Å; S267-V271 WeakPolarHBondContact O-CG2 3.42Å; S267-V271 PolarHBondContact O-N 2.83Å
268	C	52.3	Low	55.4	Low	26 Å²	26	57.1 Å²	57.1	18%	0.176	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-49.8	171.5	-78.4	0	0	0	0	111.3	L204 A264 Q265 S270 V271 E272	L204-C268 HydrophobicContact CD1-CB 4.45Å; L204-C268 WeakPolarHBondContact CD1-SG 3.33Å; A264-C268 PolarHBondContact O-N 3.16Å; Q265-C268 WeakPolarHBondContact O-CB 3.34Å; Q265-C268 PolarHBondContact O-N 3.24Å; C268-S270 PolarHBondContact O-N 2.97Å; C268-V271 WeakPolarHBondContact O-CB 3.5Å; C268-V271 PolarHBondContact O-N 3.45Å; C268-E272 WeakPolarHBondContact O-CG 3.35Å; C268-E272 PolarHBondContact O-N 3.37Å
269	H	59.4	Low	55.4	Low	99 Å²	99	56.1 Å²	56.1	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-31.4	176.6	-71.1	-39.3	0	0	0	112.8	Q265 K266 E272 A273	Q265-H269 PolarHBondContact O-CD2 2.95Å; Q265-H269 PolarHBondContact O-N 3.06Å; K266-H269 PolarHBondContact O-N 2.99Å; H269-E272 IonicContact CE1-OE2 2.96Å; H269-E272 IonicContact CG-OE2 3.66Å; H269-E272 IonicContact ND1-OE2 2.7Å; H269-E272 PolarHBondContact ND1-OE2 2.87Å; H269-E272 PolarHBondContact O-N 3.44Å; H269-A273 VanDerWaalsContact O-CB 3.28Å; H269-A273 WeakPolarHBondContact O-CB 3.32Å; H269-A273 PolarHBondContact O-N 3.48Å
270	S	59.8	Low	55.7	Low	62 Å²	62	58.2 Å²	58.2	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-38.9	172.7	-169.4	0	0	0	0	112.3	K266 S267 C268 A274	K266-S270 PolarHBondContact O-N 2.96Å; S267-S270 WeakPolarHBondContact O-CB 3.47Å; S267-S270 PolarHBondContact O-N 3.33Å; C268-S270 PolarHBondContact O-N 2.97Å; S270-A274 WeakPolarHBondContact O-CB 3.28Å; S270-A274 PolarHBondContact O-N 2.76Å
271	V	53.6	Low	56.2	Low	7 Å²	7	60.6 Å²	60.6	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-46.2	174.3	172.9	0	0	0	0	110.1	A200 Y201 L204 S267 C268 A273 A274 F275	A200-V271 HydrophobicContact CB-CG2 3.74Å; Y201-V271 HydrophobicContact CD1-CG1 4.31Å; Y201-V271 HydrophobicContact CD1-CG2 4.27Å; Y201-V271 HydrophobicContact CD2-CG1 4.48Å; Y201-V271 HydrophobicContact CE1-CG1 3.88Å; Y201-V271 HydrophobicContact CE2-CG1 4.03Å; Y201-V271 HydrophobicContact CG-CG2 4.36Å; L204-V271 HydrophobicContact CB-CG2 4.45Å; L204-V271 HydrophobicContact CD2-CG2 4.29Å; S267-V271 WeakPolarHBondContact O-CG2 3.42Å; S267-V271 PolarHBondContact O-N 2.83Å; C268-V271 WeakPolarHBondContact O-CB 3.5Å; C268-V271 PolarHBondContact O-N 3.45Å; V271-A273 PolarHBondContact O-N 2.92Å; V271-A274 PolarHBondContact O-N 2.78Å; V271-F275 HydrophobicContact CG1-CD2 3.73Å; V271-F275 HydrophobicContact CG1-CE2 3.67Å; V271-F275 VanDerWaalsContact O-CD2 3.32Å; V271-F275 WeakPolarHBondContact O-CD2 3.26Å; V271-F275 PolarHBondContact O-N 3.1Å
272	E	51.4	Low	56.4	Low	86 Å²	86	58.1 Å²	58.1	40%	0.402	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-43.7	175.9	-70.7	172.2	170.6	0	0	112.6	C268 H269 F275 S276	C268-E272 WeakPolarHBondContact O-CG 3.35Å; C268-E272 PolarHBondContact O-N 3.37Å; H269-E272 IonicContact CE1-OE2 2.96Å; H269-E272 IonicContact CG-OE2 3.66Å; H269-E272 IonicContact ND1-OE2 2.7Å; H269-E272 PolarHBondContact ND1-OE2 2.87Å; H269-E272 PolarHBondContact O-N 3.44Å; E272-F275 PolarHBondContact O-N 3.14Å; E272-S276 WeakPolarHBondContact O-CB 3.44Å; E272-S276 PolarHBondContact O-N 2.64Å; E272-S276 PolarHBondContact O-OG 2.94Å
273	A	62.4	Low	56.3	Low	54 Å²	54	57.1 Å²	57.1	45%	0.446	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-40.7	177.3	0	0	0	0	0	111.9	H269 V271 S276 T277	H269-A273 VanDerWaalsContact O-CB 3.28Å; H269-A273 WeakPolarHBondContact O-CB 3.32Å; H269-A273 PolarHBondContact O-N 3.48Å; V271-A273 PolarHBondContact O-N 2.92Å; A273-S276 PolarHBondContact O-N 3.43Å; A273-T277 PolarHBondContact O-N 3.41Å; A273-T277 PolarHBondContact O-OG1 2.89Å
274	A	58.1	Low	56.3	Low	10 Å²	10	59.1 Å²	59.1	8%	0.083	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-43.6	175.3	0	0	0	0	0	111.3	L197 S270 V271 S276 T277 V278	L197-A274 HydrophobicContact CD2-CB 3.73Å; S270-A274 WeakPolarHBondContact O-CB 3.28Å; S270-A274 PolarHBondContact O-N 2.76Å; V271-A274 PolarHBondContact O-N 2.78Å; A274-S276 PolarHBondContact O-N 3.38Å; A274-T277 WeakPolarHBondContact O-CB 3.15Å; A274-T277 PolarHBondContact O-N 2.75Å; A274-V278 WeakPolarHBondContact O-CG2 3.46Å; A274-V278 PolarHBondContact O-N 2.86Å
275	F	53.5	Low	56.5	Low	47 Å²	47	58.7 Å²	58.7	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-41	173.1	-89.3	-71.7	0	0	0	113.2	L197 Y201 V271 E272 T277 V278 S279	L197-F275 HydrophobicContact CD1-CD1 3.95Å; L197-F275 HydrophobicContact CD1-CE1 3.52Å; L197-F275 HydrophobicContact CD1-CE2 4.29Å; L197-F275 HydrophobicContact CD1-CZ 3.7Å; L197-F275 HydrophobicContact CD2-CB 4.27Å; L197-F275 HydrophobicContact CD2-CD1 3.87Å; L197-F275 HydrophobicContact CD2-CD2 3.36Å; L197-F275 HydrophobicContact CD2-CE1 3.96Å; L197-F275 HydrophobicContact CD2-CE2 3.44Å; L197-F275 VanDerWaalsContact CD2-CE2 3.44Å; L197-F275 HydrophobicContact CD2-CG 3.57Å; L197-F275 HydrophobicContact CD2-CZ 3.75Å; L197-F275 HydrophobicContact CG-CE1 4.41Å; L197-F275 HydrophobicContact CG-CE2 4.44Å; L197-F275 HydrophobicContact CG-CZ 4.33Å; Y201-F275 AromaticContact CE2-CE2 3.53Å; Y201-F275 HydrophobicContact CE2-CE2 3.53Å; Y201-F275 AromaticContact CE2-CZ 3.76Å; Y201-F275 HydrophobicContact CE2-CZ 3.76Å; Y201-F275 AromaticContact CZ-CE2 3.52Å; Y201-F275 AromaticContact CZ-CZ 3.87Å; Y201-F275 WeakPolarHBondContact OH-CE2 3.4Å; Y201-F275 WeakPolarHBondContact OH-CZ 3.37Å; V271-F275 HydrophobicContact CG1-CD2 3.73Å; V271-F275 HydrophobicContact CG1-CE2 3.67Å; V271-F275 VanDerWaalsContact O-CD2 3.32Å; V271-F275 WeakPolarHBondContact O-CD2 3.26Å; V271-F275 PolarHBondContact O-N 3.1Å; E272-F275 PolarHBondContact O-N 3.14Å; F275-T277 PolarHBondContact O-N 3.45Å; F275-V278 PolarHBondContact O-N 3.23Å; F275-S279 WeakPolarHBondContact O-CB 3.43Å; F275-S279 PolarHBondContact O-N 2.9Å
276	S	56.6	Low	56.2	Low	76 Å²	76	54.3 Å²	54.3	53%	0.531	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-38.7	176.1	-61.7	0	0	0	0	110.8	E272 A273 A274 S279 E280	E272-S276 WeakPolarHBondContact O-CB 3.44Å; E272-S276 PolarHBondContact O-N 2.64Å; E272-S276 PolarHBondContact O-OG 2.94Å; A273-S276 PolarHBondContact O-N 3.43Å; A274-S276 PolarHBondContact O-N 3.38Å; S276-S279 WeakPolarHBondContact O-CB 3.45Å; S276-S279 PolarHBondContact O-N 3.11Å; S276-E280 WeakPolarHBondContact O-CB 3.42Å; S276-E280 PolarHBondContact O-N 3.25Å
277	T	61.3	Low	55.4	Low	42 Å²	42	51.1 Å²	51.1	26%	0.258	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-44.8	175.8	-53.5	0	0	0	0	111.8	S193 A273 A274 F275 S279 E280 R281	S193-T277 WeakPolarHBondContact OG-CG2 3.34Å; A273-T277 PolarHBondContact O-N 3.41Å; A273-T277 PolarHBondContact O-OG1 2.89Å; A274-T277 WeakPolarHBondContact O-CB 3.15Å; A274-T277 PolarHBondContact O-N 2.75Å; F275-T277 PolarHBondContact O-N 3.45Å; T277-S279 VanDerWaalsContact C-N 3.3Å; T277-S279 PolarHBondContact O-N 3.48Å; T277-E280 PolarHBondContact O-N 3.1Å; T277-R281 WeakPolarHBondContact O-CB 3.26Å; T277-R281 WeakPolarHBondContact O-CG 3.46Å; T277-R281 PolarHBondContact O-N 2.81Å
278	V	52.5	Low	54.7	Low	9 Å²	9	59.2 Å²	59.2	6%	0.055	33%	0.328	C	S	.	.	H	α-helix	trans	-57.6	-45.8	172.2	174.8	0	0	0	0	110.6	L190 S193 L197 A274 F275 R281 S282	L190-V278 HydrophobicContact CD1-CG1 3.9Å; L190-V278 WeakPolarHBondContact CD1-O 3.39Å; S193-V278 WeakPolarHBondContact O-CG2 3.27Å; L197-V278 HydrophobicContact CD1-CG2 4.16Å; L197-V278 HydrophobicContact CG-CG2 4.27Å; A274-V278 WeakPolarHBondContact O-CG2 3.46Å; A274-V278 PolarHBondContact O-N 2.86Å; F275-V278 PolarHBondContact O-N 3.23Å; V278-R281 PolarHBondContact O-N 2.89Å; V278-S282 VanDerWaalsContact O-CB 3.24Å; V278-S282 WeakPolarHBondContact O-CB 3.44Å; V278-S282 PolarHBondContact O-N 2.87Å; V278-S282 PolarHBondContact O-OG 3.49Å
279	S	53.1	Low	54.2	Low	61 Å²	61	63 Å²	63	43%	0.427	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-49.5	179.4	-166	0	0	0	0	111.7	F275 S276 T277 R281 S282 A283	F275-S279 WeakPolarHBondContact O-CB 3.43Å; F275-S279 PolarHBondContact O-N 2.9Å; S276-S279 WeakPolarHBondContact O-CB 3.45Å; S276-S279 PolarHBondContact O-N 3.11Å; T277-S279 VanDerWaalsContact C-N 3.3Å; T277-S279 PolarHBondContact O-N 3.48Å; S279-R281 PolarHBondContact O-N 3.31Å; S279-S282 WeakPolarHBondContact CA-OG 3.35Å; S279-S282 PolarHBondContact O-N 3.13Å; S279-S282 PolarHBondContact O-OG 3.1Å; S279-A283 PolarHBondContact O-N 3.18Å
280	E	60.7	Low	53.4	Low	109 Å²	109	59.7 Å²	59.7	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-44.3	178.2	-165.6	-168.1	159.2	0	0	112	S276 T277 A283 K284	S276-E280 WeakPolarHBondContact O-CB 3.42Å; S276-E280 PolarHBondContact O-N 3.25Å; T277-E280 PolarHBondContact O-N 3.1Å; E280-A283 PolarHBondContact O-N 2.96Å; E280-K284 WeakPolarHBondContact O-CG 3.32Å; E280-K284 PolarHBondContact O-N 3.35Å; E280-K284 VanDerWaalsContact OE1-CE 3.29Å; E280-K284 WeakPolarHBondContact OE1-CE 3.42Å; E280-K284 IonicContact OE1-NZ 3.14Å; E280-K284 PolarHBondContact OE1-NZ 3.23Å
281	R	59.6	Low	52.5	Low	77 Å²	77	59.4 Å²	59.4	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-68.2	-36.2	178.1	-71.3	-172.9	-173.6	177.6	7.7	112.5	H189 L190 S193 T277 V278 S279 A283 K284 L285	H189-R281 WeakPolarHBondContact O-CD 3.41Å; H189-R281 PolarHBondContact O-NH1 3.26Å; L190-R281 HydrophobicContact CD1-CB 4.42Å; S193-R281 VanDerWaalsContact OG-CD 3.28Å; S193-R281 WeakPolarHBondContact OG-CD 3.47Å; S193-R281 PolarHBondContact OG-NE 2.85Å; S193-R281 PolarHBondContact OG-NH1 2.97Å; T277-R281 WeakPolarHBondContact O-CB 3.26Å; T277-R281 WeakPolarHBondContact O-CG 3.46Å; T277-R281 PolarHBondContact O-N 2.81Å; V278-R281 PolarHBondContact O-N 2.89Å; S279-R281 PolarHBondContact O-N 3.31Å; R281-A283 VanDerWaalsContact C-N 3.33Å; R281-A283 PolarHBondContact O-N 2.85Å; R281-K284 PolarHBondContact O-N 3.25Å; R281-K284 VanDerWaalsContact O-N 3.17Å; R281-L285 PolarHBondContact O-N 3.43Å
282	S	52.8	Low	51.9	Low	4 Å²	4	64.2 Å²	64.2	3%	0.028	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-34.9	175	71.9	0	0	0	0	112.7	V278 S279 K284 L285 R336	V278-S282 VanDerWaalsContact O-CB 3.24Å; V278-S282 WeakPolarHBondContact O-CB 3.44Å; V278-S282 PolarHBondContact O-N 2.87Å; V278-S282 PolarHBondContact O-OG 3.49Å; S279-S282 WeakPolarHBondContact CA-OG 3.35Å; S279-S282 PolarHBondContact O-N 3.13Å; S279-S282 PolarHBondContact O-OG 3.1Å; S282-K284 VanDerWaalsContact C-N 3.25Å; S282-K284 PolarHBondContact O-N 3.03Å; S282-L285 WeakPolarHBondContact O-CB 3.34Å; S282-L285 PolarHBondContact O-N 2.9Å; S282-R336 PolarHBondContact OG-NH1 3.15Å; S282-R336 PolarHBondContact OG-NH2 2.77Å
283	A	55.8	Low	51.5	Low	83 Å²	83	63.4 Å²	63.4	69%	0.686	36%	0.358	S	S	*	.	H	α-helix	trans	-70.7	-22.3	174.1	0	0	0	0	0	112.8	S279 E280 R281	S279-A283 PolarHBondContact O-N 3.18Å; E280-A283 PolarHBondContact O-N 2.96Å; R281-A283 VanDerWaalsContact C-N 3.33Å; R281-A283 PolarHBondContact O-N 2.85Å
284	K	55.3	Low	50.4	Low	125 Å²	125	66.8 Å²	66.8	54%	0.543	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-6.5	175.5	-71.7	174.8	-174.6	170	0	114.1	E280 R281 S282 P286	E280-K284 WeakPolarHBondContact O-CG 3.32Å; E280-K284 PolarHBondContact O-N 3.35Å; E280-K284 VanDerWaalsContact OE1-CE 3.29Å; E280-K284 WeakPolarHBondContact OE1-CE 3.42Å; E280-K284 IonicContact OE1-NZ 3.14Å; E280-K284 PolarHBondContact OE1-NZ 3.23Å; R281-K284 PolarHBondContact O-N 3.25Å; R281-K284 VanDerWaalsContact O-N 3.17Å; S282-K284 VanDerWaalsContact C-N 3.25Å; S282-K284 PolarHBondContact O-N 3.03Å; K284-P286 WeakPolarHBondContact O-CD 3.39Å; K284-P286 VanDerWaalsContact O-N 3.15Å
285	L	55.5	Low	49.6	Very low	9 Å²	9	67.4 Å²	67.4	5%	0.047	37%	0.365	C	S	.	.	S	Bend	trans	-55.4	122.4	167.5	-89	155.2	0	0	0	107.7	N186 L187 L190 R281 S282 V287	N186-L285 HydrophobicContact CB-CD2 4.29Å; L187-L285 HydrophobicContact CB-CD2 4.34Å; L187-L285 HydrophobicContact CD1-CD2 4.41Å; L190-L285 HydrophobicContact CD2-CD1 3.68Å; R281-L285 PolarHBondContact O-N 3.43Å; S282-L285 WeakPolarHBondContact O-CB 3.34Å; S282-L285 PolarHBondContact O-N 2.9Å; L285-V287 PolarHBondContact O-N 3.01Å
286	P	47.8	Very low	49	Very low	20 Å²	20	69.7 Å²	69.7	13%	0.13	38%	0.376	C	S	.	.			trans	-75.5	71.2	-167.8	30.2	-35.1	0	0	0	110.7	N186 K284 K288 D289 F290	N186-P286 WeakPolarHBondContact ND2-CD 3.26Å; K284-P286 WeakPolarHBondContact O-CD 3.39Å; K284-P286 VanDerWaalsContact O-N 3.15Å; P286-K288 PolarHBondContact O-N 3.44Å; P286-D289 HydrophobicContact CB-CB 4.3Å; P286-F290 VanDerWaalsContact O-CD2 3.31Å; P286-F290 WeakPolarHBondContact O-CD2 3.46Å
287	V	44.9	Very low	48.3	Very low	56 Å²	56	71.3 Å²	71.3	34%	0.339	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-27.4	169.4	-176	0	0	0	0	109.9	L285 S291 V329	L285-V287 PolarHBondContact O-N 3.01Å; V287-S291 PolarHBondContact O-N 3.14Å; V287-V329 HydrophobicContact CG2-CG1 3.89Å
288	K	42.6	Very low	47.3	Very low	181 Å²	181	71.5 Å²	71.5	79%	0.787	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-33.2	-177.7	-72.2	-174.2	178.6	178.4	0	114.4	P286 F290 S291	P286-K288 PolarHBondContact O-N 3.44Å; K288-F290 VanDerWaalsContact C-N 3.28Å; K288-F290 PolarHBondContact O-N 3.26Å; K288-S291 WeakPolarHBondContact O-CB 3.37Å; K288-S291 PolarHBondContact O-N 2.85Å; K288-S291 VanDerWaalsContact O-N 3.08Å; K288-S291 PolarHBondContact O-OG 3.42Å
289	D	41	Very low	46.8	Very low	107 Å²	107	72.2 Å²	72.2	57%	0.572	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-22.9	178.7	-67.4	-27.3	0	0	0	112.2	P286 S291	P286-D289 HydrophobicContact CB-CB 4.3Å; D289-S291 VanDerWaalsContact C-N 3.31Å
290	F	43.4	Very low	46.2	Very low	29 Å²	29	72.5 Å²	72.5	13%	0.127	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	14.3	168.3	-64.4	-70.8	0	0	0	113.2	T183 P286 K288 N292 L295 L326	T183-F290 HydrophobicContact CG2-CE2 4.4Å; T183-F290 WeakPolarHBondContact OG1-CE2 3.01Å; P286-F290 VanDerWaalsContact O-CD2 3.31Å; P286-F290 WeakPolarHBondContact O-CD2 3.46Å; K288-F290 VanDerWaalsContact C-N 3.28Å; K288-F290 PolarHBondContact O-N 3.26Å; F290-N292 PolarHBondContact O-N 3.45Å; F290-L295 HydrophobicContact CB-CD1 3.97Å; F290-L295 HydrophobicContact CD1-CD1 3.62Å; F290-L295 HydrophobicContact CD1-CD2 4.32Å; F290-L295 HydrophobicContact CD1-CG 3.94Å; F290-L295 HydrophobicContact CG-CD1 4.26Å; F290-L326 HydrophobicContact CB-CD1 4.13Å; F290-L326 HydrophobicContact CB-CD2 3.76Å; F290-L326 HydrophobicContact CG-CD2 4.38Å
291	S	41.1	Very low	45.1	Very low	55 Å²	55	73.6 Å²	73.6	39%	0.385	39%	0.391	S	S	.	.			trans	-50.2	132.3	171.8	54.8	0	0	0	0	109	V287 K288 D289 S293 F294	V287-S291 PolarHBondContact O-N 3.14Å; K288-S291 WeakPolarHBondContact O-CB 3.37Å; K288-S291 PolarHBondContact O-N 2.85Å; K288-S291 VanDerWaalsContact O-N 3.08Å; K288-S291 PolarHBondContact O-OG 3.42Å; D289-S291 VanDerWaalsContact C-N 3.31Å; S291-S293 PolarHBondContact O-N 3.18Å; S291-F294 PolarHBondContact O-N 2.92Å
292	N	41.3	Very low	44	Very low	109 Å²	109	72.3 Å²	72.3	58%	0.583	39%	0.389	S	S	*	.	H	α-helix	trans	-38.1	-39.9	-169.9	-84.8	-26.5	0	0	0	113	F290 F294 E296	F290-N292 PolarHBondContact O-N 3.45Å; N292-F294 PolarHBondContact O-N 2.76Å; N292-E296 WeakPolarHBondContact O-CA 3.3Å; N292-E296 WeakPolarHBondContact O-CB 3.31Å; N292-E296 PolarHBondContact O-N 3.06Å
293	S	43.3	Very low	43.3	Very low	69 Å²	69	76.4 Å²	76.4	48%	0.483	40%	0.404	S	S	.	.	H	α-helix	trans	-61.3	-40.6	-178.9	55.2	0	0	0	0	116.1	S291 L297	S291-S293 PolarHBondContact O-N 3.18Å; S293-L297 WeakPolarHBondContact O-CB 3.3Å; S293-L297 WeakPolarHBondContact O-CD1 3.32Å; S293-L297 WeakPolarHBondContact O-CG 3.36Å; S293-L297 PolarHBondContact O-N 3.18Å
294	F	38	Very low	42.4	Very low	124 Å²	124	76.7 Å²	76.7	54%	0.544	40%	0.401	S	S	.	.	H	α-helix	trans	-77.5	-43.7	-175.9	-175	-96.1	0	0	0	112.3	S291 N292 E296 L297 S298	S291-F294 PolarHBondContact O-N 2.92Å; N292-F294 PolarHBondContact O-N 2.76Å; F294-E296 VanDerWaalsContact C-N 3.34Å; F294-L297 PolarHBondContact O-N 3.49Å; F294-S298 WeakPolarHBondContact O-CB 3.15Å; F294-S298 PolarHBondContact O-N 3.15Å; F294-S298 PolarHBondContact O-OG 3.34Å
295	L	41.7	Very low	41.4	Very low	24 Å²	24	76.2 Å²	76.2	13%	0.126	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-44.5	170.7	-91.7	172	0	0	0	110.5	F290 S298 L299 L322 L326	F290-L295 HydrophobicContact CB-CD1 3.97Å; F290-L295 HydrophobicContact CD1-CD1 3.62Å; F290-L295 HydrophobicContact CD1-CD2 4.32Å; F290-L295 HydrophobicContact CD1-CG 3.94Å; F290-L295 HydrophobicContact CG-CD1 4.26Å; L295-S298 PolarHBondContact O-N 2.97Å; L295-L299 HydrophobicContact CD2-CD1 4.48Å; L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CD1 3.49Å; L295-L299 WeakPolarHBondContact O-CG 3.43Å; L295-L299 PolarHBondContact O-N 3.41Å; L295-L322 HydrophobicContact CD2-CD1 3.92Å; L295-L326 HydrophobicContact CD1-CD1 4.34Å
296	E	40.3	Very low	40.5	Very low	95 Å²	95	78.1 Å²	78.1	44%	0.444	42%	0.423	S	S	.	.	H	α-helix	trans	-68.5	-36.7	-179.8	-164.3	166.2	-128.2	0	0	111.7	N292 F294 C300 R319	N292-E296 WeakPolarHBondContact O-CA 3.3Å; N292-E296 WeakPolarHBondContact O-CB 3.31Å; N292-E296 PolarHBondContact O-N 3.06Å; F294-E296 VanDerWaalsContact C-N 3.34Å; E296-C300 WeakPolarHBondContact O-CA 3.5Å; E296-C300 WeakPolarHBondContact O-CB 3.21Å; E296-C300 PolarHBondContact O-N 3.21Å; E296-C300 PolarHBondContact O-SG 2.99Å; E296-R319 IonicContact OE1-NH2 3.07Å
297	L	42.3	Very low	40.1	Very low	109 Å²	109	83 Å²	83	57%	0.571	46%	0.458	S	S	*	.	H	α-helix	trans	-65.6	-46.8	172.3	-90.1	157.4	0	0	0	112.5	S293 F294 C300 H301	S293-L297 WeakPolarHBondContact O-CB 3.3Å; S293-L297 WeakPolarHBondContact O-CD1 3.32Å; S293-L297 WeakPolarHBondContact O-CG 3.36Å; S293-L297 PolarHBondContact O-N 3.18Å; F294-L297 PolarHBondContact O-N 3.49Å; L297-C300 PolarHBondContact O-N 3.48Å; L297-H301 PolarHBondContact O-N 3.33Å
298	S	41.1	Very low	39.7	Very low	47 Å²	47	84.8 Å²	84.8	33%	0.329	47%	0.465	S	S	.	.	H	α-helix	trans	-63.3	-45.8	179	-56	0	0	0	0	110.7	F294 L295 I302	F294-S298 WeakPolarHBondContact O-CB 3.15Å; F294-S298 PolarHBondContact O-N 3.15Å; F294-S298 PolarHBondContact O-OG 3.34Å; L295-S298 PolarHBondContact O-N 2.97Å; S298-I302 WeakPolarHBondContact O-CD1 3.21Å; S298-I302 VanDerWaalsContact O-CG1 3.24Å; S298-I302 WeakPolarHBondContact O-CG1 3.38Å; S298-I302 PolarHBondContact O-N 3.31Å
299	L	41.9	Very low	39.5	Very low	24 Å²	24	84.4 Å²	84.4	13%	0.126	46%	0.464	C	S	.	.	H	α-helix	trans	-69.9	-37.7	176.4	-63.2	169.7	0	0	0	111.3	L295 I302 Y303 M315 R319	L295-L299 HydrophobicContact CD2-CD1 4.48Å; L295-L299 WeakPolarHBondContact O-CB 3.3Å; L295-L299 WeakPolarHBondContact O-CD1 3.49Å; L295-L299 WeakPolarHBondContact O-CG 3.43Å; L295-L299 PolarHBondContact O-N 3.41Å; L299-I302 CarbonylContact O-C 3.56Å; L299-I302 WeakPolarHBondContact O-CB 3.43Å; L299-I302 PolarHBondContact O-N 3.44Å; L299-Y303 WeakPolarHBondContact O-CB 3.37Å; L299-Y303 VanDerWaalsContact O-CD2 3.27Å; L299-Y303 WeakPolarHBondContact O-CD2 3.27Å; L299-Y303 PolarHBondContact O-N 3.44Å; L299-M315 HydrophobicContact CB-CE 3.99Å; L299-M315 HydrophobicContact CD2-CE 3.33Å; L299-M315 HydrophobicContact CD2-SD 4.1Å; L299-M315 HydrophobicContact CG-CE 4.25Å; L299-R319 HydrophobicContact CD1-CB 4.33Å
300	C	40	Very low	39.2	Very low	67 Å²	67	84 Å²	84	45%	0.453	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-40.3	177.4	-82	0	0	0	0	113	E296 L297 I302 Y303 S304	E296-C300 WeakPolarHBondContact O-CA 3.5Å; E296-C300 WeakPolarHBondContact O-CB 3.21Å; E296-C300 PolarHBondContact O-N 3.21Å; E296-C300 PolarHBondContact O-SG 2.99Å; L297-C300 PolarHBondContact O-N 3.48Å; C300-I302 VanDerWaalsContact C-N 3.27Å; C300-I302 PolarHBondContact O-N 2.97Å; C300-Y303 WeakPolarHBondContact O-CB 2.99Å; C300-Y303 PolarHBondContact O-N 3.08Å; C300-Y303 VanDerWaalsContact O-N 3.16Å; C300-S304 WeakPolarHBondContact O-CB 3.39Å; C300-S304 PolarHBondContact O-N 3.44Å
301	H	38.1	Very low	39	Very low	132 Å²	132	85.4 Å²	85.4	61%	0.611	47%	0.467	S	S	*	.	H	α-helix	trans	-60.7	-40.6	173.7	-101.1	25	0	0	0	111.4	L297 S304	L297-H301 PolarHBondContact O-N 3.33Å; H301-S304 PolarHBondContact O-N 3.38Å; H301-S304 PolarHBondContact O-OG 3.19Å; H301-S304 VanDerWaalsContact O-OG 3.06Å
302	I	36.7	Very low	39	Very low	50 Å²	50	86 Å²	86	26%	0.256	47%	0.468	S	S	.	.	H	α-helix	trans	-65.8	-37.6	173.1	-60.5	165.1	0	0	0	111.7	E172 S298 L299 C300 M315	E172-I302 HydrophobicContact CB-CD1 4.31Å; E172-I302 VanDerWaalsContact OE2-CG1 3.25Å; E172-I302 WeakPolarHBondContact OE2-CG1 3.41Å; S298-I302 WeakPolarHBondContact O-CD1 3.21Å; S298-I302 VanDerWaalsContact O-CG1 3.24Å; S298-I302 WeakPolarHBondContact O-CG1 3.38Å; S298-I302 PolarHBondContact O-N 3.31Å; L299-I302 CarbonylContact O-C 3.56Å; L299-I302 WeakPolarHBondContact O-CB 3.43Å; L299-I302 PolarHBondContact O-N 3.44Å; C300-I302 VanDerWaalsContact C-N 3.27Å; C300-I302 PolarHBondContact O-N 2.97Å; I302-M315 HydrophobicContact CB-CE 3.52Å; I302-M315 HydrophobicContact CD1-CE 3.97Å; I302-M315 HydrophobicContact CG1-CE 4.33Å; I302-M315 HydrophobicContact CG2-CE 3.32Å; I302-M315 HydrophobicContact CG2-SD 3.94Å
303	Y	37	Very low	38.8	Very low	90 Å²	90	85.6 Å²	85.6	35%	0.353	46%	0.463	S	S	.	.	H	α-helix	trans	-66.3	-36	177.6	-101.6	-84.4	0	0	0	113.2	L299 C300 V312 M315	L299-Y303 WeakPolarHBondContact O-CB 3.37Å; L299-Y303 VanDerWaalsContact O-CD2 3.27Å; L299-Y303 WeakPolarHBondContact O-CD2 3.27Å; L299-Y303 PolarHBondContact O-N 3.44Å; C300-Y303 WeakPolarHBondContact O-CB 2.99Å; C300-Y303 PolarHBondContact O-N 3.08Å; C300-Y303 VanDerWaalsContact O-N 3.16Å; Y303-V312 HydrophobicContact CE1-CB 4.37Å; Y303-V312 HydrophobicContact CE1-CG1 4.04Å; Y303-V312 HydrophobicContact CE1-CG2 4.16Å; Y303-V312 PolarHBondContact OH-O 2.82Å; Y303-M315 HydrophobicContact CD2-CB 4.49Å; Y303-M315 HydrophobicContact CD2-CE 4.27Å; Y303-M315 HydrophobicContact CE2-CB 3.74Å; Y303-M315 HydrophobicContact CE2-CE 4.44Å
304	S	37.1	Very low	38.6	Very low	89 Å²	89	84.8 Å²	84.8	62%	0.622	46%	0.455	S	S	*	.	H	α-helix	trans	-78.9	-17.5	-168.3	68.4	0	0	0	0	115.6	C300 H301	C300-S304 WeakPolarHBondContact O-CB 3.39Å; C300-S304 PolarHBondContact O-N 3.44Å; H301-S304 PolarHBondContact O-N 3.38Å; H301-S304 PolarHBondContact O-OG 3.19Å; H301-S304 VanDerWaalsContact O-OG 3.06Å
305	T	33.7	Very low	38.7	Very low	114 Å²	114	80.2 Å²	80.2	70%	0.699	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	3.2	-169.4	48.8	0	0	0	0	115.6
306	S	37.7	Very low	38.8	Very low	49 Å²	49	83.9 Å²	83.9	34%	0.343	45%	0.451	S	S	.	.			trans	-158.6	150	-179.5	56.4	0	0	0	0	116.6	K311	S306-K311 WeakPolarHBondContact OG-CD 3.38Å; S306-K311 PolarHBondContact OG-NZ 3.33Å
307	S	38.2	Very low	38.9	Very low	123 Å²	123	81.6 Å²	81.6	86%	0.86	44%	0.441	S	S	*	.			trans	-99.7	23	-165.5	62.6	0	0	0	0	116.4
308	D	38	Very low	38.9	Very low	93 Å²	93	76.7 Å²	76.7	50%	0.497	42%	0.415	S	S	.	.			trans	-107.6	128.6	-176.2	-87.3	-34	0	0	0	114.5	L310 K311	D308-L310 PolarHBondContact O-N 2.96Å; D308-K311 PolarHBondContact O-N 3.35Å
309	F	36.8	Very low	39	Very low	174 Å²	174	80 Å²	80	76%	0.763	42%	0.42	S	S	*	.	H	α-helix	trans	-59.5	-34.9	-176.1	-178	-96.9	0	0	0	114.4	K311 V312 H313	F309-K311 VanDerWaalsContact C-N 3.33Å; F309-K311 PolarHBondContact O-N 2.85Å; F309-V312 PolarHBondContact O-N 3.19Å; F309-H313 PolarHBondContact O-N 3.02Å
310	L	35.1	Very low	39.3	Very low	97 Å²	97	83.7 Å²	83.7	51%	0.508	44%	0.437	S	S	.	.	H	α-helix	trans	-66.3	-34.6	-179.7	-154.2	81.8	0	0	0	112	D308 H313 V314	D308-L310 PolarHBondContact O-N 2.96Å; L310-H313 PolarHBondContact O-N 3.41Å; L310-V314 PolarHBondContact O-N 2.73Å; L310-V314 VanDerWaalsContact O-N 3.08Å
311	K	40.2	Very low	39.5	Very low	59 Å²	59	82.8 Å²	82.8	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-66.3	-43.7	175.2	-65.9	-171.5	-172.5	-174.7	0	111.5	S306 D308 F309 H313 V314 M315	S306-K311 WeakPolarHBondContact OG-CD 3.38Å; S306-K311 PolarHBondContact OG-NZ 3.33Å; D308-K311 PolarHBondContact O-N 3.35Å; F309-K311 VanDerWaalsContact C-N 3.33Å; F309-K311 PolarHBondContact O-N 2.85Å; K311-H313 PolarHBondContact O-N 3.38Å; K311-V314 PolarHBondContact O-N 2.85Å; K311-M315 VanDerWaalsContact O-CB 3.3Å; K311-M315 WeakPolarHBondContact O-CB 3.23Å; K311-M315 WeakPolarHBondContact O-CG 3.47Å; K311-M315 PolarHBondContact O-N 3.05Å
312	V	40	Very low	39.8	Very low	67 Å²	67	77.1 Å²	77.1	41%	0.406	40%	0.4	S	S	.	.	H	α-helix	trans	-58.1	-39	176.7	171	0	0	0	0	111	Y303 F309 K316	Y303-V312 HydrophobicContact CE1-CB 4.37Å; Y303-V312 HydrophobicContact CE1-CG1 4.04Å; Y303-V312 HydrophobicContact CE1-CG2 4.16Å; Y303-V312 PolarHBondContact OH-O 2.82Å; F309-V312 PolarHBondContact O-N 3.19Å; V312-K316 VanDerWaalsContact O-CB 3.25Å; V312-K316 WeakPolarHBondContact O-CB 3.4Å; V312-K316 PolarHBondContact O-N 3.43Å
313	H	38.2	Very low	40.3	Very low	101 Å²	101	77.7 Å²	77.7	47%	0.468	40%	0.403	S	S	.	.	H	α-helix	trans	-73.2	-46.9	-179.3	-165.5	68.8	0	0	0	113	F309 L310 K311 M315 K316 I317	F309-H313 PolarHBondContact O-N 3.02Å; L310-H313 PolarHBondContact O-N 3.41Å; K311-H313 PolarHBondContact O-N 3.38Å; H313-M315 VanDerWaalsContact C-N 3.3Å; H313-M315 PolarHBondContact O-N 3.29Å; H313-K316 WeakPolarHBondContact O-CB 3.46Å; H313-K316 PolarHBondContact O-N 3.48Å; H313-I317 WeakPolarHBondContact O-CG1 3.29Å; H313-I317 PolarHBondContact O-N 3.01Å
314	V	38.5	Very low	41	Very low	53 Å²	53	78.5 Å²	78.5	32%	0.321	41%	0.406	S	S	.	.	H	α-helix	trans	-58.9	-43.5	175.3	166.6	0	0	0	0	111.1	L310 K311 I317 V318 V379	L310-V314 PolarHBondContact O-N 2.73Å; L310-V314 VanDerWaalsContact O-N 3.08Å; K311-V314 PolarHBondContact O-N 2.85Å; V314-I317 PolarHBondContact O-N 3.03Å; V314-V318 WeakPolarHBondContact O-CG2 3.01Å; V314-V318 PolarHBondContact O-N 2.91Å; V314-V379 HydrophobicContact CB-CG2 4.42Å; V314-V379 HydrophobicContact CG1-CG2 3.35Å; V314-V379 HydrophobicContact CG2-CG2 4.38Å
315	M	39.9	Very low	41.3	Very low	28 Å²	28	74.8 Å²	74.8	14%	0.138	38%	0.38	C	S	.	.	H	α-helix	trans	-67.5	-35.9	178.2	-69.2	-71.4	-76.9	0	0	112.4	L299 I302 Y303 K311 H313 V318 R319	L299-M315 HydrophobicContact CB-CE 3.99Å; L299-M315 HydrophobicContact CD2-CE 3.33Å; L299-M315 HydrophobicContact CD2-SD 4.1Å; L299-M315 HydrophobicContact CG-CE 4.25Å; I302-M315 HydrophobicContact CB-CE 3.52Å; I302-M315 HydrophobicContact CD1-CE 3.97Å; I302-M315 HydrophobicContact CG1-CE 4.33Å; I302-M315 HydrophobicContact CG2-CE 3.32Å; I302-M315 HydrophobicContact CG2-SD 3.94Å; Y303-M315 HydrophobicContact CD2-CB 4.49Å; Y303-M315 HydrophobicContact CD2-CE 4.27Å; Y303-M315 HydrophobicContact CE2-CB 3.74Å; Y303-M315 HydrophobicContact CE2-CE 4.44Å; K311-M315 VanDerWaalsContact O-CB 3.3Å; K311-M315 WeakPolarHBondContact O-CB 3.23Å; K311-M315 WeakPolarHBondContact O-CG 3.47Å; K311-M315 PolarHBondContact O-N 3.05Å; H313-M315 VanDerWaalsContact C-N 3.3Å; H313-M315 PolarHBondContact O-N 3.29Å; M315-V318 PolarHBondContact O-N 3.46Å; M315-R319 WeakPolarHBondContact O-CB 3.35Å; M315-R319 PolarHBondContact O-N 3.03Å
316	K	43.2	Very low	41.9	Very low	101 Å²	101	71 Å²	71	44%	0.439	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-45	172.3	-177.2	177.6	171.7	-179.1	0	111.4	V312 H313 R319 E320	V312-K316 VanDerWaalsContact O-CB 3.25Å; V312-K316 WeakPolarHBondContact O-CB 3.4Å; V312-K316 PolarHBondContact O-N 3.43Å; H313-K316 WeakPolarHBondContact O-CB 3.46Å; H313-K316 PolarHBondContact O-N 3.48Å; K316-R319 PolarHBondContact O-N 3.28Å; K316-E320 WeakPolarHBondContact CE-OE1 3.46Å; K316-E320 IonicContact NZ-OE1 3.77Å; K316-E320 WeakPolarHBondContact O-CB 3.23Å; K316-E320 WeakPolarHBondContact O-CG 3.41Å; K316-E320 PolarHBondContact O-N 3.12Å
317	I	43.9	Very low	42.5	Very low	46 Å²	46	73.9 Å²	73.9	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-45.4	176.8	-69.1	168.3	0	0	0	111.1	H313 V314 R319 E320 K321	H313-I317 WeakPolarHBondContact O-CG1 3.29Å; H313-I317 PolarHBondContact O-N 3.01Å; V314-I317 PolarHBondContact O-N 3.03Å; I317-R319 VanDerWaalsContact C-N 3.33Å; I317-R319 PolarHBondContact O-N 3.28Å; I317-E320 PolarHBondContact O-N 2.88Å; I317-K321 HydrophobicContact CG2-CD 3.79Å; I317-K321 HydrophobicContact CG2-CG 4.39Å; I317-K321 WeakPolarHBondContact O-CB 3.44Å; I317-K321 VanDerWaalsContact O-CG 3.31Å; I317-K321 WeakPolarHBondContact O-CG 3.01Å; I317-K321 PolarHBondContact O-N 3.26Å
318	V	42.1	Very low	43	Very low	6 Å²	6	71.4 Å²	71.4	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-43.1	177.9	169.8	0	0	0	0	110.8	V314 M315 L322 V382	V314-V318 WeakPolarHBondContact O-CG2 3.01Å; V314-V318 PolarHBondContact O-N 2.91Å; M315-V318 PolarHBondContact O-N 3.46Å; V318-L322 HydrophobicContact CG1-CD1 3.9Å; V318-L322 WeakPolarHBondContact O-CB 3.37Å; V318-L322 WeakPolarHBondContact O-CG 3.4Å; V318-L322 PolarHBondContact O-N 3.3Å; V318-V382 HydrophobicContact CG1-CG1 4.4Å; V318-V382 HydrophobicContact CG1-CG2 4.22Å; V318-V382 HydrophobicContact CG2-CG2 4.42Å
319	R	43.7	Very low	43.4	Very low	116 Å²	116	67.4 Å²	67.4	44%	0.438	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-49.2	175.2	-179.3	179.2	177.9	-116.4	6.4	112.2	E296 L299 M315 K316 I317 K321 L322 L323	E296-R319 IonicContact OE1-NH2 3.07Å; L299-R319 HydrophobicContact CD1-CB 4.33Å; M315-R319 WeakPolarHBondContact O-CB 3.35Å; M315-R319 PolarHBondContact O-N 3.03Å; K316-R319 PolarHBondContact O-N 3.28Å; I317-R319 VanDerWaalsContact C-N 3.33Å; I317-R319 PolarHBondContact O-N 3.28Å; R319-K321 VanDerWaalsContact C-N 3.33Å; R319-K321 PolarHBondContact O-N 2.92Å; R319-L322 PolarHBondContact O-N 2.96Å; R319-L323 HydrophobicContact CG-CD1 3.87Å; R319-L323 PolarHBondContact O-N 2.94Å
320	E	46.4	Very low	43.8	Very low	102 Å²	102	63.9 Å²	63.9	48%	0.477	30%	0.303	S	S	.	.	H	α-helix	trans	-61	-41.5	180	-75.9	172.8	176.6	0	0	111.5	K316 I317 L323 Y324	K316-E320 WeakPolarHBondContact CE-OE1 3.46Å; K316-E320 IonicContact NZ-OE1 3.77Å; K316-E320 WeakPolarHBondContact O-CB 3.23Å; K316-E320 WeakPolarHBondContact O-CG 3.41Å; K316-E320 PolarHBondContact O-N 3.12Å; I317-E320 PolarHBondContact O-N 2.88Å; E320-L323 PolarHBondContact O-N 3.32Å; E320-Y324 WeakPolarHBondContact O-CB 3.17Å; E320-Y324 PolarHBondContact O-N 3.3Å
321	K	45.7	Very low	44.3	Very low	49 Å²	49	61.8 Å²	61.8	21%	0.213	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-42.8	177.3	-74.9	175.6	166.6	-79.2	0	113.2	I317 R319 Y324 V325 V382 Q383 E386	I317-K321 HydrophobicContact CG2-CD 3.79Å; I317-K321 HydrophobicContact CG2-CG 4.39Å; I317-K321 WeakPolarHBondContact O-CB 3.44Å; I317-K321 VanDerWaalsContact O-CG 3.31Å; I317-K321 WeakPolarHBondContact O-CG 3.01Å; I317-K321 PolarHBondContact O-N 3.26Å; R319-K321 VanDerWaalsContact C-N 3.33Å; R319-K321 PolarHBondContact O-N 2.92Å; K321-Y324 PolarHBondContact O-N 3.38Å; K321-V325 WeakPolarHBondContact O-CG2 3.22Å; K321-V325 PolarHBondContact O-N 3.31Å; K321-V325 VanDerWaalsContact O-N 3.08Å; K321-V382 HydrophobicContact CB-CG1 4.45Å; K321-Q383 HydrophobicContact CD-CG 4.1Å; K321-E386 VanDerWaalsContact CD-OE2 3.3Å; K321-E386 WeakPolarHBondContact CD-OE2 3.22Å; K321-E386 WeakPolarHBondContact CG-OE2 3.34Å; K321-E386 IonicContact NZ-OE1 3.86Å; K321-E386 IonicContact NZ-OE2 3.18Å; K321-E386 PolarHBondContact NZ-OE2 3.33Å
322	L	44.1	Very low	44.3	Very low	12 Å²	12	59.8 Å²	59.8	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-37.8	177	-74.2	169.7	0	0	0	111.9	L180 L295 V318 R319 V325 L326	L180-L322 HydrophobicContact CD2-CD2 4.48Å; L295-L322 HydrophobicContact CD2-CD1 3.92Å; V318-L322 HydrophobicContact CG1-CD1 3.9Å; V318-L322 WeakPolarHBondContact O-CB 3.37Å; V318-L322 WeakPolarHBondContact O-CG 3.4Å; V318-L322 PolarHBondContact O-N 3.3Å; R319-L322 PolarHBondContact O-N 2.96Å; L322-V325 PolarHBondContact O-N 3.01Å; L322-L326 WeakPolarHBondContact O-CG 3.48Å; L322-L326 PolarHBondContact O-N 3.26Å
323	L	47.3	Very low	44.5	Very low	63 Å²	63	59.4 Å²	59.4	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-45	172.8	-106.7	111.7	0	0	0	111.8	R319 E320 V325 L326 E327	R319-L323 HydrophobicContact CG-CD1 3.87Å; R319-L323 PolarHBondContact O-N 2.94Å; E320-L323 PolarHBondContact O-N 3.32Å; L323-V325 VanDerWaalsContact C-N 3.33Å; L323-V325 PolarHBondContact O-N 3.43Å; L323-L326 WeakPolarHBondContact O-CB 3.15Å; L323-L326 PolarHBondContact O-N 3.29Å; L323-L326 VanDerWaalsContact O-N 3.16Å; L323-E327 PolarHBondContact O-N 3.32Å
324	Y	50.4	Low	44.6	Very low	106 Å²	106	60.3 Å²	60.3	42%	0.416	28%	0.284	S	S	.	.	H	α-helix	trans	-58.7	-43.3	176.9	176.9	-99.7	0	0	0	112.4	E320 K321 E327 K328	E320-Y324 WeakPolarHBondContact O-CB 3.17Å; E320-Y324 PolarHBondContact O-N 3.3Å; K321-Y324 PolarHBondContact O-N 3.38Å; Y324-E327 PolarHBondContact O-N 2.89Å; Y324-K328 HydrophobicContact CE1-CG 4.2Å; Y324-K328 PolarHBondContact O-N 3.47Å; Y324-K328 VanDerWaalsContact O-N 3.08Å
325	V	44.1	Very low	44.7	Very low	11 Å²	11	61.6 Å²	61.6	7%	0.067	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-42.9	175.6	171.4	0	0	0	0	111.2	K321 L322 L323 K328 V329 E386 F389	K321-V325 WeakPolarHBondContact O-CG2 3.22Å; K321-V325 PolarHBondContact O-N 3.31Å; K321-V325 VanDerWaalsContact O-N 3.08Å; L322-V325 PolarHBondContact O-N 3.01Å; L323-V325 VanDerWaalsContact C-N 3.33Å; L323-V325 PolarHBondContact O-N 3.43Å; V325-K328 PolarHBondContact O-N 3.34Å; V325-V329 WeakPolarHBondContact O-CG2 3.32Å; V325-V329 PolarHBondContact O-N 2.83Å; V325-V329 VanDerWaalsContact O-N 3.15Å; V325-E386 HydrophobicContact CG2-CB 4.08Å; V325-E386 HydrophobicContact CG2-CG 3.74Å; V325-F389 HydrophobicContact CG1-CD1 3.46Å; V325-F389 VanDerWaalsContact CG1-CD1 3.46Å; V325-F389 HydrophobicContact CG1-CE1 3.51Å; V325-F389 HydrophobicContact CG1-CG 4.03Å; V325-F389 HydrophobicContact CG1-CZ 4.14Å
326	L	46.3	Very low	44.6	Very low	34 Å²	34	64.9 Å²	64.9	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-42.1	177.2	-74.5	164.6	0	0	0	112.4	F290 L295 L322 L323 K328 V329 M330	F290-L326 HydrophobicContact CB-CD1 4.13Å; F290-L326 HydrophobicContact CB-CD2 3.76Å; F290-L326 HydrophobicContact CG-CD2 4.38Å; L295-L326 HydrophobicContact CD1-CD1 4.34Å; L322-L326 WeakPolarHBondContact O-CG 3.48Å; L322-L326 PolarHBondContact O-N 3.26Å; L323-L326 WeakPolarHBondContact O-CB 3.15Å; L323-L326 PolarHBondContact O-N 3.29Å; L323-L326 VanDerWaalsContact O-N 3.16Å; L326-K328 VanDerWaalsContact C-N 3.31Å; L326-K328 PolarHBondContact O-N 3.05Å; L326-V329 PolarHBondContact O-N 3.26Å; L326-M330 PolarHBondContact O-N 3.41Å; L326-M330 VanDerWaalsContact O-N 3.07Å
327	E	50.4	Low	44.2	Very low	111 Å²	111	66 Å²	66	52%	0.519	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-42.4	174	-76.2	178.3	173.6	0	0	111.2	L323 Y324 V329 M330 D331	L323-E327 PolarHBondContact O-N 3.32Å; Y324-E327 PolarHBondContact O-N 2.89Å; E327-V329 VanDerWaalsContact C-N 3.34Å; E327-V329 PolarHBondContact O-N 3.47Å; E327-M330 WeakPolarHBondContact O-CB 3.37Å; E327-M330 PolarHBondContact O-N 3.03Å; E327-M330 VanDerWaalsContact O-N 3.15Å; E327-D331 PolarHBondContact O-N 2.69Å
328	K	49.6	Very low	43.7	Very low	70 Å²	70	66.9 Å²	66.9	30%	0.304	33%	0.327	S	S	.	.	H	α-helix	trans	-65.8	-33.1	177.8	-72.7	-71.5	159.9	-140.4	0	114	Y324 V325 L326 M330 D331 F332 L393	Y324-K328 HydrophobicContact CE1-CG 4.2Å; Y324-K328 PolarHBondContact O-N 3.47Å; Y324-K328 VanDerWaalsContact O-N 3.08Å; V325-K328 PolarHBondContact O-N 3.34Å; L326-K328 VanDerWaalsContact C-N 3.31Å; L326-K328 PolarHBondContact O-N 3.05Å; K328-M330 VanDerWaalsContact C-N 3.35Å; K328-D331 IonicContact NZ-OD2 3.29Å; K328-D331 PolarHBondContact NZ-OD2 3.17Å; K328-F332 WeakPolarHBondContact O-CB 3.35Å; K328-F332 PolarHBondContact O-N 2.95Å; K328-L393 HydrophobicContact CB-CD2 4.06Å
329	V	44.7	Very low	43.4	Very low	9 Å²	9	69.4 Å²	69.4	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-67.8	-38.8	173	178	0	0	0	0	111.1	V287 V325 L326 E327 F332 N333 F389	V287-V329 HydrophobicContact CG2-CG1 3.89Å; V325-V329 WeakPolarHBondContact O-CG2 3.32Å; V325-V329 PolarHBondContact O-N 2.83Å; V325-V329 VanDerWaalsContact O-N 3.15Å; L326-V329 PolarHBondContact O-N 3.26Å; E327-V329 VanDerWaalsContact C-N 3.34Å; E327-V329 PolarHBondContact O-N 3.47Å; V329-F332 PolarHBondContact O-N 2.87Å; V329-N333 PolarHBondContact O-N 3.32Å; V329-F389 HydrophobicContact CG2-CE1 3.42Å; V329-F389 VanDerWaalsContact CG2-CE1 3.42Å; V329-F389 HydrophobicContact CG2-CZ 3.27Å
330	M	45.9	Very low	42.8	Very low	100 Å²	100	69.3 Å²	69.3	49%	0.493	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-47.9	173.9	-72.2	-171	50.3	0	0	111.5	L326 E327 K328 F332 N333 E334	L326-M330 PolarHBondContact O-N 3.41Å; L326-M330 VanDerWaalsContact O-N 3.07Å; E327-M330 WeakPolarHBondContact O-CB 3.37Å; E327-M330 PolarHBondContact O-N 3.03Å; E327-M330 VanDerWaalsContact O-N 3.15Å; K328-M330 VanDerWaalsContact C-N 3.35Å; M330-F332 VanDerWaalsContact C-N 3.27Å; M330-F332 PolarHBondContact O-N 3.3Å; M330-N333 PolarHBondContact O-N 2.77Å; M330-E334 PolarHBondContact O-N 3.19Å
331	D	46.3	Very low	42.1	Very low	53 Å²	53	69.8 Å²	69.8	28%	0.283	36%	0.362	S	S	.	.	H	α-helix	trans	-53	-44.1	174	-77	-10.2	0	0	0	111.3	E327 K328 N333 E334 H335	E327-D331 PolarHBondContact O-N 2.69Å; K328-D331 IonicContact NZ-OD2 3.29Å; K328-D331 PolarHBondContact NZ-OD2 3.17Å; D331-N333 VanDerWaalsContact C-N 3.34Å; D331-N333 PolarHBondContact O-N 3.04Å; D331-E334 PolarHBondContact O-N 2.74Å; D331-H335 WeakPolarHBondContact O-CB 3.29Å; D331-H335 PolarHBondContact O-CD2 3.34Å; D331-H335 PolarHBondContact O-N 3.45Å
332	F	40.7	Very low	41.4	Very low	18 Å²	18	79.2 Å²	79.2	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-62.7	-38.6	177.8	175.3	-100.4	0	0	0	112.6	L190 K328 V329 M330 L393 I396 R397	L190-F332 HydrophobicContact CD2-CE1 4.25Å; K328-F332 WeakPolarHBondContact O-CB 3.35Å; K328-F332 PolarHBondContact O-N 2.95Å; V329-F332 PolarHBondContact O-N 2.87Å; M330-F332 VanDerWaalsContact C-N 3.27Å; M330-F332 PolarHBondContact O-N 3.3Å; F332-L393 HydrophobicContact CB-CD1 4.12Å; F332-L393 HydrophobicContact CB-CD2 4.43Å; F332-L393 HydrophobicContact CB-CG 4.5Å; F332-L393 HydrophobicContact CD1-CD1 4.08Å; F332-L393 HydrophobicContact CD2-CD1 4.2Å; F332-L393 HydrophobicContact CG-CD1 3.86Å; F332-I396 HydrophobicContact CE2-CG2 4.01Å; F332-I396 HydrophobicContact CZ-CG2 3.63Å; F332-R397 HydrophobicContact CD2-CB 4Å; F332-R397 HydrophobicContact CD2-CG 4.37Å; F332-R397 HydrophobicContact CE2-CB 3.94Å
333	N	43.3	Very low	40.6	Very low	59 Å²	59	86.9 Å²	86.9	32%	0.316	43%	0.432	S	S	.	.	H	α-helix	trans	-74.1	-32	176.6	-77.4	-30	0	0	0	112.9	V329 M330 D331 R336	V329-N333 PolarHBondContact O-N 3.32Å; M330-N333 PolarHBondContact O-N 2.77Å; D331-N333 VanDerWaalsContact C-N 3.34Å; D331-N333 PolarHBondContact O-N 3.04Å; N333-R336 PolarHBondContact OD1-NH2 2.73Å
334	E	40.8	Very low	39.7	Very low	119 Å²	119	90.7 Å²	90.7	56%	0.556	45%	0.446	S	S	*	.	H	α-helix	trans	-76.2	-38.3	175.6	-71.5	-174.3	-179.5	0	0	112.7	M330 D331 R336 T337	M330-E334 PolarHBondContact O-N 3.19Å; D331-E334 PolarHBondContact O-N 2.74Å; E334-R336 PolarHBondContact O-N 3.24Å; E334-R336 VanDerWaalsContact O-N 3.08Å; E334-T337 PolarHBondContact O-N 2.94Å; E334-T337 PolarHBondContact O-OG1 2.96Å
335	H	39.2	Very low	38.8	Very low	81 Å²	81	89.4 Å²	89.4	38%	0.375	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-65.8	-12.1	178.8	-77.1	-42.2	0	0	0	114.4	D331 T337 A338	D331-H335 WeakPolarHBondContact O-CB 3.29Å; D331-H335 PolarHBondContact O-CD2 3.34Å; D331-H335 PolarHBondContact O-N 3.45Å; H335-T337 PolarHBondContact O-N 2.89Å; H335-A338 PolarHBondContact O-N 3.35Å
336	R	38.3	Very low	38.2	Very low	96 Å²	96	93.4 Å²	93.4	36%	0.362	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-60.1	-20.7	168.9	-115.7	-172.9	-80.7	-163.7	-2.2	113.4	S282 N333 E334	S282-R336 PolarHBondContact OG-NH1 3.15Å; S282-R336 PolarHBondContact OG-NH2 2.77Å; N333-R336 PolarHBondContact OD1-NH2 2.73Å; E334-R336 PolarHBondContact O-N 3.24Å; E334-R336 VanDerWaalsContact O-N 3.08Å
337	T	35.5	Very low	37.7	Very low	125 Å²	125	96.6 Å²	96.6	77%	0.767	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-97.5	-4.6	-176.6	59.7	0	0	0	0	115	E334 H335	E334-T337 PolarHBondContact O-N 2.94Å; E334-T337 PolarHBondContact O-OG1 2.96Å; H335-T337 PolarHBondContact O-N 2.89Å
338	A	33.4	Very low	37	Very low	65 Å²	65	92 Å²	92	54%	0.537	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	2	-160.4	0	0	0	0	0	117.7	H335 S340	H335-A338 PolarHBondContact O-N 3.35Å; A338-S340 PolarHBondContact O-N 3.31Å
339	S	36	Very low	36.4	Very low	59 Å²	59	93.1 Å²	93.1	41%	0.413	47%	0.474	S	S	.	.			trans	-75.1	99.9	-175.5	57	0	0	0	0	112.8
340	S	29.7	Very low	35.8	Very low	114 Å²	114	98.5 Å²	98.5	80%	0.797	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-79	119.4	163.1	47.5	0	0	0	0	110	A338	A338-S340 PolarHBondContact O-N 3.31Å
341	F	32.5	Very low	35.4	Very low	111 Å²	111	99 Å²	99	49%	0.487	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-72.3	133.2	-168.7	-72.5	-90.8	0	0	0	113.5	P405	F341-P405 HydrophobicContact CE1-CB 3.95Å; F341-P405 HydrophobicContact CE1-CG 4.27Å
342	R	30.1	Very low	35.1	Very low	247 Å²	247	98.7 Å²	98.7	93%	0.932	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-75	158.2	170.7	-76.4	-173	180	-170.5	2.3	111.9
343	E	28.8	Very low	34.7	Very low	173 Å²	173	100.3 Å²	100.3	81%	0.808	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-67.1	145.3	175.8	-69.7	-179.4	148.9	0	0	112.1	D345	E343-D345 PolarHBondContact O-N 3.2Å
344	F	27.6	Very low	34.6	Very low	144 Å²	144	101.2 Å²	101.2	63%	0.632	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-53	122.4	-178.3	172.5	-99	0	0	0	113.1	P346	F344-P346 HydrophobicContact CE1-CB 4.07Å; F344-P346 HydrophobicContact CE1-CG 4.45Å; F344-P346 HydrophobicContact CZ-CB 4.43Å
345	D	32.5	Very low	34.7	Very low	79 Å²	79	98.1 Å²	98.1	42%	0.422	51%	0.505	S	S	.	.			trans	-106.4	113.4	169.9	-167.4	-9.3	0	0	0	110.3	E343 D347 F348	E343-D345 PolarHBondContact O-N 3.2Å; D345-D347 PolarHBondContact O-N 2.94Å; D345-D347 VanDerWaalsContact O-N 3.08Å; D345-D347 WeakPolarHBondContact OD1-CB 3.04Å; D345-D347 PolarHBondContact OD1-N 2.95Å; D345-D347 VanDerWaalsContact OD1-N 3.07Å; D345-F348 PolarHBondContact O-N 3.19Å
346	P	31.5	Very low	34.6	Very low	94 Å²	94	94.6 Å²	94.6	61%	0.61	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.3	176	24.5	-31.7	0	0	0	114.7	F344	F344-P346 HydrophobicContact CE1-CB 4.07Å; F344-P346 HydrophobicContact CE1-CG 4.45Å; F344-P346 HydrophobicContact CZ-CB 4.43Å
347	D	34.5	Very low	34.7	Very low	101 Å²	101	93.5 Å²	93.5	54%	0.54	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	4.6	176.5	-79.2	-12.9	0	0	0	115.2	D345 E349	D345-D347 PolarHBondContact O-N 2.94Å; D345-D347 VanDerWaalsContact O-N 3.08Å; D345-D347 WeakPolarHBondContact OD1-CB 3.04Å; D345-D347 PolarHBondContact OD1-N 2.95Å; D345-D347 VanDerWaalsContact OD1-N 3.07Å; D347-E349 PolarHBondContact O-N 3.05Å
348	F	36.5	Very low	35.1	Very low	15 Å²	15	91.7 Å²	91.7	7%	0.066	47%	0.47	C	S	.	.	H	α-helix	trans	-52.2	-27.5	179.7	-177.5	-100.9	0	0	0	114.4	D345 L350 D352 V403 E406 V410	D345-F348 PolarHBondContact O-N 3.19Å; F348-L350 VanDerWaalsContact C-N 3.27Å; F348-L350 PolarHBondContact O-N 2.99Å; F348-L350 VanDerWaalsContact O-N 3.13Å; F348-D352 HydrophobicContact CD2-CB 4.2Å; F348-D352 WeakPolarHBondContact CD2-OD2 3.38Å; F348-D352 HydrophobicContact CE2-CB 4.05Å; F348-V403 HydrophobicContact CZ-CG1 4.21Å; F348-E406 WeakPolarHBondContact CB-OE2 3.42Å; F348-E406 HydrophobicContact CD1-CB 4.41Å; F348-E406 HydrophobicContact CD2-CB 3.86Å; F348-E406 HydrophobicContact CD2-CG 4.13Å; F348-E406 WeakPolarHBondContact CD2-OE2 3.5Å; F348-E406 HydrophobicContact CE1-CB 4.01Å; F348-E406 HydrophobicContact CE2-CB 3.41Å; F348-E406 VanDerWaalsContact CE2-CB 3.41Å; F348-E406 HydrophobicContact CE2-CG 3.91Å; F348-E406 WeakPolarHBondContact CE2-OE2 3.35Å; F348-E406 HydrophobicContact CG-CB 4.32Å; F348-E406 WeakPolarHBondContact CG-OE2 3.39Å; F348-E406 HydrophobicContact CZ-CB 3.48Å; F348-E406 VanDerWaalsContact CZ-CB 3.48Å; F348-E406 HydrophobicContact CZ-CG 4.47Å; F348-V410 HydrophobicContact CD1-CG2 3.75Å; F348-V410 HydrophobicContact CE1-CG2 4.35Å; F348-V410 HydrophobicContact CG-CG2 4.46Å
349	E	37.5	Very low	35.6	Very low	93 Å²	93	90.5 Å²	90.5	44%	0.435	45%	0.454	S	S	.	.	H	α-helix	trans	-59.1	-30.9	-172.5	-71.5	-161.3	148.4	0	0	114.6	D347 N414	D347-E349 PolarHBondContact O-N 3.05Å; E349-N414 PolarHBondContact OE1-ND2 3.34Å
350	L	31.7	Very low	35.8	Very low	122 Å²	122	88.3 Å²	88.3	64%	0.639	44%	0.437	S	S	*	.	H	α-helix	trans	-116.3	-38.5	-168.3	-129.4	95.9	0	0	0	115	F348 V354	F348-L350 VanDerWaalsContact C-N 3.27Å; F348-L350 PolarHBondContact O-N 2.99Å; F348-L350 VanDerWaalsContact O-N 3.13Å; L350-V354 WeakPolarHBondContact O-CB 3.33Å; L350-V354 WeakPolarHBondContact O-CG2 3.48Å; L350-V354 PolarHBondContact O-N 3.44Å
351	K	37	Very low	36.4	Very low	112 Å²	112	85.5 Å²	85.5	49%	0.487	41%	0.41	S	S	.	.	H	α-helix	trans	-70	-47.5	-175.5	-82	176.4	-178.4	161.3	0	111	V354 V355	K351-V354 PolarHBondContact O-N 2.89Å; K351-V355 VanDerWaalsContact O-CG2 3.25Å; K351-V355 WeakPolarHBondContact O-CG2 3.22Å; K351-V355 PolarHBondContact O-N 2.9Å; K351-V355 VanDerWaalsContact O-N 3.08Å
352	D	39.7	Very low	36.8	Very low	45 Å²	45	82.1 Å²	82.1	24%	0.241	40%	0.403	C	S	.	.	H	α-helix	trans	-82.8	-32.2	-168.9	-53.2	-44.8	0	0	0	112.1	F348 V354 V355 I356	F348-D352 HydrophobicContact CD2-CB 4.2Å; F348-D352 WeakPolarHBondContact CD2-OD2 3.38Å; F348-D352 HydrophobicContact CE2-CB 4.05Å; D352-V354 VanDerWaalsContact C-N 3.32Å; D352-V354 PolarHBondContact O-N 3.26Å; D352-V355 PolarHBondContact O-N 3.08Å; D352-I356 WeakPolarHBondContact O-CD1 3.42Å; D352-I356 WeakPolarHBondContact O-CG1 3.36Å; D352-I356 PolarHBondContact O-N 2.97Å
353	M	33.4	Very low	37.3	Very low	52 Å²	52	70.6 Å²	70.6	26%	0.256	36%	0.361	S	S	.	.	H	α-helix	trans	-60	-40.5	168.6	-74.2	-143.7	-172.2	0	0	112.4	M357 A417 L421	M353-M357 VanDerWaalsContact O-CB 3.31Å; M353-M357 WeakPolarHBondContact O-CB 3.48Å; M353-M357 VanDerWaalsContact O-CG 3.24Å; M353-M357 WeakPolarHBondContact O-CG 3.46Å; M353-M357 PolarHBondContact O-N 3.28Å; M353-A417 HydrophobicContact CE-CB 4Å; M353-L421 HydrophobicContact CG-CD1 4.4Å; M353-L421 HydrophobicContact SD-CD1 4.16Å
354	V	41.1	Very low	37.7	Very low	78 Å²	78	64.5 Å²	64.5	47%	0.473	33%	0.332	S	S	.	.	H	α-helix	trans	-68.1	-38.2	176.8	171.6	0	0	0	0	110.8	L350 K351 D352 M357 K358	L350-V354 WeakPolarHBondContact O-CB 3.33Å; L350-V354 WeakPolarHBondContact O-CG2 3.48Å; L350-V354 PolarHBondContact O-N 3.44Å; K351-V354 PolarHBondContact O-N 2.89Å; D352-V354 VanDerWaalsContact C-N 3.32Å; D352-V354 PolarHBondContact O-N 3.26Å; V354-M357 HydrophobicContact CG2-CE 4.13Å; V354-K358 WeakPolarHBondContact O-CB 3.36Å; V354-K358 PolarHBondContact O-N 3.34Å
355	V	41.4	Very low	38.4	Very low	54 Å²	54	62.8 Å²	62.8	33%	0.327	33%	0.326	S	S	.	.	H	α-helix	trans	-64.7	-49.5	176.5	170.5	0	0	0	0	111.2	K351 D352 M357 K358 H359	K351-V355 VanDerWaalsContact O-CG2 3.25Å; K351-V355 WeakPolarHBondContact O-CG2 3.22Å; K351-V355 PolarHBondContact O-N 2.9Å; K351-V355 VanDerWaalsContact O-N 3.08Å; D352-V355 PolarHBondContact O-N 3.08Å; V355-M357 PolarHBondContact O-N 2.96Å; V355-K358 WeakPolarHBondContact O-CB 3.11Å; V355-K358 PolarHBondContact O-N 3.34Å; V355-K358 VanDerWaalsContact O-N 3.11Å; V355-H359 VanDerWaalsContact CG1-CD2 3.48Å; V355-H359 WeakPolarHBondContact CG1-CD2 2.88Å; V355-H359 PolarHBondContact O-CD2 3.22Å; V355-H359 PolarHBondContact O-N 3.45Å
356	I	38.7	Very low	38.6	Very low	7 Å²	7	61.5 Å²	61.5	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-58.1	-49.9	175.5	-64.8	162.1	0	0	0	110.8	D352 K358 H359 I360 L395 L399 V403	D352-I356 WeakPolarHBondContact O-CD1 3.42Å; D352-I356 WeakPolarHBondContact O-CG1 3.36Å; D352-I356 PolarHBondContact O-N 2.97Å; I356-K358 PolarHBondContact O-N 3.42Å; I356-H359 PolarHBondContact O-N 2.95Å; I356-I360 HydrophobicContact CG2-CD1 3.79Å; I356-I360 WeakPolarHBondContact O-CG1 3.47Å; I356-I360 PolarHBondContact O-N 3.42Å; I356-L395 HydrophobicContact CG2-CD1 4.03Å; I356-L399 HydrophobicContact CD1-CD2 4.39Å; I356-V403 HydrophobicContact CD1-CB 4.3Å; I356-V403 HydrophobicContact CD1-CG1 3.85Å; I356-V403 HydrophobicContact CD1-CG2 3.45Å; I356-V403 VanDerWaalsContact CD1-CG2 3.45Å; I356-V403 HydrophobicContact CG1-CG2 4.09Å
357	M	39.2	Very low	38.7	Very low	74 Å²	74	58.3 Å²	58.3	37%	0.365	30%	0.295	S	S	.	.	H	α-helix	trans	-60.6	-35.3	177.1	-76.9	-169.1	-57.1	0	0	112.1	M353 V354 V355 K361	M353-M357 VanDerWaalsContact O-CB 3.31Å; M353-M357 WeakPolarHBondContact O-CB 3.48Å; M353-M357 VanDerWaalsContact O-CG 3.24Å; M353-M357 WeakPolarHBondContact O-CG 3.46Å; M353-M357 PolarHBondContact O-N 3.28Å; V354-M357 HydrophobicContact CG2-CE 4.13Å; V355-M357 PolarHBondContact O-N 2.96Å; M357-K361 VanDerWaalsContact O-CB 3.24Å; M357-K361 WeakPolarHBondContact O-CB 3.06Å; M357-K361 VanDerWaalsContact O-CG 3.3Å; M357-K361 WeakPolarHBondContact O-CG 3.26Å; M357-K361 PolarHBondContact O-N 3.49Å
358	K	44.3	Very low	38.8	Very low	87 Å²	87	57.7 Å²	57.7	38%	0.378	29%	0.291	S	S	.	.	H	α-helix	trans	-71.7	-41.3	178.7	-173.9	-176.9	178.1	-169.6	0	111.5	V354 V355 I356 K361 A362	V354-K358 WeakPolarHBondContact O-CB 3.36Å; V354-K358 PolarHBondContact O-N 3.34Å; V355-K358 WeakPolarHBondContact O-CB 3.11Å; V355-K358 PolarHBondContact O-N 3.34Å; V355-K358 VanDerWaalsContact O-N 3.11Å; I356-K358 PolarHBondContact O-N 3.42Å; K358-K361 PolarHBondContact O-N 3.02Å; K358-A362 WeakPolarHBondContact O-CB 3.25Å; K358-A362 PolarHBondContact O-N 3.05Å
359	H	43.1	Very low	38.8	Very low	39 Å²	39	61 Å²	61	18%	0.181	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-43	176.5	-74.7	-66.1	0	0	0	112	V355 I356 A362 A363 Q391 H394 L395	V355-H359 VanDerWaalsContact CG1-CD2 3.48Å; V355-H359 WeakPolarHBondContact CG1-CD2 2.88Å; V355-H359 PolarHBondContact O-CD2 3.22Å; V355-H359 PolarHBondContact O-N 3.45Å; I356-H359 PolarHBondContact O-N 2.95Å; H359-A362 PolarHBondContact O-N 3.35Å; H359-A363 WeakPolarHBondContact O-CB 3.31Å; H359-A363 PolarHBondContact O-N 3.05Å; H359-Q391 PolarHBondContact ND1-OE1 3.2Å; H359-H394 AromaticContact CE1-ND1 3.85Å; H359-H394 AromaticContact NE2-CE1 3.9Å; H359-H394 AromaticContact NE2-ND1 3.79Å; H359-L395 HydrophobicContact CB-CD1 4.45Å
360	I	41.1	Very low	38.6	Very low	13 Å²	13	57.2 Å²	57.2	7%	0.067	30%	0.295	C	S	.	.	H	α-helix	trans	-61.8	-49.8	174.6	-67.3	168	0	0	0	110	I356 A362 A363 Q364 L395 L425 F428	I356-I360 HydrophobicContact CG2-CD1 3.79Å; I356-I360 WeakPolarHBondContact O-CG1 3.47Å; I356-I360 PolarHBondContact O-N 3.42Å; I360-A362 PolarHBondContact O-N 3.2Å; I360-A363 PolarHBondContact O-N 3.15Å; I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.3Å; I360-Q364 WeakPolarHBondContact O-CG 3.43Å; I360-Q364 PolarHBondContact O-N 3.36Å; I360-L395 HydrophobicContact CD1-CD1 4.41Å; I360-L395 HydrophobicContact CD1-CD2 4.28Å; I360-L395 HydrophobicContact CG1-CD1 4.11Å; I360-L395 HydrophobicContact CG1-CD2 3.6Å; I360-L425 HydrophobicContact CD1-CD2 3.35Å; I360-F428 HydrophobicContact CG2-CD2 4.11Å; I360-F428 HydrophobicContact CG2-CE2 3.88Å
361	K	42.9	Very low	38.7	Very low	55 Å²	55	56.1 Å²	56.1	24%	0.239	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-36.1	178.2	-77.8	-175.1	176.7	-172.8	0	113.4	M357 K358 Q364 Q365	M357-K361 VanDerWaalsContact O-CB 3.24Å; M357-K361 WeakPolarHBondContact O-CB 3.06Å; M357-K361 VanDerWaalsContact O-CG 3.3Å; M357-K361 WeakPolarHBondContact O-CG 3.26Å; M357-K361 PolarHBondContact O-N 3.49Å; K358-K361 PolarHBondContact O-N 3.02Å; K361-Q364 PolarHBondContact O-N 3.41Å; K361-Q365 VanDerWaalsContact O-CB 3.25Å; K361-Q365 WeakPolarHBondContact O-CB 3.41Å; K361-Q365 VanDerWaalsContact O-CG 3.24Å; K361-Q365 WeakPolarHBondContact O-CG 3.25Å; K361-Q365 PolarHBondContact O-N 3.46Å
362	A	41.1	Very low	38.7	Very low	40 Å²	40	55.2 Å²	55.2	33%	0.331	30%	0.295	S	S	.	.	H	α-helix	trans	-68	-42.9	177.2	0	0	0	0	0	110.9	K358 H359 I360 F366	K358-A362 WeakPolarHBondContact O-CB 3.25Å; K358-A362 PolarHBondContact O-N 3.05Å; H359-A362 PolarHBondContact O-N 3.35Å; I360-A362 PolarHBondContact O-N 3.2Å; A362-F366 WeakPolarHBondContact O-CB 3.33Å; A362-F366 PolarHBondContact O-N 2.96Å
363	A	39.4	Very low	38.4	Very low	5 Å²	5	57.5 Å²	57.5	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-44.5	172	0	0	0	0	0	111.4	H359 I360 L367 Q391	H359-A363 WeakPolarHBondContact O-CB 3.31Å; H359-A363 PolarHBondContact O-N 3.05Å; I360-A363 PolarHBondContact O-N 3.15Å; A363-L367 WeakPolarHBondContact O-CB 3.35Å; A363-L367 WeakPolarHBondContact O-CD1 3.09Å; A363-L367 VanDerWaalsContact O-CG 3.26Å; A363-L367 WeakPolarHBondContact O-CG 3.17Å; A363-L367 PolarHBondContact O-N 3.29Å; A363-Q391 HydrophobicContact CB-CB 4.34Å
364	Q	38.5	Very low	38.3	Very low	46 Å²	46	61.4 Å²	61.4	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-50.7	176.5	-73.4	171	-27.2	0	0	112.6	I360 K361 F366 L367 N368 F428 L443	I360-Q364 HydrophobicContact CG2-CG 4.33Å; I360-Q364 WeakPolarHBondContact O-CB 3.3Å; I360-Q364 WeakPolarHBondContact O-CG 3.43Å; I360-Q364 PolarHBondContact O-N 3.36Å; K361-Q364 PolarHBondContact O-N 3.41Å; Q364-F366 PolarHBondContact O-N 3.18Å; Q364-L367 PolarHBondContact O-N 2.96Å; Q364-N368 VanDerWaalsContact O-CG 3.28Å; Q364-N368 PolarHBondContact O-N 2.95Å; Q364-N368 VanDerWaalsContact O-N 3.16Å; Q364-N368 PolarHBondContact O-OD1 3.48Å; Q364-F428 HydrophobicContact CG-CE2 3.8Å; Q364-F428 HydrophobicContact CG-CZ 4.47Å; Q364-L443 HydrophobicContact CG-CD2 4.13Å
365	Q	40.6	Very low	38.1	Very low	107 Å²	107	59.8 Å²	59.8	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-71	-31	-177.9	-72.1	178.7	-5.6	0	0	112.4	K361 N368 V369	K361-Q365 VanDerWaalsContact O-CB 3.25Å; K361-Q365 WeakPolarHBondContact O-CB 3.41Å; K361-Q365 VanDerWaalsContact O-CG 3.24Å; K361-Q365 WeakPolarHBondContact O-CG 3.25Å; K361-Q365 PolarHBondContact O-N 3.46Å; Q365-N368 WeakPolarHBondContact O-CB 3.33Å; Q365-N368 PolarHBondContact O-N 3.41Å; Q365-V369 PolarHBondContact O-N 3.28Å
366	F	38	Very low	38.1	Very low	53 Å²	53	61.5 Å²	61.5	23%	0.232	33%	0.332	C	S	.	.	H	α-helix	trans	-73.6	-36.3	177	-170.7	-101.4	0	0	0	111.6	A362 Q364 N368 V369 I370 C384 R387 V388	A362-F366 WeakPolarHBondContact O-CB 3.33Å; A362-F366 PolarHBondContact O-N 2.96Å; Q364-F366 PolarHBondContact O-N 3.18Å; F366-N368 VanDerWaalsContact C-N 3.29Å; F366-N368 PolarHBondContact O-N 2.87Å; F366-V369 PolarHBondContact O-N 2.96Å; F366-I370 HydrophobicContact CD1-CD1 3.91Å; F366-I370 HydrophobicContact CE1-CD1 3.78Å; F366-I370 WeakPolarHBondContact O-CD1 3.45Å; F366-I370 WeakPolarHBondContact O-CG1 3.42Å; F366-C384 HydrophobicContact CE1-CB 4.12Å; F366-C384 HydrophobicContact CZ-CB 4.47Å; F366-R387 HydrophobicContact CD1-CB 4.28Å; F366-R387 HydrophobicContact CE1-CB 3.68Å; F366-R387 HydrophobicContact CE1-CG 4.46Å; F366-R387 HydrophobicContact CZ-CB 4.04Å; F366-R387 HydrophobicContact CZ-CG 4.34Å; F366-V388 HydrophobicContact CD1-CG2 3.83Å; F366-V388 HydrophobicContact CE1-CG2 4.27Å
367	L	33	Very low	38.3	Very low	27 Å²	27	63.4 Å²	63.4	14%	0.141	35%	0.346	C	S	.	.	H	α-helix	trans	-60.9	-36.6	168.8	-74.5	164.8	0	0	0	112.2	A363 Q364 V369 I370 V388 L439 L443	A363-L367 WeakPolarHBondContact O-CB 3.35Å; A363-L367 WeakPolarHBondContact O-CD1 3.09Å; A363-L367 VanDerWaalsContact O-CG 3.26Å; A363-L367 WeakPolarHBondContact O-CG 3.17Å; A363-L367 PolarHBondContact O-N 3.29Å; Q364-L367 PolarHBondContact O-N 2.96Å; L367-V369 VanDerWaalsContact C-N 3.27Å; L367-V369 PolarHBondContact O-N 2.98Å; L367-I370 PolarHBondContact O-N 3.21Å; L367-V388 HydrophobicContact CD1-CG1 4.5Å; L367-V388 HydrophobicContact CD2-CG1 4.32Å; L367-V388 HydrophobicContact CD2-CG2 3.85Å; L367-V388 HydrophobicContact CG-CG2 4.05Å; L367-L439 HydrophobicContact CD1-CD2 4.39Å; L367-L443 HydrophobicContact CB-CD1 4.32Å; L367-L443 HydrophobicContact CD1-CD1 4.02Å
368	N	37.3	Very low	38.3	Very low	88 Å²	88	61.7 Å²	61.7	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-61.1	-30.7	176	-66.2	-17.9	0	0	0	113.8	Q364 Q365 F366	Q364-N368 VanDerWaalsContact O-CG 3.28Å; Q364-N368 PolarHBondContact O-N 2.95Å; Q364-N368 VanDerWaalsContact O-N 3.16Å; Q364-N368 PolarHBondContact O-OD1 3.48Å; Q365-N368 WeakPolarHBondContact O-CB 3.33Å; Q365-N368 PolarHBondContact O-N 3.41Å; F366-N368 VanDerWaalsContact C-N 3.29Å; F366-N368 PolarHBondContact O-N 2.87Å
369	V	36.8	Very low	38.2	Very low	83 Å²	83	59 Å²	59	50%	0.503	33%	0.331	S	S	.	.	H	α-helix	trans	-74	-34.8	-179.2	176	0	0	0	0	111.1	Q365 F366 L367 Q371 S372	Q365-V369 PolarHBondContact O-N 3.28Å; F366-V369 PolarHBondContact O-N 2.96Å; L367-V369 VanDerWaalsContact C-N 3.27Å; L367-V369 PolarHBondContact O-N 2.98Å; V369-Q371 PolarHBondContact O-N 3.48Å; V369-S372 PolarHBondContact O-N 3.08Å; V369-S372 PolarHBondContact O-OG 3.15Å
370	I	32.8	Very low	38.3	Very low	14 Å²	14	58.3 Å²	58.3	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-69.3	-28	-166.8	-68.5	163.2	0	0	0	113.5	F366 L367 F375 C384	F366-I370 HydrophobicContact CD1-CD1 3.91Å; F366-I370 HydrophobicContact CE1-CD1 3.78Å; F366-I370 WeakPolarHBondContact O-CD1 3.45Å; F366-I370 WeakPolarHBondContact O-CG1 3.42Å; L367-I370 PolarHBondContact O-N 3.21Å; I370-F375 HydrophobicContact CG2-CE1 3.59Å; I370-F375 HydrophobicContact CG2-CE2 4.35Å; I370-F375 HydrophobicContact CG2-CZ 3.33Å; I370-C384 HydrophobicContact CD1-CB 3.46Å; I370-C384 VanDerWaalsContact CD1-CB 3.46Å; I370-C384 HydrophobicContact CG1-CB 3.93Å; I370-C384 VanDerWaalsContact CG1-SG 3.55Å
371	Q	32.9	Very low	38.5	Very low	99 Å²	99	58.2 Å²	58.2	46%	0.463	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	6.6	177	-80.4	-163.3	-16.2	0	0	115.5	V369 E373	V369-Q371 PolarHBondContact O-N 3.48Å; Q371-E373 PolarHBondContact O-N 2.79Å
372	S	37.4	Very low	38.5	Very low	94 Å²	94	55.8 Å²	55.8	66%	0.657	32%	0.321	S	S	*	.	S	Bend	trans	-69.7	-16.7	156.4	69.8	0	0	0	0	112	V369	V369-S372 PolarHBondContact O-N 3.08Å; V369-S372 PolarHBondContact O-OG 3.15Å
373	E	32.8	Very low	38.7	Very low	93 Å²	93	57.4 Å²	57.4	44%	0.435	32%	0.321	S	S	.	.	S	Bend	trans	-115.4	107.3	-176	-62.9	-173.3	175.5	0	0	110.4	Q371 F375	Q371-E373 PolarHBondContact O-N 2.79Å; E373-F375 PolarHBondContact O-N 3.47Å
374	T	32.8	Very low	39.1	Very low	134 Å²	134	58.3 Å²	58.3	82%	0.822	33%	0.327	S	S	*	.			trans	-51.1	106.4	152.6	43.7	0	0	0	0	107	S376	T374-S376 PolarHBondContact O-N 3.05Å
375	F	35.4	Very low	39.6	Very low	43 Å²	43	57.4 Å²	57.4	19%	0.189	32%	0.322	C	S	.	.			trans	-47.3	98.7	-172.9	-66.6	-82.1	0	0	0	111.7	I370 E373 S377 L381	I370-F375 HydrophobicContact CG2-CE1 3.59Å; I370-F375 HydrophobicContact CG2-CE2 4.35Å; I370-F375 HydrophobicContact CG2-CZ 3.33Å; E373-F375 PolarHBondContact O-N 3.47Å; F375-S377 PolarHBondContact O-N 3.49Å; F375-L381 HydrophobicContact CB-CD1 4.37Å; F375-L381 HydrophobicContact CD1-CB 3.5Å; F375-L381 VanDerWaalsContact CD1-CB 3.5Å; F375-L381 HydrophobicContact CD1-CD1 3.64Å; F375-L381 HydrophobicContact CD1-CG 3.85Å; F375-L381 HydrophobicContact CD2-CD1 3.59Å; F375-L381 HydrophobicContact CE1-CB 3.55Å; F375-L381 HydrophobicContact CE1-CD1 3.59Å; F375-L381 HydrophobicContact CE1-CG 3.55Å; F375-L381 HydrophobicContact CE2-CD1 3.54Å; F375-L381 HydrophobicContact CE2-CG 4.33Å; F375-L381 HydrophobicContact CG-CB 4.22Å; F375-L381 HydrophobicContact CG-CD1 3.62Å; F375-L381 HydrophobicContact CG-CG 4.35Å; F375-L381 HydrophobicContact CZ-CB 4.32Å; F375-L381 HydrophobicContact CZ-CD1 3.52Å; F375-L381 HydrophobicContact CZ-CG 3.79Å
376	S	42.8	Very low	39.8	Very low	90 Å²	90	53.5 Å²	53.5	63%	0.629	30%	0.304	S	S	*	.	S	Bend	trans	-80.8	-8.5	175.9	61.1	0	0	0	0	111.5	V168 T374	V168-S376 VanDerWaalsContact CG2-O 3.27Å; V168-S376 WeakPolarHBondContact CG2-O 3.43Å; T374-S376 PolarHBondContact O-N 3.05Å
377	S	41.6	Very low	40.3	Very low	48 Å²	48	57 Å²	57	34%	0.336	32%	0.316	S	S	.	.			trans	-147.2	134.1	174	70.5	0	0	0	0	113.2	F375 V379 A380 L381	F375-S377 PolarHBondContact O-N 3.49Å; S377-V379 PolarHBondContact O-N 3.12Å; S377-A380 PolarHBondContact O-N 2.88Å; S377-A380 WeakPolarHBondContact OG-CB 3.5Å; S377-A380 PolarHBondContact OG-N 3.44Å; S377-L381 PolarHBondContact O-N 3.41Å
378	V	40.5	Very low	41	Very low	37 Å²	37	56 Å²	56	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-55.9	-30.5	172.7	-176.5	0	0	0	0	111.7	C173 L176 L381 V382	C173-V378 HydrophobicContact CB-CG2 4.48Å; C173-V378 VanDerWaalsContact SG-CG2 3.56Å; L176-V378 HydrophobicContact CD2-CG1 3.78Å; V378-L381 WeakPolarHBondContact O-CB 3.46Å; V378-L381 PolarHBondContact O-N 2.81Å; V378-V382 HydrophobicContact CG1-CG2 4.27Å; V378-V382 WeakPolarHBondContact O-CG2 3.5Å; V378-V382 PolarHBondContact O-N 3.03Å
379	V	41	Very low	41.7	Very low	32 Å²	32	52 Å²	52	19%	0.194	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-45.6	179.3	-179.5	0	0	0	0	111.7	V314 S377 L381 V382 Q383	V314-V379 HydrophobicContact CB-CG2 4.42Å; V314-V379 HydrophobicContact CG1-CG2 3.35Å; V314-V379 HydrophobicContact CG2-CG2 4.38Å; S377-V379 PolarHBondContact O-N 3.12Å; V379-L381 VanDerWaalsContact C-N 3.3Å; V379-L381 PolarHBondContact O-N 3.17Å; V379-V382 PolarHBondContact O-N 3.47Å; V379-Q383 HydrophobicContact CG1-CG 4.28Å; V379-Q383 WeakPolarHBondContact O-CB 3.29Å; V379-Q383 VanDerWaalsContact O-CG 3.23Å; V379-Q383 WeakPolarHBondContact O-CG 3.4Å; V379-Q383 PolarHBondContact O-N 2.96Å
380	A	45.3	Very low	42.3	Very low	23 Å²	23	50 Å²	50	19%	0.19	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-43	176.3	0	0	0	0	0	110.5	S377 V382 Q383 C384	S377-A380 PolarHBondContact O-N 2.88Å; S377-A380 WeakPolarHBondContact OG-CB 3.5Å; S377-A380 PolarHBondContact OG-N 3.44Å; A380-V382 PolarHBondContact O-N 3.32Å; A380-Q383 PolarHBondContact O-N 3.18Å; A380-C384 WeakPolarHBondContact O-CB 3.44Å; A380-C384 PolarHBondContact O-N 3.02Å; A380-C384 PolarHBondContact O-SG 2.93Å
381	L	45.5	Very low	43.1	Very low	12 Å²	12	51.8 Å²	51.8	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-59.7	-46.6	176.9	-167	144.5	0	0	0	112.7	K177 L180 F375 S377 V378 V379 C384 F385	K177-L381 HydrophobicContact CD-CD1 4.12Å; K177-L381 HydrophobicContact CG-CD1 3.63Å; K177-L381 HydrophobicContact CG-CD2 4.27Å; L180-L381 HydrophobicContact CD1-CD2 3.38Å; F375-L381 HydrophobicContact CB-CD1 4.37Å; F375-L381 HydrophobicContact CD1-CB 3.5Å; F375-L381 VanDerWaalsContact CD1-CB 3.5Å; F375-L381 HydrophobicContact CD1-CD1 3.64Å; F375-L381 HydrophobicContact CD1-CG 3.85Å; F375-L381 HydrophobicContact CD2-CD1 3.59Å; F375-L381 HydrophobicContact CE1-CB 3.55Å; F375-L381 HydrophobicContact CE1-CD1 3.59Å; F375-L381 HydrophobicContact CE1-CG 3.55Å; F375-L381 HydrophobicContact CE2-CD1 3.54Å; F375-L381 HydrophobicContact CE2-CG 4.33Å; F375-L381 HydrophobicContact CG-CB 4.22Å; F375-L381 HydrophobicContact CG-CD1 3.62Å; F375-L381 HydrophobicContact CG-CG 4.35Å; F375-L381 HydrophobicContact CZ-CB 4.32Å; F375-L381 HydrophobicContact CZ-CD1 3.52Å; F375-L381 HydrophobicContact CZ-CG 3.79Å; S377-L381 PolarHBondContact O-N 3.41Å; V378-L381 WeakPolarHBondContact O-CB 3.46Å; V378-L381 PolarHBondContact O-N 2.81Å; V379-L381 VanDerWaalsContact C-N 3.3Å; V379-L381 PolarHBondContact O-N 3.17Å; L381-C384 PolarHBondContact O-N 3.17Å; L381-F385 PolarHBondContact O-N 3.31Å
382	V	43.7	Very low	43.9	Very low	4 Å²	4	47.3 Å²	47.3	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-44.2	179	171.8	0	0	0	0	111.6	L176 V318 K321 V378 V379 A380 C384 F385 E386	L176-V382 HydrophobicContact CD2-CG2 3.97Å; V318-V382 HydrophobicContact CG1-CG1 4.4Å; V318-V382 HydrophobicContact CG1-CG2 4.22Å; V318-V382 HydrophobicContact CG2-CG2 4.42Å; K321-V382 HydrophobicContact CB-CG1 4.45Å; V378-V382 HydrophobicContact CG1-CG2 4.27Å; V378-V382 WeakPolarHBondContact O-CG2 3.5Å; V378-V382 PolarHBondContact O-N 3.03Å; V379-V382 PolarHBondContact O-N 3.47Å; A380-V382 PolarHBondContact O-N 3.32Å; V382-C384 PolarHBondContact O-N 3.46Å; V382-F385 PolarHBondContact O-N 2.8Å; V382-E386 WeakPolarHBondContact O-CB 3.22Å; V382-E386 PolarHBondContact O-N 3.4Å
383	Q	45.6	Very low	44.7	Very low	73 Å²	73	43.4 Å²	43.4	34%	0.341	24%	0.235	S	C	.	.	H	α-helix	trans	-61.5	-36.9	175.6	-73.2	-179.8	-3.9	0	0	111.8	K321 V379 A380 R387	K321-Q383 HydrophobicContact CD-CG 4.1Å; V379-Q383 HydrophobicContact CG1-CG 4.28Å; V379-Q383 WeakPolarHBondContact O-CB 3.29Å; V379-Q383 VanDerWaalsContact O-CG 3.23Å; V379-Q383 WeakPolarHBondContact O-CG 3.4Å; V379-Q383 PolarHBondContact O-N 2.96Å; A380-Q383 PolarHBondContact O-N 3.18Å; Q383-R387 WeakPolarHBondContact O-CG 3.24Å; Q383-R387 PolarHBondContact O-N 3.33Å; Q383-R387 VanDerWaalsContact O-N 3.12Å
384	C	46.6	Very low	45.6	Very low	24 Å²	24	42.5 Å²	42.5	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-47.2	177.7	-76.2	0	0	0	0	111.8	F366 I370 A380 L381 V382 E386 R387 V388	F366-C384 HydrophobicContact CE1-CB 4.12Å; F366-C384 HydrophobicContact CZ-CB 4.47Å; I370-C384 HydrophobicContact CD1-CB 3.46Å; I370-C384 VanDerWaalsContact CD1-CB 3.46Å; I370-C384 HydrophobicContact CG1-CB 3.93Å; I370-C384 VanDerWaalsContact CG1-SG 3.55Å; A380-C384 WeakPolarHBondContact O-CB 3.44Å; A380-C384 PolarHBondContact O-N 3.02Å; A380-C384 PolarHBondContact O-SG 2.93Å; L381-C384 PolarHBondContact O-N 3.17Å; V382-C384 PolarHBondContact O-N 3.46Å; C384-E386 PolarHBondContact O-N 3.02Å; C384-R387 PolarHBondContact O-N 3.37Å; C384-V388 WeakPolarHBondContact O-CG2 3.4Å; C384-V388 PolarHBondContact O-N 3.1Å
385	F	48.5	Very low	46.5	Very low	28 Å²	28	36.3 Å²	36.3	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-47.7	174.8	179.9	-93.4	0	0	0	111.7	L180 T183 L381 V382 R387 V388 F389	L180-F385 HydrophobicContact CB-CD2 3.68Å; L180-F385 HydrophobicContact CB-CE2 3.85Å; L180-F385 HydrophobicContact CB-CG 4.11Å; L180-F385 HydrophobicContact CB-CZ 4.39Å; L180-F385 HydrophobicContact CD1-CB 4.31Å; L180-F385 HydrophobicContact CD1-CG 4.34Å; L180-F385 HydrophobicContact CD2-CB 4.26Å; L180-F385 HydrophobicContact CD2-CD1 3.33Å; L180-F385 HydrophobicContact CD2-CD2 3.94Å; L180-F385 HydrophobicContact CD2-CE1 3.48Å; L180-F385 VanDerWaalsContact CD2-CE1 3.48Å; L180-F385 HydrophobicContact CD2-CE2 4.1Å; L180-F385 HydrophobicContact CD2-CG 3.54Å; L180-F385 HydrophobicContact CD2-CZ 3.87Å; L180-F385 HydrophobicContact CG-CD1 4.42Å; L180-F385 HydrophobicContact CG-CD2 4.26Å; L180-F385 HydrophobicContact CG-CG 4.18Å; L180-F385 WeakPolarHBondContact O-CE2 3.4Å; T183-F385 HydrophobicContact CG2-CZ 3.74Å; L381-F385 PolarHBondContact O-N 3.31Å; V382-F385 PolarHBondContact O-N 2.8Å; F385-R387 VanDerWaalsContact C-N 3.31Å; F385-R387 PolarHBondContact O-N 3.27Å; F385-V388 PolarHBondContact O-N 3.04Å; F385-F389 HydrophobicContact CD1-CB 4.42Å; F385-F389 HydrophobicContact CE1-CB 4.15Å; F385-F389 AromaticContact CE1-CD2 3.92Å; F385-F389 HydrophobicContact CE1-CD2 3.92Å; F385-F389 HydrophobicContact CE1-CG 4.22Å; F385-F389 HydrophobicContact CZ-CB 4.41Å; F385-F389 AromaticContact CZ-CD2 3.73Å; F385-F389 HydrophobicContact CZ-CD2 3.73Å; F385-F389 HydrophobicContact CZ-CE2 4.49Å; F385-F389 HydrophobicContact CZ-CG 4.41Å; F385-F389 WeakPolarHBondContact O-CB 3.38Å; F385-F389 PolarHBondContact O-N 3.07Å
386	E	46.7	Very low	47.2	Very low	25 Å²	25	34.2 Å²	34.2	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-52.9	-47.3	176.4	174.5	-174.9	-176.3	0	0	111.5	K321 V325 V382 C384 N390	K321-E386 VanDerWaalsContact CD-OE2 3.3Å; K321-E386 WeakPolarHBondContact CD-OE2 3.22Å; K321-E386 WeakPolarHBondContact CG-OE2 3.34Å; K321-E386 IonicContact NZ-OE1 3.86Å; K321-E386 IonicContact NZ-OE2 3.18Å; K321-E386 PolarHBondContact NZ-OE2 3.33Å; V325-E386 HydrophobicContact CG2-CB 4.08Å; V325-E386 HydrophobicContact CG2-CG 3.74Å; V382-E386 WeakPolarHBondContact O-CB 3.22Å; V382-E386 PolarHBondContact O-N 3.4Å; C384-E386 PolarHBondContact O-N 3.02Å; E386-N390 VanDerWaalsContact O-CB 3.26Å; E386-N390 WeakPolarHBondContact O-CB 3.05Å; E386-N390 PolarHBondContact O-N 3.48Å; E386-N390 PolarHBondContact O-ND2 3.06Å
387	R	48.1	Very low	47.6	Very low	125 Å²	125	34.1 Å²	34.1	47%	0.472	17%	0.169	S	C	.	.	H	α-helix	trans	-66.5	-46.5	-179.4	-76.1	175	173.7	-173.2	-0.4	112.6	F366 Q383 C384 F385 F389 N390 Q391	F366-R387 HydrophobicContact CD1-CB 4.28Å; F366-R387 HydrophobicContact CE1-CB 3.68Å; F366-R387 HydrophobicContact CE1-CG 4.46Å; F366-R387 HydrophobicContact CZ-CB 4.04Å; F366-R387 HydrophobicContact CZ-CG 4.34Å; Q383-R387 WeakPolarHBondContact O-CG 3.24Å; Q383-R387 PolarHBondContact O-N 3.33Å; Q383-R387 VanDerWaalsContact O-N 3.12Å; C384-R387 PolarHBondContact O-N 3.37Å; F385-R387 VanDerWaalsContact C-N 3.31Å; F385-R387 PolarHBondContact O-N 3.27Å; R387-F389 VanDerWaalsContact C-N 3.35Å; R387-N390 PolarHBondContact O-N 3.42Å; R387-Q391 WeakPolarHBondContact O-CB 3.44Å; R387-Q391 WeakPolarHBondContact O-CG 3.39Å; R387-Q391 PolarHBondContact O-N 3.41Å
388	V	48.1	Very low	48	Very low	6 Å²	6	33.1 Å²	33.1	4%	0.036	16%	0.159	C	C	.	.	H	α-helix	trans	-63.6	-44.2	177.8	173.8	0	0	0	0	110.6	Y184 F366 L367 C384 F385 Q391 L392	Y184-V388 HydrophobicContact CD2-CG1 3.86Å; Y184-V388 HydrophobicContact CE2-CG1 3.59Å; F366-V388 HydrophobicContact CD1-CG2 3.83Å; F366-V388 HydrophobicContact CE1-CG2 4.27Å; L367-V388 HydrophobicContact CD1-CG1 4.5Å; L367-V388 HydrophobicContact CD2-CG1 4.32Å; L367-V388 HydrophobicContact CD2-CG2 3.85Å; L367-V388 HydrophobicContact CG-CG2 4.05Å; C384-V388 WeakPolarHBondContact O-CG2 3.4Å; C384-V388 PolarHBondContact O-N 3.1Å; F385-V388 PolarHBondContact O-N 3.04Å; V388-Q391 PolarHBondContact O-N 2.92Å; V388-L392 HydrophobicContact CG1-CD1 3.96Å; V388-L392 HydrophobicContact CG1-CG 4.47Å; V388-L392 WeakPolarHBondContact O-CB 3.24Å; V388-L392 WeakPolarHBondContact O-CG 3.5Å; V388-L392 PolarHBondContact O-N 3.42Å
389	F	51	Low	48.5	Very low	6 Å²	6	31.4 Å²	31.4	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-59.5	-48.8	177.2	-172.2	-84.9	0	0	0	111.1	T183 L187 V325 V329 F385 R387 Q391 L392 L393	T183-F389 HydrophobicContact CG2-CD2 4.18Å; T183-F389 HydrophobicContact CG2-CE2 3.69Å; L187-F389 HydrophobicContact CD1-CD1 4.44Å; L187-F389 HydrophobicContact CD1-CD2 3.59Å; L187-F389 HydrophobicContact CD1-CE1 4.11Å; L187-F389 HydrophobicContact CD1-CE2 3.16Å; L187-F389 HydrophobicContact CD1-CG 4.2Å; L187-F389 HydrophobicContact CD1-CZ 3.45Å; L187-F389 VanDerWaalsContact CD1-CZ 3.45Å; L187-F389 HydrophobicContact CG-CE2 4.47Å; V325-F389 HydrophobicContact CG1-CD1 3.46Å; V325-F389 VanDerWaalsContact CG1-CD1 3.46Å; V325-F389 HydrophobicContact CG1-CE1 3.51Å; V325-F389 HydrophobicContact CG1-CG 4.03Å; V325-F389 HydrophobicContact CG1-CZ 4.14Å; V329-F389 HydrophobicContact CG2-CE1 3.42Å; V329-F389 VanDerWaalsContact CG2-CE1 3.42Å; V329-F389 HydrophobicContact CG2-CZ 3.27Å; F385-F389 HydrophobicContact CD1-CB 4.42Å; F385-F389 HydrophobicContact CE1-CB 4.15Å; F385-F389 AromaticContact CE1-CD2 3.92Å; F385-F389 HydrophobicContact CE1-CD2 3.92Å; F385-F389 HydrophobicContact CE1-CG 4.22Å; F385-F389 HydrophobicContact CZ-CB 4.41Å; F385-F389 AromaticContact CZ-CD2 3.73Å; F385-F389 HydrophobicContact CZ-CD2 3.73Å; F385-F389 HydrophobicContact CZ-CE2 4.49Å; F385-F389 HydrophobicContact CZ-CG 4.41Å; F385-F389 WeakPolarHBondContact O-CB 3.38Å; F385-F389 PolarHBondContact O-N 3.07Å; R387-F389 VanDerWaalsContact C-N 3.35Å; F389-Q391 PolarHBondContact O-N 3.4Å; F389-L392 PolarHBondContact O-N 2.96Å; F389-L393 HydrophobicContact CE1-CD2 4.07Å; F389-L393 WeakPolarHBondContact O-CB 2.93Å; F389-L393 PolarHBondContact O-N 3.23Å
390	N	48.7	Very low	48.8	Very low	41 Å²	41	31.2 Å²	31.2	22%	0.219	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-41.4	178.4	-73.1	-22.3	0	0	0	112.2	E386 R387 H394	E386-N390 VanDerWaalsContact O-CB 3.26Å; E386-N390 WeakPolarHBondContact O-CB 3.05Å; E386-N390 PolarHBondContact O-N 3.48Å; E386-N390 PolarHBondContact O-ND2 3.06Å; R387-N390 PolarHBondContact O-N 3.42Å; N390-H394 WeakPolarHBondContact O-CB 3.39Å; N390-H394 PolarHBondContact O-N 3.37Å
391	Q	50.9	Low	49	Very low	50 Å²	50	32.4 Å²	32.4	23%	0.234	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-44	178.7	-71.5	-66.1	-21.8	0	0	112.2	H359 A363 R387 V388 F389 H394 L395	H359-Q391 PolarHBondContact ND1-OE1 3.2Å; A363-Q391 HydrophobicContact CB-CB 4.34Å; R387-Q391 WeakPolarHBondContact O-CB 3.44Å; R387-Q391 WeakPolarHBondContact O-CG 3.39Å; R387-Q391 PolarHBondContact O-N 3.41Å; V388-Q391 PolarHBondContact O-N 2.92Å; F389-Q391 PolarHBondContact O-N 3.4Å; Q391-H394 PolarHBondContact O-N 3.41Å; Q391-L395 WeakPolarHBondContact O-CB 3.43Å; Q391-L395 PolarHBondContact O-N 3.44Å
392	L	49.7	Very low	49.1	Very low	6 Å²	6	36.1 Å²	36.1	3%	0.031	17%	0.167	C	C	.	.	H	α-helix	trans	-70.6	-39.3	177.2	-71.5	173.5	0	0	0	111.9	Y184 L187 L191 V388 F389 H394 L395 I396	Y184-L392 HydrophobicContact CD2-CD1 3.9Å; Y184-L392 HydrophobicContact CE2-CD1 3.42Å; Y184-L392 VanDerWaalsContact CE2-CD1 3.42Å; L187-L392 HydrophobicContact CD2-CB 3.14Å; L187-L392 HydrophobicContact CD2-CD1 3.87Å; L187-L392 HydrophobicContact CD2-CG 4.13Å; L191-L392 HydrophobicContact CD2-CD2 4.18Å; V388-L392 HydrophobicContact CG1-CD1 3.96Å; V388-L392 HydrophobicContact CG1-CG 4.47Å; V388-L392 WeakPolarHBondContact O-CB 3.24Å; V388-L392 WeakPolarHBondContact O-CG 3.5Å; V388-L392 PolarHBondContact O-N 3.42Å; F389-L392 PolarHBondContact O-N 2.96Å; L392-H394 VanDerWaalsContact C-N 3.32Å; L392-H394 PolarHBondContact O-N 2.77Å; L392-L395 PolarHBondContact O-N 3.15Å; L392-I396 WeakPolarHBondContact O-CB 3.11Å; L392-I396 WeakPolarHBondContact O-CG1 3.41Å; L392-I396 PolarHBondContact O-N 3.19Å
393	L	53.4	Low	49.4	Very low	12 Å²	12	36.1 Å²	36.1	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-42	174.9	-172.3	71	0	0	0	110.9	L187 K328 F332 F389 I396 R397	L187-L393 HydrophobicContact CD1-CB 4.48Å; L187-L393 HydrophobicContact CD1-CD1 4.39Å; K328-L393 HydrophobicContact CB-CD2 4.06Å; F332-L393 HydrophobicContact CB-CD1 4.12Å; F332-L393 HydrophobicContact CB-CD2 4.43Å; F332-L393 HydrophobicContact CB-CG 4.5Å; F332-L393 HydrophobicContact CD1-CD1 4.08Å; F332-L393 HydrophobicContact CD2-CD1 4.2Å; F332-L393 HydrophobicContact CG-CD1 3.86Å; F389-L393 HydrophobicContact CE1-CD2 4.07Å; F389-L393 WeakPolarHBondContact O-CB 2.93Å; F389-L393 PolarHBondContact O-N 3.23Å; L393-I396 PolarHBondContact O-N 3.33Å; L393-R397 VanDerWaalsContact O-CB 3.27Å; L393-R397 WeakPolarHBondContact O-CB 3.42Å; L393-R397 PolarHBondContact O-N 3.29Å
394	H	51.6	Low	49.6	Very low	73 Å²	73	32.9 Å²	32.9	34%	0.338	15%	0.152	S	C	.	.	H	α-helix	trans	-62.7	-46.9	173.7	-167.1	-76.8	0	0	0	111	H359 N390 Q391 L392 I396 R397 E398	H359-H394 AromaticContact CE1-ND1 3.85Å; H359-H394 AromaticContact NE2-CE1 3.9Å; H359-H394 AromaticContact NE2-ND1 3.79Å; N390-H394 WeakPolarHBondContact O-CB 3.39Å; N390-H394 PolarHBondContact O-N 3.37Å; Q391-H394 PolarHBondContact O-N 3.41Å; L392-H394 VanDerWaalsContact C-N 3.32Å; L392-H394 PolarHBondContact O-N 2.77Å; H394-I396 VanDerWaalsContact C-N 3.34Å; H394-I396 PolarHBondContact O-N 3.03Å; H394-R397 CarbonylContact O-C 3.59Å; H394-R397 WeakPolarHBondContact O-CB 3.11Å; H394-R397 PolarHBondContact O-N 3.46Å; H394-R397 VanDerWaalsContact O-N 3.12Å; H394-E398 WeakPolarHBondContact CE1-CG 3.43Å; H394-E398 IonicContact CE1-OE1 2.99Å; H394-E398 PolarHBondContact CE1-OE1 2.97Å; H394-E398 VanDerWaalsContact ND1-CG 3.3Å; H394-E398 WeakPolarHBondContact ND1-CG 3.37Å; H394-E398 IonicContact NE2-OE1 3.48Å; H394-E398 WeakPolarHBondContact O-CB 3.28Å; H394-E398 VanDerWaalsContact O-CG 3.28Å; H394-E398 WeakPolarHBondContact O-CG 3.04Å; H394-E398 PolarHBondContact O-N 3.25Å
395	L	50.9	Low	49.7	Very low	4 Å²	4	33 Å²	33	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-45.4	175.8	179.3	66.8	0	0	0	112	L191 I356 H359 I360 Q391 L392 R397 E398 L399	L191-L395 HydrophobicContact CD1-CD2 3.95Å; L191-L395 HydrophobicContact CD1-CG 4.13Å; L191-L395 HydrophobicContact CD2-CD2 4.12Å; I356-L395 HydrophobicContact CG2-CD1 4.03Å; H359-L395 HydrophobicContact CB-CD1 4.45Å; I360-L395 HydrophobicContact CD1-CD1 4.41Å; I360-L395 HydrophobicContact CD1-CD2 4.28Å; I360-L395 HydrophobicContact CG1-CD1 4.11Å; I360-L395 HydrophobicContact CG1-CD2 3.6Å; Q391-L395 WeakPolarHBondContact O-CB 3.43Å; Q391-L395 PolarHBondContact O-N 3.44Å; L392-L395 PolarHBondContact O-N 3.15Å; L395-R397 VanDerWaalsContact C-N 3.3Å; L395-R397 PolarHBondContact O-N 3.42Å; L395-E398 PolarHBondContact O-N 2.85Å; L395-L399 HydrophobicContact CD1-CD1 4.03Å; L395-L399 HydrophobicContact CD1-CG 4.15Å; L395-L399 HydrophobicContact CG-CD1 3.9Å; L395-L399 HydrophobicContact CG-CG 4.41Å; L395-L399 VanDerWaalsContact O-CB 3.26Å; L395-L399 WeakPolarHBondContact O-CB 3.48Å; L395-L399 WeakPolarHBondContact O-CG 3.27Å; L395-L399 PolarHBondContact O-N 2.85Å
396	I	50.3	Low	49.6	Very low	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-44.8	175.5	-69.1	166.9	0	0	0	109.8	L187 L190 L191 F332 L392 L393 H394 T400	L187-I396 HydrophobicContact CD2-CD1 3.58Å; L187-I396 HydrophobicContact CG-CD1 3.87Å; L190-I396 HydrophobicContact CB-CD1 4.25Å; L190-I396 HydrophobicContact CD2-CD1 4.07Å; L190-I396 HydrophobicContact CD2-CG2 4.2Å; L190-I396 HydrophobicContact CG-CD1 4.08Å; L190-I396 HydrophobicContact CG-CG2 4.26Å; L191-I396 HydrophobicContact CB-CD1 4.03Å; L191-I396 HydrophobicContact CB-CG1 3.85Å; L191-I396 HydrophobicContact CD1-CG1 3.72Å; L191-I396 HydrophobicContact CG-CG1 4.39Å; F332-I396 HydrophobicContact CE2-CG2 4.01Å; F332-I396 HydrophobicContact CZ-CG2 3.63Å; L392-I396 WeakPolarHBondContact O-CB 3.11Å; L392-I396 WeakPolarHBondContact O-CG1 3.41Å; L392-I396 PolarHBondContact O-N 3.19Å; L393-I396 PolarHBondContact O-N 3.33Å; H394-I396 VanDerWaalsContact C-N 3.34Å; H394-I396 PolarHBondContact O-N 3.03Å; I396-T400 VanDerWaalsContact O-CB 3.24Å; I396-T400 WeakPolarHBondContact O-CB 3.25Å; I396-T400 PolarHBondContact O-N 3.36Å; I396-T400 PolarHBondContact O-OG1 3.32Å
397	R	51.3	Low	49.5	Very low	88 Å²	88	34.5 Å²	34.5	33%	0.332	16%	0.161	S	C	.	.	H	α-helix	trans	-61.7	-51.5	178.4	179.9	-178	152.1	155.3	-0.4	112.2	F332 L393 H394 L395 T400 L401	F332-R397 HydrophobicContact CD2-CB 4Å; F332-R397 HydrophobicContact CD2-CG 4.37Å; F332-R397 HydrophobicContact CE2-CB 3.94Å; L393-R397 VanDerWaalsContact O-CB 3.27Å; L393-R397 WeakPolarHBondContact O-CB 3.42Å; L393-R397 PolarHBondContact O-N 3.29Å; H394-R397 CarbonylContact O-C 3.59Å; H394-R397 WeakPolarHBondContact O-CB 3.11Å; H394-R397 PolarHBondContact O-N 3.46Å; H394-R397 VanDerWaalsContact O-N 3.12Å; L395-R397 VanDerWaalsContact C-N 3.3Å; L395-R397 PolarHBondContact O-N 3.42Å; R397-T400 PolarHBondContact O-N 3.01Å; R397-L401 HydrophobicContact CG-CD1 3.64Å; R397-L401 HydrophobicContact CG-CG 4.31Å; R397-L401 WeakPolarHBondContact O-CB 3.27Å; R397-L401 WeakPolarHBondContact O-CG 3.42Å; R397-L401 PolarHBondContact O-N 2.82Å
398	E	51.2	Low	49.3	Very low	27 Å²	27	29.8 Å²	29.8	13%	0.126	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-46.6	177.9	-68.9	-58.7	130.6	0	0	111.3	H394 L395 T400 E402 V403	H394-E398 WeakPolarHBondContact CE1-CG 3.43Å; H394-E398 IonicContact CE1-OE1 2.99Å; H394-E398 PolarHBondContact CE1-OE1 2.97Å; H394-E398 VanDerWaalsContact ND1-CG 3.3Å; H394-E398 WeakPolarHBondContact ND1-CG 3.37Å; H394-E398 IonicContact NE2-OE1 3.48Å; H394-E398 WeakPolarHBondContact O-CB 3.28Å; H394-E398 VanDerWaalsContact O-CG 3.28Å; H394-E398 WeakPolarHBondContact O-CG 3.04Å; H394-E398 PolarHBondContact O-N 3.25Å; L395-E398 PolarHBondContact O-N 2.85Å; E398-T400 VanDerWaalsContact C-N 3.3Å; E398-T400 PolarHBondContact O-N 3.3Å; E398-E402 PolarHBondContact O-N 3.36Å; E398-E402 VanDerWaalsContact OE2-CD 3.29Å; E398-E402 VanDerWaalsContact OE2-OE2 3.13Å; E398-V403 WeakPolarHBondContact O-CG2 3.26Å; E398-V403 PolarHBondContact O-N 3.44Å
399	L	49.7	Very low	49.1	Very low	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-58.8	-43.7	176.1	-74.4	172.2	0	0	0	111.4	L191 T194 I356 L395 V403 I404	L191-L399 HydrophobicContact CD1-CD1 3.64Å; T194-L399 HydrophobicContact CG2-CB 4.06Å; I356-L399 HydrophobicContact CD1-CD2 4.39Å; L395-L399 HydrophobicContact CD1-CD1 4.03Å; L395-L399 HydrophobicContact CD1-CG 4.15Å; L395-L399 HydrophobicContact CG-CD1 3.9Å; L395-L399 HydrophobicContact CG-CG 4.41Å; L395-L399 VanDerWaalsContact O-CB 3.26Å; L395-L399 WeakPolarHBondContact O-CB 3.48Å; L395-L399 WeakPolarHBondContact O-CG 3.27Å; L395-L399 PolarHBondContact O-N 2.85Å; L399-V403 HydrophobicContact CD2-CB 4.2Å; L399-V403 HydrophobicContact CD2-CG1 4.2Å; L399-V403 HydrophobicContact CD2-CG2 4.29Å; L399-I404 VanDerWaalsContact O-CB 3.23Å; L399-I404 WeakPolarHBondContact O-CB 3.28Å; L399-I404 VanDerWaalsContact O-CD1 3.31Å; L399-I404 WeakPolarHBondContact O-CD1 3.43Å; L399-I404 WeakPolarHBondContact O-CG1 3.48Å; L399-I404 PolarHBondContact O-N 3.46Å
400	T	48.4	Very low	48.6	Very low	29 Å²	29	31.8 Å²	31.8	18%	0.178	16%	0.162	C	C	.	.	I	π-helix	trans	-75.8	-42.2	-175.5	-51.8	0	0	0	0	113	T194 I396 R397 E398	T194-T400 VanDerWaalsContact CG2-OG1 3.24Å; T194-T400 WeakPolarHBondContact CG2-OG1 3.48Å; I396-T400 VanDerWaalsContact O-CB 3.24Å; I396-T400 WeakPolarHBondContact O-CB 3.25Å; I396-T400 PolarHBondContact O-N 3.36Å; I396-T400 PolarHBondContact O-OG1 3.32Å; R397-T400 PolarHBondContact O-N 3.01Å; E398-T400 VanDerWaalsContact C-N 3.3Å; E398-T400 PolarHBondContact O-N 3.3Å
401	L	49	Very low	48.2	Very low	47 Å²	47	30.2 Å²	30.2	25%	0.246	16%	0.155	C	C	.	.	I	π-helix	trans	-95.3	-29.4	-170.4	-63.6	-178.5	0	0	0	114	R397 P405	R397-L401 HydrophobicContact CG-CD1 3.64Å; R397-L401 HydrophobicContact CG-CG 4.31Å; R397-L401 WeakPolarHBondContact O-CB 3.27Å; R397-L401 WeakPolarHBondContact O-CG 3.42Å; R397-L401 PolarHBondContact O-N 2.82Å; L401-P405 WeakPolarHBondContact O-CG 3.37Å
402	E	48.5	Very low	47.8	Very low	90 Å²	90	29.7 Å²	29.7	42%	0.421	16%	0.159	S	C	.	.	I	π-helix	trans	-116	-55.4	-172.3	-54.2	-161.1	174	0	0	110.7	E398 P405 E406	E398-E402 PolarHBondContact O-N 3.36Å; E398-E402 VanDerWaalsContact OE2-CD 3.29Å; E398-E402 VanDerWaalsContact OE2-OE2 3.13Å; E402-P405 WeakPolarHBondContact O-CD 3.36Å; E402-E406 WeakPolarHBondContact O-CB 3.22Å; E402-E406 WeakPolarHBondContact O-CG 3.41Å; E402-E406 PolarHBondContact O-N 2.79Å; E402-E406 VanDerWaalsContact O-N 3.15Å
403	V	48.9	Very low	47.3	Very low	4 Å²	4	35.3 Å²	35.3	2%	0.024	19%	0.193	C	C	.	.	I	π-helix	trans	-72.7	-49.4	-169.8	-175.5	0	0	0	0	112.9	F348 I356 E398 L399 E406 L407	F348-V403 HydrophobicContact CZ-CG1 4.21Å; I356-V403 HydrophobicContact CD1-CB 4.3Å; I356-V403 HydrophobicContact CD1-CG1 3.85Å; I356-V403 HydrophobicContact CD1-CG2 3.45Å; I356-V403 VanDerWaalsContact CD1-CG2 3.45Å; I356-V403 HydrophobicContact CG1-CG2 4.09Å; E398-V403 WeakPolarHBondContact O-CG2 3.26Å; E398-V403 PolarHBondContact O-N 3.44Å; L399-V403 HydrophobicContact CD2-CB 4.2Å; L399-V403 HydrophobicContact CD2-CG1 4.2Å; L399-V403 HydrophobicContact CD2-CG2 4.29Å; V403-E406 PolarHBondContact O-N 2.99Å; V403-L407 HydrophobicContact CG1-CD1 3.92Å; V403-L407 HydrophobicContact CG1-CG 4.21Å; V403-L407 WeakPolarHBondContact O-CB 3.48Å; V403-L407 WeakPolarHBondContact O-CG 3.39Å; V403-L407 PolarHBondContact O-N 3.02Å
404	I	50.2	Low	46.9	Very low	5 Å²	5	37.5 Å²	37.5	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-45.5	-179.2	-73.9	166.8	0	0	0	111.8	T194 L197 M198 Y201 L399 E406	T194-I404 HydrophobicContact CG2-CD1 3.9Å; T194-I404 WeakPolarHBondContact O-CD1 3.35Å; L197-I404 HydrophobicContact CB-CD1 3.93Å; L197-I404 HydrophobicContact CD1-CD1 3.74Å; L197-I404 HydrophobicContact CG-CD1 4.45Å; M198-I404 HydrophobicContact CG-CG1 4.07Å; Y201-I404 HydrophobicContact CD2-CG2 3.77Å; Y201-I404 HydrophobicContact CE2-CG2 3.36Å; L399-I404 VanDerWaalsContact O-CB 3.23Å; L399-I404 WeakPolarHBondContact O-CB 3.28Å; L399-I404 VanDerWaalsContact O-CD1 3.31Å; L399-I404 WeakPolarHBondContact O-CD1 3.43Å; L399-I404 WeakPolarHBondContact O-CG1 3.48Å; L399-I404 PolarHBondContact O-N 3.46Å; I404-E406 PolarHBondContact O-N 2.79Å
405	P	48.1	Very low	46.6	Very low	27 Å²	27	38.6 Å²	38.6	18%	0.175	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-41.1	174.1	-27.9	38.2	0	0	0	113.7	F341 L401 E402 F408	F341-P405 HydrophobicContact CE1-CB 3.95Å; F341-P405 HydrophobicContact CE1-CG 4.27Å; L401-P405 WeakPolarHBondContact O-CG 3.37Å; E402-P405 WeakPolarHBondContact O-CD 3.36Å; P405-F408 WeakPolarHBondContact O-CB 3.42Å; P405-F408 PolarHBondContact O-N 2.86Å
406	E	47.4	Very low	46.4	Very low	67 Å²	67	40.5 Å²	40.5	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-74.7	-30.6	-179.2	-74.3	-147.6	-157.1	0	0	114	F348 E402 V403 I404 F408 G409 V410	F348-E406 WeakPolarHBondContact CB-OE2 3.42Å; F348-E406 HydrophobicContact CD1-CB 4.41Å; F348-E406 HydrophobicContact CD2-CB 3.86Å; F348-E406 HydrophobicContact CD2-CG 4.13Å; F348-E406 WeakPolarHBondContact CD2-OE2 3.5Å; F348-E406 HydrophobicContact CE1-CB 4.01Å; F348-E406 HydrophobicContact CE2-CB 3.41Å; F348-E406 VanDerWaalsContact CE2-CB 3.41Å; F348-E406 HydrophobicContact CE2-CG 3.91Å; F348-E406 WeakPolarHBondContact CE2-OE2 3.35Å; F348-E406 HydrophobicContact CG-CB 4.32Å; F348-E406 WeakPolarHBondContact CG-OE2 3.39Å; F348-E406 HydrophobicContact CZ-CB 3.48Å; F348-E406 VanDerWaalsContact CZ-CB 3.48Å; F348-E406 HydrophobicContact CZ-CG 4.47Å; E402-E406 WeakPolarHBondContact O-CB 3.22Å; E402-E406 WeakPolarHBondContact O-CG 3.41Å; E402-E406 PolarHBondContact O-N 2.79Å; E402-E406 VanDerWaalsContact O-N 3.15Å; V403-E406 PolarHBondContact O-N 2.99Å; I404-E406 PolarHBondContact O-N 2.79Å; E406-F408 PolarHBondContact O-N 3.49Å; E406-F408 VanDerWaalsContact O-N 3.12Å; E406-G409 WeakPolarHBondContact O-CA 3.39Å; E406-G409 PolarHBondContact O-N 2.91Å; E406-V410 PolarHBondContact O-N 2.64Å; E406-V410 VanDerWaalsContact O-N 3.15Å
407	L	44.8	Very low	46	Very low	18 Å²	18	41.8 Å²	41.8	9%	0.094	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-29.1	172.9	-79	168.6	0	0	0	112.3	M198 V403 G409 V410 A411 I418	M198-L407 HydrophobicContact CG-CD1 3.84Å; M198-L407 HydrophobicContact SD-CD1 3.78Å; V403-L407 HydrophobicContact CG1-CD1 3.92Å; V403-L407 HydrophobicContact CG1-CG 4.21Å; V403-L407 WeakPolarHBondContact O-CB 3.48Å; V403-L407 WeakPolarHBondContact O-CG 3.39Å; V403-L407 PolarHBondContact O-N 3.02Å; L407-G409 VanDerWaalsContact C-N 3.26Å; L407-G409 PolarHBondContact O-N 3.25Å; L407-V410 PolarHBondContact O-N 3.11Å; L407-A411 WeakPolarHBondContact O-CB 3.17Å; L407-A411 PolarHBondContact O-N 3.37Å; L407-I418 HydrophobicContact CD2-CB 4.31Å; L407-I418 HydrophobicContact CD2-CD1 3.48Å; L407-I418 VanDerWaalsContact CD2-CD1 3.48Å; L407-I418 HydrophobicContact CD2-CG1 3.5Å; L407-I418 HydrophobicContact CD2-CG2 3.92Å
408	F	43.4	Very low	45.6	Very low	26 Å²	26	37.8 Å²	37.8	11%	0.114	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-34.4	174.9	-152.1	-87.7	0	0	0	112.3	Y201 V218 P405 E406	Y201-F408 HydrophobicContact CD1-CD2 4.03Å; Y201-F408 HydrophobicContact CD1-CE2 4.25Å; Y201-F408 HydrophobicContact CE1-CD2 4.27Å; Y201-F408 HydrophobicContact CE1-CE2 4.47Å; V218-F408 HydrophobicContact CB-CD1 4.16Å; V218-F408 HydrophobicContact CB-CE1 4.34Å; V218-F408 HydrophobicContact CG1-CD1 3.48Å; V218-F408 VanDerWaalsContact CG1-CD1 3.48Å; V218-F408 HydrophobicContact CG1-CE1 4.05Å; V218-F408 HydrophobicContact CG1-CG 4.35Å; V218-F408 HydrophobicContact CG2-CD1 3.77Å; V218-F408 HydrophobicContact CG2-CE1 3.88Å; P405-F408 WeakPolarHBondContact O-CB 3.42Å; P405-F408 PolarHBondContact O-N 2.86Å; E406-F408 PolarHBondContact O-N 3.49Å; E406-F408 VanDerWaalsContact O-N 3.12Å
409	G	44.7	Very low	45.5	Very low	30 Å²	30	39.6 Å²	39.6	31%	0.309	24%	0.236	S	C	.	.	H	α-helix	trans	-77.5	-42.8	175.2	0	0	0	0	0	113.2	E406 L407	E406-G409 WeakPolarHBondContact O-CA 3.39Å; E406-G409 PolarHBondContact O-N 2.91Å; L407-G409 VanDerWaalsContact C-N 3.26Å; L407-G409 PolarHBondContact O-N 3.25Å
410	V	40.5	Very low	45.3	Very low	23 Å²	23	46.9 Å²	46.9	14%	0.139	27%	0.267	C	S	.	.	H	α-helix	trans	-85.2	-29.4	-170.9	179.4	0	0	0	0	113.7	F348 E406 L407 A412 V413 N414	F348-V410 HydrophobicContact CD1-CG2 3.75Å; F348-V410 HydrophobicContact CE1-CG2 4.35Å; F348-V410 HydrophobicContact CG-CG2 4.46Å; E406-V410 PolarHBondContact O-N 2.64Å; E406-V410 VanDerWaalsContact O-N 3.15Å; L407-V410 PolarHBondContact O-N 3.11Å; V410-A412 PolarHBondContact O-N 2.78Å; V410-V413 PolarHBondContact O-N 3.5Å; V410-N414 HydrophobicContact CG1-CB 4.5Å; V410-N414 PolarHBondContact O-N 2.81Å
411	A	40.5	Very low	45	Very low	8 Å²	8	46 Å²	46	7%	0.066	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.8	-179.3	0	0	0	0	0	113.6	L407 V413 I418	L407-A411 WeakPolarHBondContact O-CB 3.17Å; L407-A411 PolarHBondContact O-N 3.37Å; A411-V413 VanDerWaalsContact C-N 3.25Å; A411-V413 PolarHBondContact O-N 3.36Å; A411-I418 HydrophobicContact CB-CD1 3.31Å
412	A	41	Very low	44.8	Very low	39 Å²	39	44.6 Å²	44.6	32%	0.322	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.5	173.7	0	0	0	0	0	112.4	R213 V410	R213-A412 HydrophobicContact CB-CB 4.32Å; V410-A412 PolarHBondContact O-N 2.78Å
413	V	40.5	Very low	44.7	Very low	124 Å²	124	44.9 Å²	44.9	75%	0.752	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-38.1	-173.7	-173.4	0	0	0	0	111.7	V410 A411	V410-V413 PolarHBondContact O-N 3.5Å; A411-V413 VanDerWaalsContact C-N 3.25Å; A411-V413 PolarHBondContact O-N 3.36Å
414	N	44.2	Very low	44.3	Very low	58 Å²	58	48.7 Å²	48.7	31%	0.31	28%	0.278	S	S	.	.			trans	-137.2	56.1	-166.4	-150	-14.8	0	0	0	114.8	E349 V410 G416 A417	E349-N414 PolarHBondContact OE1-ND2 3.34Å; V410-N414 HydrophobicContact CG1-CB 4.5Å; V410-N414 PolarHBondContact O-N 2.81Å; N414-G416 PolarHBondContact O-N 3.19Å; N414-G416 VanDerWaalsContact O-N 3.1Å; N414-A417 PolarHBondContact O-N 2.89Å; N414-A417 VanDerWaalsContact O-N 3.14Å
415	R	44.3	Very low	43.9	Very low	96 Å²	96	48.7 Å²	48.7	36%	0.362	28%	0.278	S	S	.	.	H	α-helix	trans	-53.3	-32.1	-179.8	-157	178.1	-167.8	143.4	17.9	114.2	I202 I418 V419	I202-R415 PolarHBondContact O-NH2 3.01Å; R415-I418 PolarHBondContact O-N 2.98Å; R415-V419 WeakPolarHBondContact O-CG2 3.37Å; R415-V419 PolarHBondContact O-N 2.76Å
416	G	46.8	Very low	43.9	Very low	45 Å²	45	51.9 Å²	51.9	46%	0.464	29%	0.292	S	S	.	.	H	α-helix	trans	-69.3	-32	-179.3	0	0	0	0	0	114.2	N414 K420	N414-G416 PolarHBondContact O-N 3.19Å; N414-G416 VanDerWaalsContact O-N 3.1Å; G416-K420 WeakPolarHBondContact O-CG 3.32Å; G416-K420 PolarHBondContact O-N 3.3Å
417	A	42.7	Very low	43.6	Very low	27 Å²	27	55.8 Å²	55.8	22%	0.223	31%	0.31	C	S	.	.	H	α-helix	trans	-71	-36.7	176.3	0	0	0	0	0	111.6	M353 N414 K420 L421	M353-A417 HydrophobicContact CE-CB 4Å; N414-A417 PolarHBondContact O-N 2.89Å; N414-A417 VanDerWaalsContact O-N 3.14Å; A417-K420 PolarHBondContact O-N 3.21Å; A417-L421 PolarHBondContact O-N 3Å
418	I	43.7	Very low	43.5	Very low	3 Å²	3	56.4 Å²	56.4	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-71.8	-40.6	-178.9	-57.9	174.5	0	0	0	111.7	I202 L407 A411 R415 K420 L421 L422	I202-I418 HydrophobicContact CD1-CG2 3.49Å; I202-I418 VanDerWaalsContact CD1-CG2 3.49Å; I202-I418 HydrophobicContact CG1-CG2 4.21Å; L407-I418 HydrophobicContact CD2-CB 4.31Å; L407-I418 HydrophobicContact CD2-CD1 3.48Å; L407-I418 VanDerWaalsContact CD2-CD1 3.48Å; L407-I418 HydrophobicContact CD2-CG1 3.5Å; L407-I418 HydrophobicContact CD2-CG2 3.92Å; A411-I418 HydrophobicContact CB-CD1 3.31Å; R415-I418 PolarHBondContact O-N 2.98Å; I418-K420 VanDerWaalsContact C-N 3.27Å; I418-K420 PolarHBondContact O-N 2.89Å; I418-L421 WeakPolarHBondContact O-CB 3.47Å; I418-L421 PolarHBondContact O-N 3.46Å; I418-L422 WeakPolarHBondContact O-CB 3.07Å; I418-L422 PolarHBondContact O-N 3.16Å
419	V	47.4	Very low	43.4	Very low	65 Å²	65	57.7 Å²	57.7	39%	0.394	32%	0.32	S	S	.	.	H	α-helix	trans	-60.3	-40.4	173.8	173.5	0	0	0	0	110.6	R415 L422 D423	R415-V419 WeakPolarHBondContact O-CG2 3.37Å; R415-V419 PolarHBondContact O-N 2.76Å; V419-L422 WeakPolarHBondContact O-CB 3.23Å; V419-L422 PolarHBondContact O-N 2.83Å; V419-D423 VanDerWaalsContact O-CG 3.28Å; V419-D423 PolarHBondContact O-N 3.47Å
420	K	45.4	Very low	43.2	Very low	153 Å²	153	61.7 Å²	61.7	67%	0.665	34%	0.339	S	S	*	.	H	α-helix	trans	-65.1	-39.5	174.6	-71.3	177	-179.8	-179.6	0	112.9	G416 A417 I418 L422 D423 L424	G416-K420 WeakPolarHBondContact O-CG 3.32Å; G416-K420 PolarHBondContact O-N 3.3Å; A417-K420 PolarHBondContact O-N 3.21Å; I418-K420 VanDerWaalsContact C-N 3.27Å; I418-K420 PolarHBondContact O-N 2.89Å; K420-L422 VanDerWaalsContact C-N 3.33Å; K420-D423 PolarHBondContact O-N 3.37Å; K420-L424 VanDerWaalsContact O-CB 3.26Å; K420-L424 WeakPolarHBondContact O-CB 3.38Å; K420-L424 PolarHBondContact O-N 3.13Å
421	L	43.4	Very low	43.1	Very low	12 Å²	12	61.9 Å²	61.9	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-44.8	173.4	-169.7	84.7	0	0	0	110.4	M198 M353 A417 I418 L424 L425	M198-L421 HydrophobicContact SD-CD2 4.18Å; M353-L421 HydrophobicContact CG-CD1 4.4Å; M353-L421 HydrophobicContact SD-CD1 4.16Å; A417-L421 PolarHBondContact O-N 3Å; I418-L421 WeakPolarHBondContact O-CB 3.47Å; I418-L421 PolarHBondContact O-N 3.46Å; L421-L424 PolarHBondContact O-N 3.19Å; L421-L425 HydrophobicContact CD2-CD1 4.18Å; L421-L425 HydrophobicContact CG-CD1 3.91Å; L421-L425 WeakPolarHBondContact O-CB 3.3Å; L421-L425 WeakPolarHBondContact O-CG 3.31Å; L421-L425 PolarHBondContact O-N 2.84Å
422	L	45.3	Very low	43	Very low	17 Å²	17	67.8 Å²	67.8	9%	0.089	38%	0.382	C	S	.	.	H	α-helix	trans	-62.5	-46.9	176.1	-86.2	172.8	0	0	0	112.9	M198 P199 I202 I418 V419 K420 L424 L425 M426	M198-L422 HydrophobicContact CB-CD1 4.47Å; M198-L422 HydrophobicContact CB-CD2 3.63Å; M198-L422 HydrophobicContact CB-CG 4.29Å; M198-L422 HydrophobicContact CE-CD2 3.91Å; M198-L422 HydrophobicContact SD-CD2 4.18Å; P199-L422 HydrophobicContact CG-CD1 4.24Å; P199-L422 HydrophobicContact CG-CD2 3.9Å; I202-L422 HydrophobicContact CD1-CD1 3.3Å; I418-L422 WeakPolarHBondContact O-CB 3.07Å; I418-L422 PolarHBondContact O-N 3.16Å; V419-L422 WeakPolarHBondContact O-CB 3.23Å; V419-L422 PolarHBondContact O-N 2.83Å; K420-L422 VanDerWaalsContact C-N 3.33Å; L422-L424 PolarHBondContact O-N 3.44Å; L422-L425 PolarHBondContact O-N 3.44Å; L422-M426 VanDerWaalsContact O-CB 3.25Å; L422-M426 WeakPolarHBondContact O-CB 3.31Å; L422-M426 WeakPolarHBondContact O-CG 3.38Å; L422-M426 PolarHBondContact O-N 3.4Å
423	D	44.5	Very low	42.9	Very low	96 Å²	96	69.1 Å²	69.1	51%	0.513	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-38.4	177.4	-71.6	-24.3	0	0	0	111.5	V419 K420 H427	V419-D423 VanDerWaalsContact O-CG 3.28Å; V419-D423 PolarHBondContact O-N 3.47Å; K420-D423 PolarHBondContact O-N 3.37Å; D423-H427 PolarHBondContact O-N 3.11Å; D423-H427 PolarHBondContact O-ND1 3.43Å; D423-H427 VanDerWaalsContact O-ND1 3.08Å
424	L	41.2	Very low	42.9	Very low	83 Å²	83	64.2 Å²	64.2	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-72.7	-36.7	179.3	-161.8	140.3	0	0	0	112.1	K420 L421 L422	K420-L424 VanDerWaalsContact O-CB 3.26Å; K420-L424 WeakPolarHBondContact O-CB 3.38Å; K420-L424 PolarHBondContact O-N 3.13Å; L421-L424 PolarHBondContact O-N 3.19Å; L422-L424 PolarHBondContact O-N 3.44Å
425	L	42.5	Very low	42.9	Very low	5 Å²	5	64.9 Å²	64.9	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-75.3	-42.1	175.6	-69.9	170.2	0	0	0	111.8	M195 M198 I360 L421 L422 H427 F428	M195-L425 HydrophobicContact CE-CB 3.48Å; M195-L425 VanDerWaalsContact CE-CB 3.48Å; M195-L425 VanDerWaalsContact CE-O 3.3Å; M195-L425 WeakPolarHBondContact CE-O 3.38Å; M195-L425 HydrophobicContact SD-CB 3.92Å; M195-L425 HydrophobicContact SD-CD2 4.5Å; M198-L425 HydrophobicContact CE-CD1 3.32Å; M198-L425 HydrophobicContact SD-CD1 4.2Å; I360-L425 HydrophobicContact CD1-CD2 3.35Å; L421-L425 HydrophobicContact CD2-CD1 4.18Å; L421-L425 HydrophobicContact CG-CD1 3.91Å; L421-L425 WeakPolarHBondContact O-CB 3.3Å; L421-L425 WeakPolarHBondContact O-CG 3.31Å; L421-L425 PolarHBondContact O-N 2.84Å; L422-L425 PolarHBondContact O-N 3.44Å; L425-H427 PolarHBondContact O-N 2.84Å; L425-F428 WeakPolarHBondContact O-CB 3.47Å; L425-F428 PolarHBondContact O-N 2.82Å
426	M	46.9	Very low	42.8	Very low	95 Å²	95	65 Å²	65	47%	0.468	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-29.7	179.1	-76.5	-65.9	-65.4	0	0	112.8	M195 L422 F428 N429	M195-M426 HydrophobicContact CE-CG 4.48Å; M195-M426 HydrophobicContact CE-SD 4.18Å; L422-M426 VanDerWaalsContact O-CB 3.25Å; L422-M426 WeakPolarHBondContact O-CB 3.31Å; L422-M426 WeakPolarHBondContact O-CG 3.38Å; L422-M426 PolarHBondContact O-N 3.4Å; M426-F428 PolarHBondContact O-N 3.1Å; M426-N429 PolarHBondContact O-N 3.16Å; M426-N429 VanDerWaalsContact O-N 3.08Å
427	H	42.4	Very low	42.4	Very low	149 Å²	149	68.5 Å²	68.5	69%	0.69	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-55.2	-29.8	170.2	-98	72.8	0	0	0	112.8	D423 L425 N429	D423-H427 PolarHBondContact O-N 3.11Å; D423-H427 PolarHBondContact O-ND1 3.43Å; D423-H427 VanDerWaalsContact O-ND1 3.08Å; L425-H427 PolarHBondContact O-N 2.84Å; H427-N429 PolarHBondContact O-N 2.94Å
428	F	41.1	Very low	42.3	Very low	31 Å²	31	68.4 Å²	68.4	14%	0.136	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-71.4	-14.6	179.5	-146.8	-90.1	0	0	0	113.7	R188 I360 Q364 L425 M426 L443	R188-F428 PolarHBondContact NH2-O 3.49Å; I360-F428 HydrophobicContact CG2-CD2 4.11Å; I360-F428 HydrophobicContact CG2-CE2 3.88Å; Q364-F428 HydrophobicContact CG-CE2 3.8Å; Q364-F428 HydrophobicContact CG-CZ 4.47Å; L425-F428 WeakPolarHBondContact O-CB 3.47Å; L425-F428 PolarHBondContact O-N 2.82Å; M426-F428 PolarHBondContact O-N 3.1Å; F428-L443 HydrophobicContact CE2-CD2 4.38Å; F428-L443 HydrophobicContact CZ-CD2 4.49Å
429	N	42.1	Very low	41.9	Very low	53 Å²	53	68.8 Å²	68.8	28%	0.283	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-114.5	3.9	-163.6	-154	25.7	0	0	0	115.2	A192 M426 H427 S431	A192-N429 WeakPolarHBondContact CB-ND2 3.38Å; A192-N429 WeakPolarHBondContact CB-OD1 3.46Å; M426-N429 PolarHBondContact O-N 3.16Å; M426-N429 VanDerWaalsContact O-N 3.08Å; H427-N429 PolarHBondContact O-N 2.94Å; N429-S431 PolarHBondContact O-N 3.47Å
430	T	39.9	Very low	41.3	Very low	114 Å²	114	71.9 Å²	71.9	70%	0.699	38%	0.383	S	S	*	.			trans	-86	5.3	-168.1	48.6	0	0	0	0	116.6
431	S	39.3	Very low	40.8	Very low	26 Å²	26	69.5 Å²	69.5	18%	0.182	38%	0.378	C	S	.	.			trans	-106.8	127.3	171.1	75.2	0	0	0	0	112.4	R188 N429 D442	R188-S431 PolarHBondContact NH2-OG 3.48Å; N429-S431 PolarHBondContact O-N 3.47Å; S431-D442 VanDerWaalsContact CB-OD1 3.31Å; S431-D442 WeakPolarHBondContact CB-OD1 3.36Å; S431-D442 VanDerWaalsContact CB-OD2 3.3Å; S431-D442 WeakPolarHBondContact CB-OD2 3.13Å; S431-D442 PolarHBondContact OG-OD1 3.44Å; S431-D442 PolarHBondContact OG-OD2 2.66Å
432	S	38.7	Very low	40.3	Very low	133 Å²	133	71.4 Å²	71.4	93%	0.93	39%	0.388	S	S	*	.	S	Bend	trans	-90.3	-8.1	-170.4	52.7	0	0	0	0	115
433	A	38.3	Very low	39.9	Very low	67 Å²	67	72 Å²	72	55%	0.554	39%	0.391	S	S	*	.	S	Bend	trans	-139	119	176.1	0	0	0	0	0	110.2	T435 S438	A433-T435 PolarHBondContact O-N 3.03Å; A433-S438 PolarHBondContact O-OG 3.3Å
434	V	41.6	Very low	39.4	Very low	20 Å²	20	71 Å²	71	12%	0.121	39%	0.388	C	S	.	.			trans	-91.2	101.4	-179.4	-173.8	0	0	0	0	109.7	Q185 L439	Q185-V434 HydrophobicContact CG-CB 4.04Å; Q185-V434 HydrophobicContact CG-CG1 4.44Å; Q185-V434 HydrophobicContact CG-CG2 4.42Å; Q185-V434 PolarHBondContact NE2-O 2.85Å; V434-L439 HydrophobicContact CG1-CB 4.34Å; V434-L439 HydrophobicContact CG1-CD1 3.59Å; V434-L439 HydrophobicContact CG1-CG 4.19Å
435	T	43	Very low	38.7	Very low	72 Å²	72	72.4 Å²	72.4	44%	0.442	40%	0.4	S	S	.	.			trans	-100.7	161.7	161	58.4	0	0	0	0	107.8	A433 D437 S438 L439	A433-T435 PolarHBondContact O-N 3.03Å; T435-D437 PolarHBondContact O-N 3.33Å; T435-S438 PolarHBondContact N-OG 3.49Å; T435-S438 PolarHBondContact O-N 3.26Å; T435-S438 PolarHBondContact O-OG 3.04Å; T435-S438 WeakPolarHBondContact OG1-CB 3.36Å; T435-S438 PolarHBondContact OG1-N 3.29Å; T435-S438 PolarHBondContact OG1-OG 3.37Å; T435-S438 VanDerWaalsContact OG1-OG 3.05Å; T435-L439 WeakPolarHBondContact O-CB 2.85Å; T435-L439 PolarHBondContact O-N 2.86Å
436	W	42.7	Very low	38	Very low	100 Å²	100	75.5 Å²	75.5	38%	0.379	42%	0.422	S	S	.	.	H	α-helix	trans	-55.6	-33.3	174	-78	109.6	0	0	0	111.8	L181 Y440	L181-W436 HydrophobicContact CD1-CZ2 4.2Å; W436-Y440 PolarHBondContact O-N 3.03Å
437	D	38.9	Very low	37	Very low	118 Å²	118	80.7 Å²	80.7	63%	0.631	44%	0.442	S	S	*	.	H	α-helix	trans	-77.8	-38.4	179.4	-55.5	-37.8	0	0	0	113.4	T435 L439 Y440 D441	T435-D437 PolarHBondContact O-N 3.33Å; D437-L439 VanDerWaalsContact C-N 3.29Å; D437-L439 PolarHBondContact O-N 3.27Å; D437-Y440 VanDerWaalsContact O-CB 3.26Å; D437-Y440 WeakPolarHBondContact O-CB 3.42Å; D437-Y440 PolarHBondContact O-N 3.3Å; D437-Y440 VanDerWaalsContact O-N 3.11Å; D437-D441 PolarHBondContact O-N 3.29Å; D437-D441 VanDerWaalsContact O-N 3.16Å
438	S	39	Very low	36.1	Very low	24 Å²	24	78.9 Å²	78.9	17%	0.168	44%	0.436	C	S	.	.	H	α-helix	trans	-72	-25.2	174.6	64.8	0	0	0	0	112.9	A433 T435 Y440 D442	A433-S438 PolarHBondContact O-OG 3.3Å; T435-S438 PolarHBondContact N-OG 3.49Å; T435-S438 PolarHBondContact O-N 3.26Å; T435-S438 PolarHBondContact O-OG 3.04Å; T435-S438 WeakPolarHBondContact OG1-CB 3.36Å; T435-S438 PolarHBondContact OG1-N 3.29Å; T435-S438 PolarHBondContact OG1-OG 3.37Å; T435-S438 VanDerWaalsContact OG1-OG 3.05Å; S438-Y440 VanDerWaalsContact C-N 3.26Å; S438-D442 PolarHBondContact O-N 3.37Å
439	L	35.9	Very low	35.3	Very low	12 Å²	12	83.8 Å²	83.8	6%	0.063	47%	0.468	C	S	.	.	H	α-helix	trans	-66.7	-30.2	169.7	-147	157.4	0	0	0	110.7	Y184 L367 V434 T435 D437 L443	Y184-L439 HydrophobicContact CD1-CD1 4.35Å; Y184-L439 HydrophobicContact CE1-CD1 3.78Å; L367-L439 HydrophobicContact CD1-CD2 4.39Å; V434-L439 HydrophobicContact CG1-CB 4.34Å; V434-L439 HydrophobicContact CG1-CD1 3.59Å; V434-L439 HydrophobicContact CG1-CG 4.19Å; T435-L439 WeakPolarHBondContact O-CB 2.85Å; T435-L439 PolarHBondContact O-N 2.86Å; D437-L439 VanDerWaalsContact C-N 3.29Å; D437-L439 PolarHBondContact O-N 3.27Å; L439-L443 HydrophobicContact CD2-CD1 3.53Å; L439-L443 WeakPolarHBondContact O-CB 3.33Å; L439-L443 VanDerWaalsContact O-CD1 3.27Å; L439-L443 WeakPolarHBondContact O-CD1 3.42Å; L439-L443 WeakPolarHBondContact O-CG 3.27Å
440	Y	36	Very low	34.4	Very low	129 Å²	129	85.9 Å²	85.9	51%	0.506	48%	0.483	S	S	.	.	H	α-helix	trans	-72.7	-48.3	174.7	166.4	-87.2	0	0	0	112.4	W436 D437 S438 D442 L443 V444	W436-Y440 PolarHBondContact O-N 3.03Å; D437-Y440 VanDerWaalsContact O-CB 3.26Å; D437-Y440 WeakPolarHBondContact O-CB 3.42Å; D437-Y440 PolarHBondContact O-N 3.3Å; D437-Y440 VanDerWaalsContact O-N 3.11Å; S438-Y440 VanDerWaalsContact C-N 3.26Å; Y440-D442 PolarHBondContact O-N 3.03Å; Y440-L443 PolarHBondContact O-N 2.96Å; Y440-V444 HydrophobicContact CD2-CG2 3.84Å; Y440-V444 HydrophobicContact CE2-CG2 3.83Å; Y440-V444 HydrophobicContact CG-CG2 4.29Å; Y440-V444 VanDerWaalsContact O-CG2 3.28Å; Y440-V444 WeakPolarHBondContact O-CG2 3.19Å; Y440-V444 PolarHBondContact O-N 3Å; Y440-V444 VanDerWaalsContact O-N 3.13Å
441	D	34.7	Very low	33.6	Very low	103 Å²	103	86.1 Å²	86.1	55%	0.551	49%	0.488	S	S	*	.	H	α-helix	trans	-64.6	-38.5	-178.8	-79.3	-23.5	0	0	0	113.1	D437 L443	D437-D441 PolarHBondContact O-N 3.29Å; D437-D441 VanDerWaalsContact O-N 3.16Å; D441-L443 PolarHBondContact O-N 3.44Å
442	D	32.7	Very low	32.9	Very low	52 Å²	52	90 Å²	90	28%	0.278	51%	0.51	S	S	.	.	H	α-helix	trans	-60.9	-31.1	175.8	-82.1	-5.1	0	0	0	113	R188 S431 S438 Y440	R188-D442 IonicContact CZ-OD2 3.68Å; R188-D442 IonicContact NH1-OD2 2.81Å; R188-D442 IonicContact NH2-OD2 3.85Å; R188-D442 PolarHBondContact NH2-OD2 2.93Å; S431-D442 VanDerWaalsContact CB-OD1 3.31Å; S431-D442 WeakPolarHBondContact CB-OD1 3.36Å; S431-D442 VanDerWaalsContact CB-OD2 3.3Å; S431-D442 WeakPolarHBondContact CB-OD2 3.13Å; S431-D442 PolarHBondContact OG-OD1 3.44Å; S431-D442 PolarHBondContact OG-OD2 2.66Å; S438-D442 PolarHBondContact O-N 3.37Å; Y440-D442 PolarHBondContact O-N 3.03Å
443	L	36	Very low	32.2	Very low	29 Å²	29	93.1 Å²	93.1	15%	0.152	51%	0.507	C	S	.	.	H	α-helix	trans	-105.7	-23.8	-164.5	-66.1	-177.9	0	0	0	114.4	Q364 L367 F428 L439 Y440 D441	Q364-L443 HydrophobicContact CG-CD2 4.13Å; L367-L443 HydrophobicContact CB-CD1 4.32Å; L367-L443 HydrophobicContact CD1-CD1 4.02Å; F428-L443 HydrophobicContact CE2-CD2 4.38Å; F428-L443 HydrophobicContact CZ-CD2 4.49Å; L439-L443 HydrophobicContact CD2-CD1 3.53Å; L439-L443 WeakPolarHBondContact O-CB 3.33Å; L439-L443 VanDerWaalsContact O-CD1 3.27Å; L439-L443 WeakPolarHBondContact O-CD1 3.42Å; L439-L443 WeakPolarHBondContact O-CG 3.27Å; Y440-L443 PolarHBondContact O-N 2.96Å; D441-L443 PolarHBondContact O-N 3.44Å
444	V	34	Very low	31.8	Very low	75 Å²	75	94.6 Å²	94.6	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-88.8	-32	-172	173.4	0	0	0	0	113.4	Y440	Y440-V444 HydrophobicContact CD2-CG2 3.84Å; Y440-V444 HydrophobicContact CE2-CG2 3.83Å; Y440-V444 HydrophobicContact CG-CG2 4.29Å; Y440-V444 VanDerWaalsContact O-CG2 3.28Å; Y440-V444 WeakPolarHBondContact O-CG2 3.19Å; Y440-V444 PolarHBondContact O-N 3Å; Y440-V444 VanDerWaalsContact O-N 3.13Å
445	V	27.6	Very low	31.1	Very low	114 Å²	114	97 Å²	97	69%	0.691	52%	0.522	S	S	*	.	S	Bend	trans	-79.2	-24.5	-166.6	-178	0	0	0	0	113.7	K447	V445-K447 PolarHBondContact O-N 3.37Å
446	S	28	Very low	30.6	Very low	70 Å²	70	99.2 Å²	99.2	49%	0.49	53%	0.53	S	S	.	.			trans	-86.2	81.6	-172.1	59	0	0	0	0	113.9	I448	S446-I448 PolarHBondContact O-N 3.34Å
447	K	26.3	Very low	30.6	Very low	204 Å²	204	100.3 Å²	100.3	89%	0.887	54%	0.535	S	S	*	.			trans	-63.3	103.9	175.1	-66	175.8	178.2	175.5	0	112.6	V445	V445-K447 PolarHBondContact O-N 3.37Å
448	I	23.6	Very low	30.7	Very low	111 Å²	111	95.9 Å²	95.9	57%	0.569	51%	0.511	S	S	*	.			trans	-120.8	114.6	172.8	-60	179.3	0	0	0	112.3	S446	S446-I448 PolarHBondContact O-N 3.34Å
449	V	22.3	Very low	30.8	Very low	133 Å²	133	97.8 Å²	97.8	81%	0.806	53%	0.525	S	S	*	.			trans	-76.7	136	176.4	176.1	0	0	0	0	111.2
450	V	25	Very low	31.1	Very low	97 Å²	97	100.5 Å²	100.5	59%	0.588	54%	0.542	S	S	*	.			trans	-92.8	120.2	-176.1	171.3	0	0	0	0	110.9	V452	V450-V452 HydrophobicContact CG1-CG2 3.72Å
451	C	21.5	Very low	31.5	Very low	120 Å²	120	94.9 Å²	94.9	81%	0.811	52%	0.52	S	S	*	.			trans	-105	97.8	168.3	-68.2	0	0	0	0	110.1
452	V	26.3	Very low	32.1	Very low	106 Å²	106	94.5 Å²	94.5	64%	0.642	52%	0.515	S	S	*	.			trans	-98.6	100.9	167.4	179.5	0	0	0	0	108	V450 L540	V450-V452 HydrophobicContact CG1-CG2 3.72Å; V452-L540 HydrophobicContact CB-CD1 4.31Å
453	K	22.9	Very low	33	Very low	200 Å²	200	95 Å²	95	87%	0.87	52%	0.523	S	S	*	.			trans	-129	82.6	168.7	-77.4	-171.5	176.7	-177.9	0	109
454	N	30.5	Very low	33.5	Very low	98 Å²	98	98.5 Å²	98.5	52%	0.524	54%	0.538	S	S	.	.			trans	-152.3	102.6	155.3	-147.9	-24.5	0	0	0	113.8	L456	N454-L456 VanDerWaalsContact C-N 3.28Å; N454-L456 PolarHBondContact O-N 2.87Å
455	P	27.3	Very low	34.3	Very low	71 Å²	71	95 Å²	95	46%	0.461	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15	179.6	-21.7	33.1	0	0	0	116.2	Y457 Y543	P455-Y457 PolarHBondContact O-N 3.38Å; P455-Y543 HydrophobicContact CB-CE1 4.43Å
456	L	31.2	Very low	35.4	Very low	118 Å²	118	92.4 Å²	92.4	62%	0.618	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-38.6	-170.3	-72.8	167.5	0	0	0	113.7	N454 I458 S459 T460	N454-L456 VanDerWaalsContact C-N 3.28Å; N454-L456 PolarHBondContact O-N 2.87Å; L456-I458 PolarHBondContact O-N 2.91Å; L456-S459 PolarHBondContact O-N 3.15Å; L456-S459 PolarHBondContact O-OG 3.3Å; L456-T460 PolarHBondContact O-N 3.19Å; L456-T460 PolarHBondContact O-OG1 2.76Å
457	Y	43.2	Very low	36.4	Very low	123 Å²	123	93.4 Å²	93.4	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-35.7	-176	-178.6	-113.8	0	0	0	113.5	P455 T460 L461 Y547	P455-Y457 PolarHBondContact O-N 3.38Å; Y457-T460 PolarHBondContact O-N 3.43Å; Y457-L461 HydrophobicContact CD1-CD1 3.96Å; Y457-L461 HydrophobicContact CE1-CD1 3.6Å; Y457-L461 HydrophobicContact CE1-CG 4.46Å; Y457-L461 PolarHBondContact O-N 3.16Å; Y457-Y547 HydrophobicContact CE1-CD2 4.04Å; Y457-Y547 AromaticContact CE1-CE2 3.6Å; Y457-Y547 HydrophobicContact CE1-CE2 3.6Å
458	I	40.2	Very low	37.4	Very low	25 Å²	25	86.3 Å²	86.3	13%	0.128	48%	0.481	C	S	.	.	H	α-helix	trans	-68.9	-37.6	177.6	-67.8	171.1	0	0	0	110.8	L456 T460 L461 Q462 Y543 T546	L456-I458 PolarHBondContact O-N 2.91Å; I458-T460 VanDerWaalsContact C-N 3.25Å; I458-T460 PolarHBondContact O-N 3.48Å; I458-L461 PolarHBondContact O-N 3.11Å; I458-Q462 WeakPolarHBondContact O-CB 3.37Å; I458-Q462 PolarHBondContact O-N 3.36Å; I458-Y543 HydrophobicContact CD1-CD1 3.37Å; I458-Y543 HydrophobicContact CD1-CE1 4.27Å; I458-Y543 HydrophobicContact CD1-CG 3.93Å; I458-Y543 VanDerWaalsContact CD1-O 3.28Å; I458-Y543 WeakPolarHBondContact CD1-O 3.13Å; I458-T546 HydrophobicContact CG2-CG2 3.59Å
459	S	41.3	Very low	38.7	Very low	64 Å²	64	85.8 Å²	85.8	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-61.3	-36.1	176.2	76.3	0	0	0	0	112.1	L456 S463	L456-S459 PolarHBondContact O-N 3.15Å; L456-S459 PolarHBondContact O-OG 3.3Å; S459-S463 WeakPolarHBondContact O-CB 3.5Å; S459-S463 PolarHBondContact O-N 2.95Å
460	T	42.9	Very low	39.9	Very low	68 Å²	68	86.4 Å²	86.4	42%	0.417	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-48.1	176.1	-41.9	0	0	0	0	111.5	L456 Y457 I458 Q462 S463 Q464	L456-T460 PolarHBondContact O-N 3.19Å; L456-T460 PolarHBondContact O-OG1 2.76Å; Y457-T460 PolarHBondContact O-N 3.43Å; I458-T460 VanDerWaalsContact C-N 3.25Å; I458-T460 PolarHBondContact O-N 3.48Å; T460-Q462 VanDerWaalsContact C-N 3.34Å; T460-Q462 PolarHBondContact O-N 3.41Å; T460-S463 PolarHBondContact O-N 3.45Å; T460-S463 PolarHBondContact O-OG 3.05Å; T460-Q464 WeakPolarHBondContact O-CG 3.21Å; T460-Q464 PolarHBondContact O-N 3.42Å
461	L	44.1	Very low	40.9	Very low	11 Å²	11	91.2 Å²	91.2	6%	0.058	49%	0.485	C	S	.	.	H	α-helix	trans	-60.5	-42.7	176.8	-72.9	167.7	0	0	0	112.2	Y457 I458 S463 Q464 A465 Y547 F550 L554	Y457-L461 HydrophobicContact CD1-CD1 3.96Å; Y457-L461 HydrophobicContact CE1-CD1 3.6Å; Y457-L461 HydrophobicContact CE1-CG 4.46Å; Y457-L461 PolarHBondContact O-N 3.16Å; I458-L461 PolarHBondContact O-N 3.11Å; L461-S463 VanDerWaalsContact C-N 3.35Å; L461-S463 PolarHBondContact O-N 3.37Å; L461-Q464 PolarHBondContact O-N 3.11Å; L461-A465 WeakPolarHBondContact O-CB 3.21Å; L461-A465 PolarHBondContact O-N 3.41Å; L461-Y547 HydrophobicContact CD1-CD2 3.42Å; L461-Y547 VanDerWaalsContact CD1-CD2 3.42Å; L461-Y547 HydrophobicContact CD1-CE2 3.64Å; L461-F550 HydrophobicContact CB-CB 4.15Å; L461-L554 HydrophobicContact CD2-CD1 3.45Å; L461-L554 VanDerWaalsContact CD2-CD1 3.45Å
462	Q	48.3	Very low	42	Very low	96 Å²	96	92.7 Å²	92.7	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-40.6	176.2	-176.1	171	9.3	0	0	111.5	I458 T460 S466 F550	I458-Q462 WeakPolarHBondContact O-CB 3.37Å; I458-Q462 PolarHBondContact O-N 3.36Å; T460-Q462 VanDerWaalsContact C-N 3.34Å; T460-Q462 PolarHBondContact O-N 3.41Å; Q462-S466 VanDerWaalsContact O-CB 3.24Å; Q462-S466 WeakPolarHBondContact O-CB 3.11Å; Q462-S466 PolarHBondContact O-N 3.02Å; Q462-S466 PolarHBondContact O-OG 3.39Å; Q462-F550 HydrophobicContact CB-CD2 4.15Å; Q462-F550 HydrophobicContact CB-CE2 3.74Å; Q462-F550 HydrophobicContact CB-CZ 4.02Å; Q462-F550 HydrophobicContact CG-CE1 4.34Å; Q462-F550 HydrophobicContact CG-CE2 3.75Å; Q462-F550 HydrophobicContact CG-CZ 3.61Å
463	S	50.7	Low	42.9	Very low	62 Å²	62	90.4 Å²	90.4	43%	0.434	47%	0.469	S	S	.	.	H	α-helix	trans	-65.7	-41.1	176.6	74.3	0	0	0	0	112.8	S459 T460 L461 S466 C467	S459-S463 WeakPolarHBondContact O-CB 3.5Å; S459-S463 PolarHBondContact O-N 2.95Å; T460-S463 PolarHBondContact O-N 3.45Å; T460-S463 PolarHBondContact O-OG 3.05Å; L461-S463 VanDerWaalsContact C-N 3.35Å; L461-S463 PolarHBondContact O-N 3.37Å; S463-S466 WeakPolarHBondContact O-CB 3.48Å; S463-S466 PolarHBondContact O-N 2.89Å; S463-C467 PolarHBondContact O-N 3.47Å; S463-C467 PolarHBondContact O-SG 3.34Å; S463-C467 VanDerWaalsContact O-SG 3.4Å
464	Q	45.7	Very low	43.8	Very low	103 Å²	103	85.2 Å²	85.2	48%	0.481	46%	0.456	S	S	.	.	H	α-helix	trans	-68.1	-42.5	178.2	-73.1	179.1	-18.5	0	0	111.7	T460 L461 C467	T460-Q464 WeakPolarHBondContact O-CG 3.21Å; T460-Q464 PolarHBondContact O-N 3.42Å; L461-Q464 PolarHBondContact O-N 3.11Å; Q464-C467 PolarHBondContact O-N 3.08Å
465	A	50.7	Low	44.1	Very low	0 Å²	0	90.2 Å²	90.2	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-64.9	-41.8	173.2	0	0	0	0	0	111.3	L461 C467 L468 F469 F550	L461-A465 WeakPolarHBondContact O-CB 3.21Å; L461-A465 PolarHBondContact O-N 3.41Å; A465-C467 PolarHBondContact O-N 3.48Å; A465-C467 VanDerWaalsContact O-N 3.16Å; A465-L468 WeakPolarHBondContact O-CB 3.43Å; A465-L468 PolarHBondContact O-N 2.76Å; A465-F469 HydrophobicContact CB-CE2 4.28Å; A465-F469 WeakPolarHBondContact O-CD2 3.45Å; A465-F469 WeakPolarHBondContact O-CE2 3.44Å; A465-F550 HydrophobicContact CB-CB 4.48Å; A465-F550 HydrophobicContact CB-CD1 3.28Å; A465-F550 HydrophobicContact CB-CE1 3.81Å; A465-F550 HydrophobicContact CB-CG 4.2Å
466	S	51.7	Low	44.9	Very low	61 Å²	61	89.9 Å²	89.9	43%	0.427	49%	0.485	S	S	.	.	H	α-helix	trans	-54	-34.1	178.4	-65.2	0	0	0	0	113	Q462 S463 L468 F469	Q462-S466 VanDerWaalsContact O-CB 3.24Å; Q462-S466 WeakPolarHBondContact O-CB 3.11Å; Q462-S466 PolarHBondContact O-N 3.02Å; Q462-S466 PolarHBondContact O-OG 3.39Å; S463-S466 WeakPolarHBondContact O-CB 3.48Å; S463-S466 PolarHBondContact O-N 2.89Å; S466-L468 VanDerWaalsContact C-N 3.25Å; S466-L468 PolarHBondContact O-N 3.23Å; S466-F469 VanDerWaalsContact CA-CD2 3.47Å; S466-F469 PolarHBondContact O-N 3.26Å
467	C	49.9	Very low	45.4	Very low	90 Å²	90	86.7 Å²	86.7	61%	0.608	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-62.4	-27.5	175.3	-67.2	0	0	0	0	113.8	S463 Q464 A465 F469	S463-C467 PolarHBondContact O-N 3.47Å; S463-C467 PolarHBondContact O-SG 3.34Å; S463-C467 VanDerWaalsContact O-SG 3.4Å; Q464-C467 PolarHBondContact O-N 3.08Å; A465-C467 PolarHBondContact O-N 3.48Å; A465-C467 VanDerWaalsContact O-N 3.16Å; C467-F469 PolarHBondContact O-N 3.29Å
468	L	46.8	Very low	45.6	Very low	55 Å²	55	88 Å²	88	29%	0.288	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-77.6	-5	178.8	-65.6	166.8	0	0	0	113.3	A465 S466 L473 V553	A465-L468 WeakPolarHBondContact O-CB 3.43Å; A465-L468 PolarHBondContact O-N 2.76Å; S466-L468 VanDerWaalsContact C-N 3.25Å; S466-L468 PolarHBondContact O-N 3.23Å; L468-L473 WeakPolarHBondContact O-CD1 3.31Å; L468-V553 HydrophobicContact CD1-CG1 3.98Å
469	F	50.2	Low	45.9	Very low	100 Å²	100	91.5 Å²	91.5	44%	0.439	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-100.7	1.5	-176.6	-63	-87.7	0	0	0	114.7	A465 S466 C467 E471 L488	A465-F469 HydrophobicContact CB-CE2 4.28Å; A465-F469 WeakPolarHBondContact O-CD2 3.45Å; A465-F469 WeakPolarHBondContact O-CE2 3.44Å; S466-F469 VanDerWaalsContact CA-CD2 3.47Å; S466-F469 PolarHBondContact O-N 3.26Å; C467-F469 PolarHBondContact O-N 3.29Å; F469-E471 PolarHBondContact O-N 2.94Å; F469-L488 HydrophobicContact CE1-CD1 3.37Å; F469-L488 HydrophobicContact CZ-CD1 3.55Å; F469-L488 HydrophobicContact CZ-CD2 4.41Å
470	Q	48.5	Very low	45.8	Very low	146 Å²	146	89.6 Å²	89.6	68%	0.682	49%	0.488	S	S	*	.	S	Bend	trans	-63.5	137.4	174.1	-69	-171.4	-7.6	0	0	109.7	N472 L473	Q470-N472 CarbonylContact O-C 3.58Å; Q470-N472 PolarHBondContact O-N 2.8Å; Q470-L473 PolarHBondContact O-N 3.41Å
471	E	44.8	Very low	46.1	Very low	199 Å²	199	92.4 Å²	92.4	93%	0.93	50%	0.496	S	S	*	.	S	Bend	trans	-53.6	-21.2	-173.8	-72.4	-176.8	155.2	0	0	114.2	F469 L473	F469-E471 PolarHBondContact O-N 2.94Å; E471-L473 PolarHBondContact O-N 2.96Å
472	N	45	Very low	46.4	Very low	151 Å²	151	95.8 Å²	95.8	81%	0.807	52%	0.519	S	S	*	.			trans	-97.5	69.2	175.2	-64.5	-28.4	0	0	0	111.3	Q470	Q470-N472 CarbonylContact O-C 3.58Å; Q470-N472 PolarHBondContact O-N 2.8Å
473	L	45.6	Very low	46.4	Very low	58 Å²	58	94.5 Å²	94.5	30%	0.304	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-61.7	138.2	166.9	-93.9	100.3	0	0	0	109.6	L468 Q470 E471 E475 L477	L468-L473 WeakPolarHBondContact O-CD1 3.31Å; Q470-L473 PolarHBondContact O-N 3.41Å; E471-L473 PolarHBondContact O-N 2.96Å; L473-E475 PolarHBondContact O-N 3.29Å; L473-L477 HydrophobicContact CD2-CB 3.58Å; L473-L477 HydrophobicContact CD2-CD1 4.16Å
474	P	40.6	Very low	46.4	Very low	91 Å²	91	92.8 Å²	92.8	59%	0.591	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-53.9	136.8	172.5	-23.4	29.9	0	0	0	112.2	G476 L477	P474-G476 PolarHBondContact O-N 3.32Å; P474-L477 HydrophobicContact CG-CD1 4.36Å; P474-L477 PolarHBondContact O-N 2.78Å
475	E	36.7	Very low	46.9	Very low	203 Å²	203	94.2 Å²	94.2	95%	0.949	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	122.2	174.9	-74.9	-177.1	163.3	0	0	110.4	L473	L473-E475 PolarHBondContact O-N 3.29Å
476	G	44.4	Very low	47.1	Very low	63 Å²	63	99.2 Å²	99.2	65%	0.649	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.3	-21.2	-175.7	0	0	0	0	0	114.7	P474 P479	P474-G476 PolarHBondContact O-N 3.32Å; G476-P479 WeakPolarHBondContact O-CD 3.41Å
477	L	42.1	Very low	47.1	Very low	51 Å²	51	98.5 Å²	98.5	27%	0.267	52%	0.523	S	S	.	.			trans	-97.4	-3.7	178.9	-60.9	173.3	0	0	0	113.9	L473 P474 P479 I480	L473-L477 HydrophobicContact CD2-CB 3.58Å; L473-L477 HydrophobicContact CD2-CD1 4.16Å; P474-L477 HydrophobicContact CG-CD1 4.36Å; P474-L477 PolarHBondContact O-N 2.78Å; L477-P479 VanDerWaalsContact C-N 3.33Å; L477-I480 HydrophobicContact CB-CD1 3.94Å; L477-I480 HydrophobicContact CD2-CD1 3.29Å; L477-I480 HydrophobicContact CG-CD1 4.17Å; L477-I480 VanDerWaalsContact O-CB 3.29Å; L477-I480 WeakPolarHBondContact O-CB 3.42Å; L477-I480 PolarHBondContact O-N 3.4Å
478	E	46.9	Very low	47.3	Very low	151 Å²	151	95.9 Å²	95.9	71%	0.706	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-50.4	-40.2	174.5	-74.1	-170.3	157.9	0	0	114.6	I480 Q481	E478-I480 PolarHBondContact O-N 3.02Å; E478-I480 VanDerWaalsContact O-N 3.12Å; E478-Q481 PolarHBondContact O-N 3.34Å
479	P	46.3	Very low	47.9	Very low	98 Å²	98	97.2 Å²	97.2	64%	0.636	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-64.4	-18.5	179.5	-20.5	32.8	0	0	0	114	G476 L477 P482	G476-P479 WeakPolarHBondContact O-CD 3.41Å; L477-P479 VanDerWaalsContact C-N 3.33Å; P479-P482 WeakPolarHBondContact O-CD 3.35Å; P479-P482 WeakPolarHBondContact O-CG 3.21Å
480	I	41	Very low	48.2	Very low	25 Å²	25	95.2 Å²	95.2	13%	0.128	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-79.1	-28.3	-178.8	-57.4	169.8	0	0	0	111.4	L477 E478 P482 V483 V484 L560	L477-I480 HydrophobicContact CB-CD1 3.94Å; L477-I480 HydrophobicContact CD2-CD1 3.29Å; L477-I480 HydrophobicContact CG-CD1 4.17Å; L477-I480 VanDerWaalsContact O-CB 3.29Å; L477-I480 WeakPolarHBondContact O-CB 3.42Å; L477-I480 PolarHBondContact O-N 3.4Å; E478-I480 PolarHBondContact O-N 3.02Å; E478-I480 VanDerWaalsContact O-N 3.12Å; I480-P482 VanDerWaalsContact C-CD 3.48Å; I480-P482 VanDerWaalsContact C-N 3.32Å; I480-P482 VanDerWaalsContact O-N 3.14Å; I480-V483 PolarHBondContact O-N 3.36Å; I480-V484 HydrophobicContact CG2-CB 4.09Å; I480-V484 HydrophobicContact CG2-CG2 3.3Å; I480-V484 PolarHBondContact O-N 3.48Å; I480-L560 HydrophobicContact CD1-CD1 3.12Å; I480-L560 HydrophobicContact CD1-CG 4.49Å; I480-L560 HydrophobicContact CG1-CD1 3.3Å
481	Q	48.3	Very low	48.6	Very low	127 Å²	127	89.5 Å²	89.5	59%	0.593	48%	0.475	S	S	*	.	H	α-helix	trans	-45.1	-48.6	-176.6	-101	-173.4	-10.4	0	0	113.5	E478 V483 K485	E478-Q481 PolarHBondContact O-N 3.34Å; Q481-V483 PolarHBondContact O-N 2.95Å; Q481-K485 WeakPolarHBondContact O-CB 3.45Å; Q481-K485 PolarHBondContact O-N 3.48Å
482	P	50.8	Low	49.4	Very low	82 Å²	82	82.5 Å²	82.5	53%	0.532	45%	0.448	S	S	.	.	H	α-helix	trans	-66	-36	178.7	22.4	-32.5	0	0	0	114.1	P479 I480 Q486	P479-P482 WeakPolarHBondContact O-CD 3.35Å; P479-P482 WeakPolarHBondContact O-CG 3.21Å; I480-P482 VanDerWaalsContact C-CD 3.48Å; I480-P482 VanDerWaalsContact C-N 3.32Å; I480-P482 VanDerWaalsContact O-N 3.14Å; P482-Q486 WeakPolarHBondContact O-CB 3.3Å; P482-Q486 PolarHBondContact O-N 2.82Å
483	V	48.8	Very low	50.3	Low	69 Å²	69	79 Å²	79	42%	0.418	43%	0.427	S	S	.	.	H	α-helix	trans	-74.2	-46.8	-178.9	179.8	0	0	0	0	110.9	I480 Q481 K485 Q486 I487	I480-V483 PolarHBondContact O-N 3.36Å; Q481-V483 PolarHBondContact O-N 2.95Å; V483-K485 VanDerWaalsContact C-N 3.3Å; V483-K485 PolarHBondContact O-N 2.89Å; V483-Q486 PolarHBondContact O-N 2.99Å; V483-I487 HydrophobicContact CG1-CD1 4.17Å; V483-I487 WeakPolarHBondContact O-CG1 3.48Å; V483-I487 PolarHBondContact O-N 2.96Å
484	V	49.2	Very low	50.9	Low	25 Å²	25	76.8 Å²	76.8	15%	0.152	42%	0.416	C	S	.	.	H	α-helix	trans	-61.8	-41.9	173.4	162.1	0	0	0	0	110.3	I480 Q486 I487 L488 V553	I480-V484 HydrophobicContact CG2-CB 4.09Å; I480-V484 HydrophobicContact CG2-CG2 3.3Å; I480-V484 PolarHBondContact O-N 3.48Å; V484-Q486 PolarHBondContact O-N 3.28Å; V484-I487 PolarHBondContact O-N 3.2Å; V484-L488 HydrophobicContact CG1-CD1 3.62Å; V484-L488 HydrophobicContact CG1-CG 4.39Å; V484-L488 WeakPolarHBondContact O-CB 3.43Å; V484-L488 WeakPolarHBondContact O-CD1 2.95Å; V484-L488 VanDerWaalsContact O-CG 3.22Å; V484-L488 WeakPolarHBondContact O-CG 3.38Å; V484-L488 PolarHBondContact O-N 3.49Å; V484-V553 HydrophobicContact CG1-CG2 4.3Å
485	K	56.5	Low	51.9	Low	133 Å²	133	74.5 Å²	74.5	58%	0.578	40%	0.398	S	S	*	.	H	α-helix	trans	-59.8	-44.5	173.4	-176.2	177	179.8	-179.8	0	111.7	Q481 V483 L488 D489	Q481-K485 WeakPolarHBondContact O-CB 3.45Å; Q481-K485 PolarHBondContact O-N 3.48Å; V483-K485 VanDerWaalsContact C-N 3.3Å; V483-K485 PolarHBondContact O-N 2.89Å; K485-L488 CarbonylContact O-C 3.55Å; K485-L488 PolarHBondContact O-N 2.9Å; K485-D489 VanDerWaalsContact O-CB 3.32Å; K485-D489 WeakPolarHBondContact O-CB 3.32Å; K485-D489 PolarHBondContact O-N 2.75Å
486	Q	55.9	Low	53.2	Low	105 Å²	105	68.4 Å²	68.4	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-44.2	177.9	-174.5	-177.6	7.8	0	0	112.6	P482 V483 V484 L488 D489 Q490	P482-Q486 WeakPolarHBondContact O-CB 3.3Å; P482-Q486 PolarHBondContact O-N 2.82Å; V483-Q486 PolarHBondContact O-N 2.99Å; V484-Q486 PolarHBondContact O-N 3.28Å; Q486-L488 VanDerWaalsContact C-N 3.3Å; Q486-L488 PolarHBondContact O-N 2.88Å; Q486-D489 PolarHBondContact O-N 3.47Å; Q486-Q490 WeakPolarHBondContact O-CG 3.39Å; Q486-Q490 PolarHBondContact O-N 2.68Å
487	I	50.7	Low	54.1	Low	46 Å²	46	65.7 Å²	65.7	24%	0.236	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-41.3	176.9	-67.4	168.9	0	0	0	110.2	V483 V484 Q490 Y491	V483-I487 HydrophobicContact CG1-CD1 4.17Å; V483-I487 WeakPolarHBondContact O-CG1 3.48Å; V483-I487 PolarHBondContact O-N 2.96Å; V484-I487 PolarHBondContact O-N 3.2Å; I487-Q490 PolarHBondContact O-N 3.08Å; I487-Y491 WeakPolarHBondContact O-CB 3.25Å; I487-Y491 PolarHBondContact O-N 3.36Å
488	L	54.6	Low	54.9	Low	35 Å²	35	63.3 Å²	63.3	18%	0.183	33%	0.332	C	S	.	.	H	α-helix	trans	-72.6	-32.2	176.9	-69.3	168.1	0	0	0	113.2	F469 V484 K485 Q486 Y491 S492 V553	F469-L488 HydrophobicContact CE1-CD1 3.37Å; F469-L488 HydrophobicContact CZ-CD1 3.55Å; F469-L488 HydrophobicContact CZ-CD2 4.41Å; V484-L488 HydrophobicContact CG1-CD1 3.62Å; V484-L488 HydrophobicContact CG1-CG 4.39Å; V484-L488 WeakPolarHBondContact O-CB 3.43Å; V484-L488 WeakPolarHBondContact O-CD1 2.95Å; V484-L488 VanDerWaalsContact O-CG 3.22Å; V484-L488 WeakPolarHBondContact O-CG 3.38Å; V484-L488 PolarHBondContact O-N 3.49Å; K485-L488 CarbonylContact O-C 3.55Å; K485-L488 PolarHBondContact O-N 2.9Å; Q486-L488 VanDerWaalsContact C-N 3.3Å; Q486-L488 PolarHBondContact O-N 2.88Å; L488-Y491 PolarHBondContact O-N 3.4Å; L488-S492 VanDerWaalsContact O-CB 3.24Å; L488-S492 WeakPolarHBondContact O-CB 3.01Å; L488-S492 PolarHBondContact O-N 2.74Å; L488-S492 PolarHBondContact O-OG 3.31Å; L488-V553 HydrophobicContact CD2-CG2 4.37Å; L488-V553 HydrophobicContact CG-CG2 4.46Å
489	D	59.1	Low	55.8	Low	83 Å²	83	59.1 Å²	59.1	44%	0.444	32%	0.315	S	S	.	.	H	α-helix	trans	-67	-41.8	173.6	-72.6	-15.6	0	0	0	109.8	K485 Q486 S492 M493	K485-D489 VanDerWaalsContact O-CB 3.32Å; K485-D489 WeakPolarHBondContact O-CB 3.32Å; K485-D489 PolarHBondContact O-N 2.75Å; Q486-D489 PolarHBondContact O-N 3.47Å; D489-S492 WeakPolarHBondContact CA-OG 3.38Å; D489-S492 PolarHBondContact O-OG 3.46Å; D489-M493 VanDerWaalsContact O-CB 3.31Å; D489-M493 WeakPolarHBondContact O-CB 3.38Å; D489-M493 PolarHBondContact O-N 3.12Å
490	Q	56.1	Low	56.6	Low	59 Å²	59	57.7 Å²	57.7	28%	0.276	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-42.1	172.8	-71.2	-178.7	-0.7	0	0	112.2	Q486 I487 L494 L765	Q486-Q490 WeakPolarHBondContact O-CG 3.39Å; Q486-Q490 PolarHBondContact O-N 2.68Å; I487-Q490 PolarHBondContact O-N 3.08Å; Q490-L494 WeakPolarHBondContact O-CB 3.43Å; Q490-L494 PolarHBondContact O-N 2.82Å; Q490-L765 HydrophobicContact CB-CD2 3.97Å; Q490-L765 HydrophobicContact CG-CD2 3.8Å
491	Y	57.7	Low	57.5	Low	25 Å²	25	56.6 Å²	56.6	10%	0.098	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-47.7	175.7	168.8	-105.2	0	0	0	112.2	I487 L488 M493 L494 E495 A545 T546 A549	I487-Y491 WeakPolarHBondContact O-CB 3.25Å; I487-Y491 PolarHBondContact O-N 3.36Å; L488-Y491 PolarHBondContact O-N 3.4Å; Y491-M493 VanDerWaalsContact C-N 3.28Å; Y491-M493 PolarHBondContact O-N 3.44Å; Y491-L494 CarbonylContact O-C 3.24Å; Y491-L494 WeakPolarHBondContact O-CB 3.34Å; Y491-L494 PolarHBondContact O-N 2.79Å; Y491-L494 VanDerWaalsContact O-N 3.08Å; Y491-E495 HydrophobicContact CE1-CB 4.27Å; Y491-E495 WeakPolarHBondContact CE1-OE2 3.23Å; Y491-E495 HydrophobicContact CE2-CB 4.21Å; Y491-E495 WeakPolarHBondContact O-CB 3.4Å; Y491-E495 PolarHBondContact O-N 3Å; Y491-E495 PolarHBondContact OH-OE2 3.23Å; Y491-A545 HydrophobicContact CD2-CB 4.46Å; Y491-A545 WeakPolarHBondContact CD2-O 3.42Å; Y491-A545 VanDerWaalsContact CE2-C 3.43Å; Y491-A545 HydrophobicContact CE2-CB 4.14Å; Y491-A545 WeakPolarHBondContact CE2-O 3.23Å; Y491-T546 VanDerWaalsContact CE2-CA 3.45Å; Y491-T546 PolarHBondContact OH-OG1 3.06Å; Y491-A549 HydrophobicContact CD1-CB 3.87Å; Y491-A549 HydrophobicContact CD2-CB 3.37Å; Y491-A549 HydrophobicContact CE1-CB 4.45Å; Y491-A549 HydrophobicContact CE2-CB 4.02Å; Y491-A549 HydrophobicContact CG-CB 3.26Å
492	S	61	Low	58.2	Low	52 Å²	52	51.3 Å²	51.3	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-37.5	179.7	57.8	0	0	0	0	111.1	L488 D489 T496	L488-S492 VanDerWaalsContact O-CB 3.24Å; L488-S492 WeakPolarHBondContact O-CB 3.01Å; L488-S492 PolarHBondContact O-N 2.74Å; L488-S492 PolarHBondContact O-OG 3.31Å; D489-S492 WeakPolarHBondContact CA-OG 3.38Å; D489-S492 PolarHBondContact O-OG 3.46Å; S492-T496 VanDerWaalsContact O-CB 3.27Å; S492-T496 WeakPolarHBondContact O-CB 3.39Å; S492-T496 PolarHBondContact O-N 2.98Å; S492-T496 PolarHBondContact O-OG1 3.42Å
493	M	63.1	Low	58.8	Low	77 Å²	77	50.2 Å²	50.2	38%	0.379	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-48.4	170.1	-173.5	-171.7	-67.7	0	0	111.2	D489 Y491 T496 V497 L765	D489-M493 VanDerWaalsContact O-CB 3.31Å; D489-M493 WeakPolarHBondContact O-CB 3.38Å; D489-M493 PolarHBondContact O-N 3.12Å; Y491-M493 VanDerWaalsContact C-N 3.28Å; Y491-M493 PolarHBondContact O-N 3.44Å; M493-T496 PolarHBondContact O-N 3.28Å; M493-V497 VanDerWaalsContact O-CG2 3.32Å; M493-V497 WeakPolarHBondContact O-CG2 3.47Å; M493-V497 PolarHBondContact O-N 2.87Å; M493-L765 HydrophobicContact SD-CD2 4.31Å; M493-L765 HydrophobicContact SD-CG 4.25Å
494	L	58.5	Low	59.3	Low	12 Å²	12	47.2 Å²	47.2	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-65.1	-43.2	178.7	-175.1	68.5	0	0	0	112.5	Q490 Y491 V497 I498 A545 F582 L585 M762	Q490-L494 WeakPolarHBondContact O-CB 3.43Å; Q490-L494 PolarHBondContact O-N 2.82Å; Y491-L494 CarbonylContact O-C 3.24Å; Y491-L494 WeakPolarHBondContact O-CB 3.34Å; Y491-L494 PolarHBondContact O-N 2.79Å; Y491-L494 VanDerWaalsContact O-N 3.08Å; L494-V497 PolarHBondContact O-N 3.45Å; L494-I498 HydrophobicContact CD1-CD1 4.37Å; L494-I498 HydrophobicContact CG-CD1 3.95Å; L494-I498 VanDerWaalsContact O-CG1 3.23Å; L494-I498 WeakPolarHBondContact O-CG1 3.33Å; L494-I498 PolarHBondContact O-N 3.32Å; L494-A545 HydrophobicContact CD2-CB 3.74Å; L494-A545 HydrophobicContact CG-CB 4.42Å; L494-F582 HydrophobicContact CD1-CZ 4.49Å; L494-L585 HydrophobicContact CD1-CD1 3.73Å; L494-M762 HydrophobicContact CD1-CE 4.21Å; L494-M762 HydrophobicContact CD1-SD 3.59Å; L494-M762 VanDerWaalsContact CD1-SD 3.59Å
495	E	62.8	Low	59.6	Low	44 Å²	44	46.1 Å²	46.1	21%	0.206	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-43.1	176.4	177.9	167.2	-158.8	0	0	110.6	Y491 I498 L499 R542	Y491-E495 HydrophobicContact CE1-CB 4.27Å; Y491-E495 WeakPolarHBondContact CE1-OE2 3.23Å; Y491-E495 HydrophobicContact CE2-CB 4.21Å; Y491-E495 WeakPolarHBondContact O-CB 3.4Å; Y491-E495 PolarHBondContact O-N 3Å; Y491-E495 PolarHBondContact OH-OE2 3.23Å; E495-I498 PolarHBondContact O-N 3.13Å; E495-L499 HydrophobicContact CG-CD1 3.81Å; E495-L499 HydrophobicContact CG-CG 4.2Å; E495-L499 WeakPolarHBondContact O-CB 3.14Å; E495-L499 WeakPolarHBondContact O-CG 3.34Å; E495-L499 PolarHBondContact O-N 3.46Å; E495-R542 IonicContact OE1-CZ 3.37Å; E495-R542 IonicContact OE1-NE 3.98Å; E495-R542 PolarHBondContact OE1-NE 2.87Å; E495-R542 IonicContact OE1-NH2 2.84Å; E495-R542 PolarHBondContact OE1-NH2 2.91Å
496	T	63.7	Low	59.8	Low	74 Å²	74	41.6 Å²	41.6	45%	0.454	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-48.4	174.9	-55.7	0	0	0	0	110.2	S492 M493 I498 L499 D500	S492-T496 VanDerWaalsContact O-CB 3.27Å; S492-T496 WeakPolarHBondContact O-CB 3.39Å; S492-T496 PolarHBondContact O-N 2.98Å; S492-T496 PolarHBondContact O-OG1 3.42Å; M493-T496 PolarHBondContact O-N 3.28Å; T496-I498 VanDerWaalsContact C-N 3.33Å; T496-I498 PolarHBondContact O-N 3.27Å; T496-L499 PolarHBondContact O-N 2.78Å; T496-D500 VanDerWaalsContact O-CB 3.31Å; T496-D500 WeakPolarHBondContact O-CB 3.42Å; T496-D500 PolarHBondContact O-N 3.39Å
497	V	62.8	Low	59.9	Low	7 Å²	7	40.9 Å²	40.9	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-42.7	175.9	167.9	0	0	0	0	112.2	M493 L494 L501 L589 A758 M762	M493-V497 VanDerWaalsContact O-CG2 3.32Å; M493-V497 WeakPolarHBondContact O-CG2 3.47Å; M493-V497 PolarHBondContact O-N 2.87Å; L494-V497 PolarHBondContact O-N 3.45Å; V497-L501 HydrophobicContact CG1-CD1 4.17Å; V497-L501 VanDerWaalsContact O-CB 3.32Å; V497-L501 WeakPolarHBondContact O-CB 3.48Å; V497-L501 VanDerWaalsContact O-CG 3.26Å; V497-L501 WeakPolarHBondContact O-CG 3.17Å; V497-L501 PolarHBondContact O-N 2.81Å; V497-L589 HydrophobicContact CG1-CD1 4.29Å; V497-A758 HydrophobicContact CG1-CB 4.08Å; V497-A758 HydrophobicContact CG2-CB 4.3Å; V497-M762 HydrophobicContact CG1-CG 4.02Å; V497-M762 HydrophobicContact CG1-SD 4.36Å
498	I	59.9	Low	60	Low	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-41.2	179.2	-66.6	166.8	0	0	0	111.4	L494 E495 T496 L501 I502 R542 A545 L585	L494-I498 HydrophobicContact CD1-CD1 4.37Å; L494-I498 HydrophobicContact CG-CD1 3.95Å; L494-I498 VanDerWaalsContact O-CG1 3.23Å; L494-I498 WeakPolarHBondContact O-CG1 3.33Å; L494-I498 PolarHBondContact O-N 3.32Å; E495-I498 PolarHBondContact O-N 3.13Å; T496-I498 VanDerWaalsContact C-N 3.33Å; T496-I498 PolarHBondContact O-N 3.27Å; I498-L501 WeakPolarHBondContact O-CB 3.29Å; I498-L501 PolarHBondContact O-N 3.16Å; I498-I502 HydrophobicContact CG2-CD1 3.88Å; I498-I502 HydrophobicContact CG2-CG1 4.42Å; I498-I502 VanDerWaalsContact O-CG1 3.27Å; I498-I502 WeakPolarHBondContact O-CG1 3.39Å; I498-I502 PolarHBondContact O-N 2.96Å; I498-R542 HydrophobicContact CG2-CB 3.75Å; I498-R542 HydrophobicContact CG2-CG 4.26Å; I498-A545 HydrophobicContact CD1-CB 3.99Å; I498-L585 HydrophobicContact CD1-CD1 4.15Å; I498-L585 HydrophobicContact CG1-CD1 4.11Å; I498-L585 HydrophobicContact CG1-CD2 3.8Å
499	L	65.4	Low	59.9	Low	64 Å²	64	42 Å²	42	34%	0.335	23%	0.226	S	C	.	.	H	α-helix	trans	-65.8	-43	176.7	-78.4	174.2	0	0	0	111.6	E495 T496 L501 I502 S503	E495-L499 HydrophobicContact CG-CD1 3.81Å; E495-L499 HydrophobicContact CG-CG 4.2Å; E495-L499 WeakPolarHBondContact O-CB 3.14Å; E495-L499 WeakPolarHBondContact O-CG 3.34Å; E495-L499 PolarHBondContact O-N 3.46Å; T496-L499 PolarHBondContact O-N 2.78Å; L499-L501 VanDerWaalsContact C-N 3.32Å; L499-L501 PolarHBondContact O-N 2.84Å; L499-I502 PolarHBondContact O-N 3.38Å; L499-S503 WeakPolarHBondContact O-CB 3.18Å; L499-S503 PolarHBondContact O-N 2.9Å
500	D	62.8	Low	59.6	Low	68 Å²	68	45.1 Å²	45.1	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-60.1	-44.9	173.9	-70.6	-16.6	0	0	0	110	T496 S503 L504	T496-D500 VanDerWaalsContact O-CB 3.31Å; T496-D500 WeakPolarHBondContact O-CB 3.42Å; T496-D500 PolarHBondContact O-N 3.39Å; D500-S503 PolarHBondContact O-N 3.23Å; D500-L504 WeakPolarHBondContact O-CB 3.38Å; D500-L504 WeakPolarHBondContact O-CD1 3.35Å; D500-L504 WeakPolarHBondContact O-CG 3.47Å; D500-L504 PolarHBondContact O-N 3.12Å
501	L	60.6	Low	59.3	Low	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.4	-45.3	173.8	-82.8	173.3	0	0	0	113	V497 I498 L499 S503 L504 V505 L538 L585 V588 L589 L592 Y755	V497-L501 HydrophobicContact CG1-CD1 4.17Å; V497-L501 VanDerWaalsContact O-CB 3.32Å; V497-L501 WeakPolarHBondContact O-CB 3.48Å; V497-L501 VanDerWaalsContact O-CG 3.26Å; V497-L501 WeakPolarHBondContact O-CG 3.17Å; V497-L501 PolarHBondContact O-N 2.81Å; I498-L501 WeakPolarHBondContact O-CB 3.29Å; I498-L501 PolarHBondContact O-N 3.16Å; L499-L501 VanDerWaalsContact C-N 3.32Å; L499-L501 PolarHBondContact O-N 2.84Å; L501-S503 VanDerWaalsContact C-N 3.34Å; L501-L504 PolarHBondContact O-N 3.28Å; L501-V505 WeakPolarHBondContact O-CB 2.92Å; L501-V505 VanDerWaalsContact O-CG2 3.22Å; L501-V505 WeakPolarHBondContact O-CG2 3.47Å; L501-V505 PolarHBondContact O-N 3.2Å; L501-L538 HydrophobicContact CD1-CD2 4.44Å; L501-L585 HydrophobicContact CD1-CD2 3.72Å; L501-V588 HydrophobicContact CD2-CG1 4.34Å; L501-L589 HydrophobicContact CD1-CD1 4.36Å; L501-L589 HydrophobicContact CD1-CD2 3.97Å; L501-L589 HydrophobicContact CD1-CG 3.91Å; L501-L589 HydrophobicContact CD2-CD2 3.46Å; L501-L589 VanDerWaalsContact CD2-CD2 3.46Å; L501-L589 HydrophobicContact CD2-CG 4.05Å; L501-L589 HydrophobicContact CG-CD2 3.93Å; L501-L589 HydrophobicContact CG-CG 4.41Å; L501-L592 HydrophobicContact CD2-CD1 3.84Å; L501-Y755 HydrophobicContact CD2-CD1 4.46Å; L501-Y755 HydrophobicContact CD2-CE1 4.37Å
502	I	61.3	Low	58.9	Low	17 Å²	17	48.6 Å²	48.6	9%	0.087	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-44.7	177	-71.6	166.8	0	0	0	109.9	I498 L499 V505 T506 Y535 L538	I498-I502 HydrophobicContact CG2-CD1 3.88Å; I498-I502 HydrophobicContact CG2-CG1 4.42Å; I498-I502 VanDerWaalsContact O-CG1 3.27Å; I498-I502 WeakPolarHBondContact O-CG1 3.39Å; I498-I502 PolarHBondContact O-N 2.96Å; L499-I502 PolarHBondContact O-N 3.38Å; I502-V505 PolarHBondContact O-N 2.69Å; I502-T506 WeakPolarHBondContact O-CB 3.38Å; I502-T506 PolarHBondContact O-N 3.15Å; I502-T506 PolarHBondContact O-OG1 2.91Å; I502-Y535 HydrophobicContact CG2-CE2 4.01Å; I502-L538 HydrophobicContact CD1-CB 4.43Å; I502-L538 HydrophobicContact CG1-CB 3.93Å; I502-L538 HydrophobicContact CG1-CD1 4.28Å
503	S	64.2	Low	58	Low	58 Å²	58	50 Å²	50	41%	0.406	26%	0.264	S	S	.	.	H	α-helix	trans	-60	-47.5	176.1	-167.7	0	0	0	0	111	L499 D500 L501 T506 E507	L499-S503 WeakPolarHBondContact O-CB 3.18Å; L499-S503 PolarHBondContact O-N 2.9Å; D500-S503 PolarHBondContact O-N 3.23Å; L501-S503 VanDerWaalsContact C-N 3.34Å; S503-T506 PolarHBondContact O-N 3.29Å; S503-E507 WeakPolarHBondContact O-CB 3.21Å; S503-E507 WeakPolarHBondContact O-CG 3.21Å; S503-E507 PolarHBondContact O-N 3.29Å
504	L	58.4	Low	57.2	Low	7 Å²	7	50.1 Å²	50.1	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-42.8	179.8	-79.8	163	0	0	0	112.6	D500 L501 E507 A508 Q751 L754 Y755	D500-L504 WeakPolarHBondContact O-CB 3.38Å; D500-L504 WeakPolarHBondContact O-CD1 3.35Å; D500-L504 WeakPolarHBondContact O-CG 3.47Å; D500-L504 PolarHBondContact O-N 3.12Å; L501-L504 PolarHBondContact O-N 3.28Å; L504-E507 PolarHBondContact O-N 2.88Å; L504-A508 WeakPolarHBondContact O-CB 3.49Å; L504-A508 PolarHBondContact O-N 3.32Å; L504-Q751 HydrophobicContact CD2-CB 4.28Å; L504-Q751 HydrophobicContact CD2-CG 4.1Å; L504-L754 HydrophobicContact CD1-CB 4.3Å; L504-L754 HydrophobicContact CD2-CD1 4.49Å; L504-Y755 HydrophobicContact CB-CE1 3.84Å; L504-Y755 WeakPolarHBondContact CB-OH 2.74Å; L504-Y755 HydrophobicContact CD1-CD1 3.77Å; L504-Y755 HydrophobicContact CD1-CE1 3.53Å; L504-Y755 HydrophobicContact CD1-CE2 4.44Å; L504-Y755 HydrophobicContact CD1-CG 4.35Å; L504-Y755 HydrophobicContact CD2-CE1 4.22Å; L504-Y755 HydrophobicContact CD2-CE2 3.87Å; L504-Y755 HydrophobicContact CG-CE1 4.06Å
505	V	57	Low	56.3	Low	1 Å²	1	56.6 Å²	56.6	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-42	174.4	170.5	0	0	0	0	110.6	L501 I502 A508 E509 V529 F534 L538 L592	L501-V505 WeakPolarHBondContact O-CB 2.92Å; L501-V505 VanDerWaalsContact O-CG2 3.22Å; L501-V505 WeakPolarHBondContact O-CG2 3.47Å; L501-V505 PolarHBondContact O-N 3.2Å; I502-V505 PolarHBondContact O-N 2.69Å; V505-A508 PolarHBondContact O-N 3.14Å; V505-E509 PolarHBondContact O-N 3.42Å; V505-V529 HydrophobicContact CG1-CG1 3.92Å; V505-F534 HydrophobicContact CG2-CE1 4.13Å; V505-L538 HydrophobicContact CB-CD1 4.5Å; V505-L538 HydrophobicContact CG2-CD1 3.96Å; V505-L592 HydrophobicContact CG2-CD1 4.05Å
506	T	60.4	Low	55.1	Low	39 Å²	39	60.3 Å²	60.3	24%	0.239	31%	0.31	C	S	.	.	H	α-helix	trans	-65.1	-41.3	177.3	-52.2	0	0	0	0	111.6	I502 S503 E509 Q510	I502-T506 WeakPolarHBondContact O-CB 3.38Å; I502-T506 PolarHBondContact O-N 3.15Å; I502-T506 PolarHBondContact O-OG1 2.91Å; S503-T506 PolarHBondContact O-N 3.29Å; T506-E509 PolarHBondContact O-N 2.89Å; T506-Q510 VanDerWaalsContact O-CG 3.31Å; T506-Q510 WeakPolarHBondContact O-CG 3.36Å; T506-Q510 PolarHBondContact O-N 3.46Å; T506-Q510 VanDerWaalsContact O-N 3.15Å
507	E	57.2	Low	53.6	Low	90 Å²	90	67.6 Å²	67.6	42%	0.421	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-40.8	173.6	-78.5	-178.1	-167.8	0	0	111.9	S503 L504 Q510 S511 Q751	S503-E507 WeakPolarHBondContact O-CB 3.21Å; S503-E507 WeakPolarHBondContact O-CG 3.21Å; S503-E507 PolarHBondContact O-N 3.29Å; L504-E507 PolarHBondContact O-N 2.88Å; E507-Q510 PolarHBondContact O-N 2.88Å; E507-S511 PolarHBondContact O-N 3.31Å; E507-Q751 PolarHBondContact OE2-NE2 3.01Å
508	A	53.3	Low	52.3	Low	7 Å²	7	73 Å²	73	6%	0.058	36%	0.358	C	S	.	.	H	α-helix	trans	-63.9	-40.1	176.4	0	0	0	0	0	111.9	L504 V505 Q510 F514	L504-A508 WeakPolarHBondContact O-CB 3.49Å; L504-A508 PolarHBondContact O-N 3.32Å; V505-A508 PolarHBondContact O-N 3.14Å; A508-Q510 VanDerWaalsContact C-N 3.3Å; A508-Q510 PolarHBondContact O-N 3.01Å; A508-F514 HydrophobicContact CB-CD2 4.39Å; A508-F514 HydrophobicContact CB-CE1 4.39Å; A508-F514 HydrophobicContact CB-CE2 3.83Å; A508-F514 HydrophobicContact CB-CZ 3.83Å; A508-F514 WeakPolarHBondContact O-CD2 3.44Å; A508-F514 WeakPolarHBondContact O-CG 3.5Å
509	E	51.9	Low	51.4	Low	98 Å²	98	82.6 Å²	82.6	46%	0.458	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-36.3	173.1	-76.4	-173.8	164.4	0	0	112.9	V505 T506 V529	V505-E509 PolarHBondContact O-N 3.42Å; T506-E509 PolarHBondContact O-N 2.89Å; E509-V529 HydrophobicContact CB-CG1 4.47Å; E509-V529 HydrophobicContact CG-CG1 3.27Å
510	Q	52.9	Low	50	Low	148 Å²	148	85.2 Å²	85.2	69%	0.692	41%	0.414	S	S	*	.	H	α-helix	trans	-81.7	-22.8	-176.6	-71.1	178.6	13.3	0	0	113.8	T506 E507 A508 D512	T506-Q510 VanDerWaalsContact O-CG 3.31Å; T506-Q510 WeakPolarHBondContact O-CG 3.36Å; T506-Q510 PolarHBondContact O-N 3.46Å; T506-Q510 VanDerWaalsContact O-N 3.15Å; E507-Q510 PolarHBondContact O-N 2.88Å; A508-Q510 VanDerWaalsContact C-N 3.3Å; A508-Q510 PolarHBondContact O-N 3.01Å; Q510-D512 PolarHBondContact O-N 2.84Å
511	S	50.6	Low	48.7	Very low	42 Å²	42	89.8 Å²	89.8	29%	0.294	44%	0.438	S	S	.	.			trans	-73.5	121.4	-179.4	171.8	0	0	0	0	111.7	E507 Q513 F514	E507-S511 PolarHBondContact O-N 3.31Å; S511-Q513 PolarHBondContact O-N 3.35Å; S511-Q513 PolarHBondContact OG-N 3.48Å; S511-F514 PolarHBondContact O-N 2.88Å; S511-F514 VanDerWaalsContact O-N 3.09Å
512	D	48.1	Very low	47.4	Very low	115 Å²	115	92.9 Å²	92.9	62%	0.615	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-60.1	-17.2	177.7	-83	-34.2	0	0	0	113.6	Q510 F514 K515	Q510-D512 PolarHBondContact O-N 2.84Å; D512-F514 PolarHBondContact O-N 3.48Å; D512-K515 PolarHBondContact O-N 3.23Å; D512-K515 VanDerWaalsContact O-N 3.15Å; D512-K515 IonicContact OD1-NZ 2.75Å; D512-K515 PolarHBondContact OD1-NZ 3.01Å
513	Q	44.1	Very low	46	Very low	82 Å²	82	99.3 Å²	99.3	38%	0.383	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-65	-23.4	174.9	-66.6	-172.9	-5.4	0	0	113.2	S511 K515 I516	S511-Q513 PolarHBondContact O-N 3.35Å; S511-Q513 PolarHBondContact OG-N 3.48Å; Q513-K515 VanDerWaalsContact C-N 3.25Å; Q513-K515 PolarHBondContact O-N 2.95Å; Q513-I516 HydrophobicContact CB-CD1 4.4Å; Q513-I516 VanDerWaalsContact O-CD1 3.25Å; Q513-I516 WeakPolarHBondContact O-CD1 3.22Å; Q513-I516 WeakPolarHBondContact O-CG1 3.36Å; Q513-I516 PolarHBondContact O-N 2.88Å
514	F	44.7	Very low	44.5	Very low	78 Å²	78	102.5 Å²	102.5	34%	0.342	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-79.8	-8.6	176.9	-70.6	-86.9	0	0	0	113.2	A508 S511 D512 I516 H595	A508-F514 HydrophobicContact CB-CD2 4.39Å; A508-F514 HydrophobicContact CB-CE1 4.39Å; A508-F514 HydrophobicContact CB-CE2 3.83Å; A508-F514 HydrophobicContact CB-CZ 3.83Å; A508-F514 WeakPolarHBondContact O-CD2 3.44Å; A508-F514 WeakPolarHBondContact O-CG 3.5Å; S511-F514 PolarHBondContact O-N 2.88Å; S511-F514 VanDerWaalsContact O-N 3.09Å; D512-F514 PolarHBondContact O-N 3.48Å; F514-I516 VanDerWaalsContact C-N 3.33Å; F514-H595 AromaticContact CE1-NE2 3.74Å
515	K	41.1	Very low	43.5	Very low	148 Å²	148	110.2 Å²	110.2	64%	0.643	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-88.9	7.6	172.8	-64.4	178.5	-170.2	148.3	0	113.3	D512 Q513 R517	D512-K515 PolarHBondContact O-N 3.23Å; D512-K515 VanDerWaalsContact O-N 3.15Å; D512-K515 IonicContact OD1-NZ 2.75Å; D512-K515 PolarHBondContact OD1-NZ 3.01Å; Q513-K515 VanDerWaalsContact C-N 3.25Å; Q513-K515 PolarHBondContact O-N 2.95Å; K515-R517 VanDerWaalsContact C-N 3.27Å; K515-R517 PolarHBondContact O-N 3.41Å
516	I	35.7	Very low	42.3	Very low	122 Å²	122	115.7 Å²	115.7	63%	0.626	57%	0.574	S	S	*	*			trans	-65.2	90.2	179.6	-63.4	168.6	0	0	0	109.2	Q513 F514 N518	Q513-I516 HydrophobicContact CB-CD1 4.4Å; Q513-I516 VanDerWaalsContact O-CD1 3.25Å; Q513-I516 WeakPolarHBondContact O-CD1 3.22Å; Q513-I516 WeakPolarHBondContact O-CG1 3.36Å; Q513-I516 PolarHBondContact O-N 2.88Å; F514-I516 VanDerWaalsContact C-N 3.33Å; I516-N518 PolarHBondContact O-N 2.88Å
517	R	33.6	Very low	41.2	Very low	228 Å²	228	117 Å²	117	86%	0.86	58%	0.583	S	S	*	*			trans	-61.7	119.7	162.8	-79.4	-177.2	174.5	-176.6	-2.7	107.5	K515	K515-R517 VanDerWaalsContact C-N 3.27Å; K515-R517 PolarHBondContact O-N 3.41Å
518	N	35.4	Very low	40.4	Very low	120 Å²	120	116.7 Å²	116.7	64%	0.642	58%	0.583	S	S	*	*			trans	-69.1	147.4	171.8	-140.4	-12.6	0	0	0	109.5	I516 N520	I516-N518 PolarHBondContact O-N 2.88Å; N518-N520 PolarHBondContact O-N 3.12Å; N518-N520 VanDerWaalsContact O-N 3.08Å
519	K	40.1	Very low	39.9	Very low	201 Å²	201	117.2 Å²	117.2	87%	0.874	59%	0.585	S	S	*	*	S	Bend	trans	-63.2	-12.7	-179.8	-84.6	-179	174.9	175.5	0	114.5
520	N	36.3	Very low	39.3	Very low	119 Å²	119	116.2 Å²	116.2	64%	0.636	59%	0.594	S	S	*	*	S	Bend	trans	-111	115.1	171.7	-61.9	-16.1	0	0	0	105.4	N518 S522	N518-N520 PolarHBondContact O-N 3.12Å; N518-N520 VanDerWaalsContact O-N 3.08Å; N520-S522 PolarHBondContact O-N 3.44Å; N520-S522 PolarHBondContact O-OG 3.06Å
521	D	36.2	Very low	38.8	Very low	164 Å²	164	113.7 Å²	113.7	88%	0.877	59%	0.585	S	S	*	*			trans	-57.5	25.2	-178.7	-72.8	-43.4	0	0	0	115.2	D523	D521-D523 PolarHBondContact O-N 3.29Å
522	S	33.4	Very low	38.1	Very low	66 Å²	66	116.3 Å²	116.3	46%	0.462	60%	0.604	S	S	.	*			trans	-85.5	102.1	165.8	59.4	0	0	0	0	109.1	N520 L524	N520-S522 PolarHBondContact O-N 3.44Å; N520-S522 PolarHBondContact O-OG 3.06Å; S522-L524 PolarHBondContact O-N 3.39Å
523	D	31.4	Very low	37.9	Very low	153 Å²	153	113.6 Å²	113.6	82%	0.818	59%	0.593	S	S	*	*			trans	-58.8	83.3	162.4	-72	-33.9	0	0	0	108.5	D521 F525	D521-D523 PolarHBondContact O-N 3.29Å; D523-F525 PolarHBondContact O-N 2.95Å
524	L	33.5	Very low	38	Very low	124 Å²	124	111.2 Å²	111.2	65%	0.649	58%	0.582	S	S	*	*			trans	-68.4	-26.7	-173.8	-152.9	81.1	0	0	0	111.2	S522	S522-L524 PolarHBondContact O-N 3.39Å
525	F	35.9	Very low	38.2	Very low	170 Å²	170	111.9 Å²	111.9	75%	0.746	58%	0.583	S	S	*	*	S	Bend	trans	-152.7	117.1	172.2	-76.8	-79	0	0	0	110.2	D523	D523-F525 PolarHBondContact O-N 2.95Å
526	T	33.2	Very low	38.4	Very low	116 Å²	116	108.4 Å²	108.4	71%	0.712	58%	0.577	S	S	*	*			trans	-49.2	124	168.2	42	0	0	0	0	109	I528	T526-I528 PolarHBondContact O-N 3.06Å
527	P	35.8	Very low	39.1	Very low	66 Å²	66	105.3 Å²	105.3	43%	0.429	56%	0.564	S	S	.	*			trans	-57.6	117.5	176.1	-15.6	26.3	0	0	0	107.5	V529 A530	P527-V529 PolarHBondContact O-N 3.22Å; P527-A530 HydrophobicContact CB-CB 4.26Å; P527-A530 HydrophobicContact CG-CB 4.44Å; P527-A530 PolarHBondContact O-N 3.43Å
528	I	42.2	Very low	39.9	Very low	84 Å²	84	94.6 Å²	94.6	43%	0.431	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-24.9	178.7	-66.9	168.2	0	0	0	111.2	T526 F534	T526-I528 PolarHBondContact O-N 3.06Å; I528-F534 HydrophobicContact CG2-CD2 4.3Å; I528-F534 HydrophobicContact CG2-CE2 3.71Å; I528-F534 HydrophobicContact CG2-CZ 3.84Å
529	V	41.1	Very low	40.6	Very low	17 Å²	17	92.2 Å²	92.2	10%	0.103	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-25.1	-176.5	176.5	0	0	0	0	114.1	V505 E509 P527 D531 L592	V505-V529 HydrophobicContact CG1-CG1 3.92Å; E509-V529 HydrophobicContact CB-CG1 4.47Å; E509-V529 HydrophobicContact CG-CG1 3.27Å; P527-V529 PolarHBondContact O-N 3.22Å; V529-D531 PolarHBondContact O-N 3.46Å; V529-L592 HydrophobicContact CG2-CD2 4.07Å
530	A	39.2	Very low	41.1	Very low	78 Å²	78	86.9 Å²	86.9	65%	0.645	49%	0.488	S	S	*	.	S	Bend	trans	-71.8	-5.9	-173.4	0	0	0	0	0	114.3	P527	P527-A530 HydrophobicContact CB-CB 4.26Å; P527-A530 HydrophobicContact CG-CB 4.44Å; P527-A530 PolarHBondContact O-N 3.43Å
531	D	42.8	Very low	41.9	Very low	95 Å²	95	81.6 Å²	81.6	51%	0.508	46%	0.461	S	S	.	.			trans	-90.6	109	-177.6	-152.9	-29	0	0	0	110.1	V529 S533 F534	V529-D531 PolarHBondContact O-N 3.46Å; D531-S533 PolarHBondContact O-N 2.86Å; D531-S533 WeakPolarHBondContact OD1-CB 3.49Å; D531-S533 PolarHBondContact OD1-N 3.33Å; D531-S533 PolarHBondContact OD1-OG 2.94Å; D531-S533 PolarHBondContact OD2-OG 2.91Å; D531-F534 WeakPolarHBondContact O-CB 3.3Å; D531-F534 PolarHBondContact O-N 3.32Å
532	S	37.3	Very low	42.6	Very low	97 Å²	97	77.5 Å²	77.5	68%	0.678	43%	0.433	S	S	*	.	H	α-helix	trans	-52.1	-20.8	175.3	63.6	0	0	0	0	114.2	F534 S536	S532-F534 VanDerWaalsContact C-N 3.28Å; S532-F534 PolarHBondContact O-N 3.5Å; S532-S536 PolarHBondContact O-N 2.85Å; S532-S536 PolarHBondContact O-OG 3.35Å
533	S	42.1	Very low	43.5	Very low	57 Å²	57	78.3 Å²	78.3	40%	0.399	43%	0.426	S	S	.	.	H	α-helix	trans	-66.5	-27.4	172.3	64.9	0	0	0	0	113.1	D531 S536 T537	D531-S533 PolarHBondContact O-N 2.86Å; D531-S533 WeakPolarHBondContact OD1-CB 3.49Å; D531-S533 PolarHBondContact OD1-N 3.33Å; D531-S533 PolarHBondContact OD1-OG 2.94Å; D531-S533 PolarHBondContact OD2-OG 2.91Å; S533-S536 WeakPolarHBondContact O-CB 3.06Å; S533-T537 WeakPolarHBondContact O-CB 3.17Å; S533-T537 PolarHBondContact O-N 3.12Å; S533-T537 PolarHBondContact O-OG1 3.39Å
534	F	48	Very low	44.4	Very low	32 Å²	32	74.3 Å²	74.3	14%	0.14	40%	0.4	C	S	.	.	H	α-helix	trans	-74.5	-48.1	-176.9	-164.4	-97.7	0	0	0	112.6	V505 I528 D531 S532 S536 T537 L538 V588	V505-F534 HydrophobicContact CG2-CE1 4.13Å; I528-F534 HydrophobicContact CG2-CD2 4.3Å; I528-F534 HydrophobicContact CG2-CE2 3.71Å; I528-F534 HydrophobicContact CG2-CZ 3.84Å; D531-F534 WeakPolarHBondContact O-CB 3.3Å; D531-F534 PolarHBondContact O-N 3.32Å; S532-F534 VanDerWaalsContact C-N 3.28Å; S532-F534 PolarHBondContact O-N 3.5Å; F534-S536 VanDerWaalsContact C-N 3.26Å; F534-S536 PolarHBondContact O-N 2.83Å; F534-T537 WeakPolarHBondContact O-CA 3.38Å; F534-T537 WeakPolarHBondContact O-CB 3.08Å; F534-T537 PolarHBondContact O-N 3.38Å; F534-L538 HydrophobicContact CD1-CD1 4.26Å; F534-L538 HydrophobicContact CE1-CD1 4.07Å; F534-L538 PolarHBondContact O-N 3.21Å; F534-V588 HydrophobicContact CE1-CG1 4.03Å; F534-V588 HydrophobicContact CE1-CG2 4.44Å; F534-V588 HydrophobicContact CE2-CG2 3.59Å; F534-V588 HydrophobicContact CZ-CB 3.99Å; F534-V588 HydrophobicContact CZ-CG1 3.51Å; F534-V588 HydrophobicContact CZ-CG2 3.42Å; F534-V588 VanDerWaalsContact CZ-CG2 3.42Å
535	Y	47.1	Very low	45.4	Very low	93 Å²	93	68.4 Å²	68.4	37%	0.365	37%	0.37	S	S	.	.	H	α-helix	trans	-57.8	-42.6	171.8	-172	-89	0	0	0	110.8	I502 T537 L538 F539	I502-Y535 HydrophobicContact CG2-CE2 4.01Å; Y535-T537 VanDerWaalsContact C-N 3.28Å; Y535-T537 PolarHBondContact O-N 2.85Å; Y535-L538 PolarHBondContact O-N 3.39Å; Y535-F539 HydrophobicContact CE1-CD2 4.28Å; Y535-F539 WeakPolarHBondContact O-CB 3.39Å; Y535-F539 PolarHBondContact O-N 2.92Å
536	S	46.6	Very low	46.2	Very low	74 Å²	74	60.9 Å²	60.9	52%	0.517	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-36.7	175	-56.1	0	0	0	0	112.3	S532 S533 F534 L540	S532-S536 PolarHBondContact O-N 2.85Å; S532-S536 PolarHBondContact O-OG 3.35Å; S533-S536 WeakPolarHBondContact O-CB 3.06Å; F534-S536 VanDerWaalsContact C-N 3.26Å; F534-S536 PolarHBondContact O-N 2.83Å; S536-L540 WeakPolarHBondContact O-CB 3.31Å; S536-L540 PolarHBondContact O-N 3Å
537	T	50	Low	47	Very low	57 Å²	57	57.3 Å²	57.3	35%	0.35	31%	0.311	S	S	.	.	H	α-helix	trans	-69.9	-43.9	177.6	-58.4	0	0	0	0	111.7	S533 F534 Y535 F539 L540 C541	S533-T537 WeakPolarHBondContact O-CB 3.17Å; S533-T537 PolarHBondContact O-N 3.12Å; S533-T537 PolarHBondContact O-OG1 3.39Å; F534-T537 WeakPolarHBondContact O-CA 3.38Å; F534-T537 WeakPolarHBondContact O-CB 3.08Å; F534-T537 PolarHBondContact O-N 3.38Å; Y535-T537 VanDerWaalsContact C-N 3.28Å; Y535-T537 PolarHBondContact O-N 2.85Å; T537-F539 VanDerWaalsContact C-N 3.32Å; T537-F539 PolarHBondContact O-N 3.43Å; T537-L540 WeakPolarHBondContact O-CB 3.31Å; T537-L540 PolarHBondContact O-N 3.18Å; T537-C541 PolarHBondContact O-N 3.35Å; T537-C541 PolarHBondContact O-SG 3.24Å
538	L	50.9	Low	47.7	Very low	4 Å²	4	55.9 Å²	55.9	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-40.1	174.5	-74.8	173.9	0	0	0	111.8	L501 I502 V505 F534 Y535 L540 C541 R542 L585 V588	L501-L538 HydrophobicContact CD1-CD2 4.44Å; I502-L538 HydrophobicContact CD1-CB 4.43Å; I502-L538 HydrophobicContact CG1-CB 3.93Å; I502-L538 HydrophobicContact CG1-CD1 4.28Å; V505-L538 HydrophobicContact CB-CD1 4.5Å; V505-L538 HydrophobicContact CG2-CD1 3.96Å; F534-L538 HydrophobicContact CD1-CD1 4.26Å; F534-L538 HydrophobicContact CE1-CD1 4.07Å; F534-L538 PolarHBondContact O-N 3.21Å; Y535-L538 PolarHBondContact O-N 3.39Å; L538-L540 VanDerWaalsContact C-N 3.34Å; L538-C541 WeakPolarHBondContact O-CB 3.27Å; L538-C541 PolarHBondContact O-N 2.95Å; L538-R542 PolarHBondContact O-N 3.3Å; L538-L585 HydrophobicContact CD2-CD2 4.26Å; L538-V588 HydrophobicContact CD2-CG1 4.46Å
539	F	50.5	Low	48.2	Very low	70 Å²	70	52.1 Å²	52.1	31%	0.307	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-38.8	175.4	-143.4	-101.9	0	0	0	111.6	Y535 T537 R542 Y543	Y535-F539 HydrophobicContact CE1-CD2 4.28Å; Y535-F539 WeakPolarHBondContact O-CB 3.39Å; Y535-F539 PolarHBondContact O-N 2.92Å; T537-F539 VanDerWaalsContact C-N 3.32Å; T537-F539 PolarHBondContact O-N 3.43Å; F539-R542 PolarHBondContact O-N 3.28Å; F539-Y543 AromaticContact CD1-CD2 3.54Å; F539-Y543 HydrophobicContact CD1-CD2 3.54Å; F539-Y543 AromaticContact CD1-CE2 3.13Å; F539-Y543 HydrophobicContact CD1-CE2 3.13Å; F539-Y543 AromaticContact CD1-CZ 3.99Å; F539-Y543 AromaticContact CE1-CD2 3.92Å; F539-Y543 HydrophobicContact CE1-CD2 3.92Å; F539-Y543 AromaticContact CE1-CE2 3.09Å; F539-Y543 HydrophobicContact CE1-CE2 3.09Å; F539-Y543 AromaticContact CE1-CZ 3.46Å; F539-Y543 VanDerWaalsContact CE1-CZ 3.46Å; F539-Y543 WeakPolarHBondContact CE1-OH 3.3Å; F539-Y543 HydrophobicContact CG-CE2 4.39Å; F539-Y543 HydrophobicContact CZ-CE2 4.32Å; F539-Y543 WeakPolarHBondContact O-CB 3.36Å; F539-Y543 VanDerWaalsContact O-CD2 3.29Å; F539-Y543 WeakPolarHBondContact O-CD2 3.28Å; F539-Y543 PolarHBondContact O-N 2.89Å
540	L	49.5	Very low	48.9	Very low	88 Å²	88	52 Å²	52	46%	0.461	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-45.5	171.6	-167.2	83.1	0	0	0	111.2	V452 S536 T537 L538 R542 Y543 Y544	V452-L540 HydrophobicContact CB-CD1 4.31Å; S536-L540 WeakPolarHBondContact O-CB 3.31Å; S536-L540 PolarHBondContact O-N 3Å; T537-L540 WeakPolarHBondContact O-CB 3.31Å; T537-L540 PolarHBondContact O-N 3.18Å; L538-L540 VanDerWaalsContact C-N 3.34Å; L540-R542 VanDerWaalsContact C-N 3.33Å; L540-R542 PolarHBondContact O-N 3.3Å; L540-Y543 PolarHBondContact O-N 3.47Å; L540-Y544 WeakPolarHBondContact O-CB 3.46Å; L540-Y544 PolarHBondContact O-N 2.5Å
541	C	52.7	Low	49.3	Very low	9 Å²	9	49.5 Å²	49.5	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-42.9	175.3	-70.3	0	0	0	0	111.5	T537 L538 Y544 A545 V581	T537-C541 PolarHBondContact O-N 3.35Å; T537-C541 PolarHBondContact O-SG 3.24Å; L538-C541 WeakPolarHBondContact O-CB 3.27Å; L538-C541 PolarHBondContact O-N 2.95Å; C541-Y544 PolarHBondContact O-N 3.44Å; C541-A545 VanDerWaalsContact O-CB 3.29Å; C541-A545 WeakPolarHBondContact O-CB 3.44Å; C541-A545 PolarHBondContact O-N 2.86Å; C541-V581 HydrophobicContact CB-CG1 4.15Å
542	R	52.3	Low	49.7	Very low	77 Å²	77	45.6 Å²	45.6	29%	0.291	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-56.5	174.8	-170.8	-178.4	175.3	-165.4	-0.3	111.1	E495 I498 L538 F539 L540 Y544 A545 T546	E495-R542 IonicContact OE1-CZ 3.37Å; E495-R542 IonicContact OE1-NE 3.98Å; E495-R542 PolarHBondContact OE1-NE 2.87Å; E495-R542 IonicContact OE1-NH2 2.84Å; E495-R542 PolarHBondContact OE1-NH2 2.91Å; I498-R542 HydrophobicContact CG2-CB 3.75Å; I498-R542 HydrophobicContact CG2-CG 4.26Å; L538-R542 PolarHBondContact O-N 3.3Å; F539-R542 PolarHBondContact O-N 3.28Å; L540-R542 VanDerWaalsContact C-N 3.33Å; L540-R542 PolarHBondContact O-N 3.3Å; R542-Y544 PolarHBondContact O-N 3.41Å; R542-A545 PolarHBondContact O-N 3.16Å; R542-A545 VanDerWaalsContact O-N 3.16Å; R542-T546 PolarHBondContact O-N 2.58Å; R542-T546 PolarHBondContact O-OG1 3.27Å
543	Y	51	Low	50.3	Low	83 Å²	83	41.1 Å²	41.1	33%	0.325	21%	0.208	S	C	.	.	H	α-helix	trans	-54.7	-39.2	179.5	-86.4	-52.7	0	0	0	112	P455 I458 F539 L540 Y547	P455-Y543 HydrophobicContact CB-CE1 4.43Å; I458-Y543 HydrophobicContact CD1-CD1 3.37Å; I458-Y543 HydrophobicContact CD1-CE1 4.27Å; I458-Y543 HydrophobicContact CD1-CG 3.93Å; I458-Y543 VanDerWaalsContact CD1-O 3.28Å; I458-Y543 WeakPolarHBondContact CD1-O 3.13Å; F539-Y543 AromaticContact CD1-CD2 3.54Å; F539-Y543 HydrophobicContact CD1-CD2 3.54Å; F539-Y543 AromaticContact CD1-CE2 3.13Å; F539-Y543 HydrophobicContact CD1-CE2 3.13Å; F539-Y543 AromaticContact CD1-CZ 3.99Å; F539-Y543 AromaticContact CE1-CD2 3.92Å; F539-Y543 HydrophobicContact CE1-CD2 3.92Å; F539-Y543 AromaticContact CE1-CE2 3.09Å; F539-Y543 HydrophobicContact CE1-CE2 3.09Å; F539-Y543 AromaticContact CE1-CZ 3.46Å; F539-Y543 VanDerWaalsContact CE1-CZ 3.46Å; F539-Y543 WeakPolarHBondContact CE1-OH 3.3Å; F539-Y543 HydrophobicContact CG-CE2 4.39Å; F539-Y543 HydrophobicContact CZ-CE2 4.32Å; F539-Y543 WeakPolarHBondContact O-CB 3.36Å; F539-Y543 VanDerWaalsContact O-CD2 3.29Å; F539-Y543 WeakPolarHBondContact O-CD2 3.28Å; F539-Y543 PolarHBondContact O-N 2.89Å; L540-Y543 PolarHBondContact O-N 3.47Å; Y543-Y547 PolarHBondContact O-N 3.04Å
544	Y	51.6	Low	50.6	Low	69 Å²	69	40.1 Å²	40.1	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-77.3	-36.2	-178.6	-157.3	-83.1	0	0	0	112.7	L540 C541 R542 T546 Y547 L548 P577 V581	L540-Y544 WeakPolarHBondContact O-CB 3.46Å; L540-Y544 PolarHBondContact O-N 2.5Å; C541-Y544 PolarHBondContact O-N 3.44Å; R542-Y544 PolarHBondContact O-N 3.41Å; Y544-T546 VanDerWaalsContact C-N 3.31Å; Y544-T546 PolarHBondContact O-N 3.36Å; Y544-Y547 HydrophobicContact CE2-CD1 4.33Å; Y544-Y547 WeakPolarHBondContact O-CB 3.44Å; Y544-Y547 PolarHBondContact O-N 3.42Å; Y544-L548 HydrophobicContact CD1-CD1 3.97Å; Y544-L548 HydrophobicContact CD1-CG 4.07Å; Y544-L548 HydrophobicContact CE1-CD1 4.16Å; Y544-L548 HydrophobicContact CE1-CD2 4.14Å; Y544-L548 HydrophobicContact CE1-CG 4.01Å; Y544-L548 WeakPolarHBondContact O-CG 3.46Å; Y544-L548 PolarHBondContact O-N 2.92Å; Y544-P577 HydrophobicContact CD1-CB 4.05Å; Y544-P577 HydrophobicContact CD1-CG 4.25Å; Y544-P577 HydrophobicContact CE1-CB 3.59Å; Y544-P577 HydrophobicContact CE1-CG 3.3Å; Y544-V581 HydrophobicContact CD1-CG2 4.28Å
545	A	54.5	Low	50.6	Low	1 Å²	1	40.7 Å²	40.7	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-42.4	169.7	0	0	0	0	0	111.6	Y491 L494 I498 C541 R542 Y547 L548 A549	Y491-A545 HydrophobicContact CD2-CB 4.46Å; Y491-A545 WeakPolarHBondContact CD2-O 3.42Å; Y491-A545 VanDerWaalsContact CE2-C 3.43Å; Y491-A545 HydrophobicContact CE2-CB 4.14Å; Y491-A545 WeakPolarHBondContact CE2-O 3.23Å; L494-A545 HydrophobicContact CD2-CB 3.74Å; L494-A545 HydrophobicContact CG-CB 4.42Å; I498-A545 HydrophobicContact CD1-CB 3.99Å; C541-A545 VanDerWaalsContact O-CB 3.29Å; C541-A545 WeakPolarHBondContact O-CB 3.44Å; C541-A545 PolarHBondContact O-N 2.86Å; R542-A545 PolarHBondContact O-N 3.16Å; R542-A545 VanDerWaalsContact O-N 3.16Å; A545-Y547 VanDerWaalsContact C-N 3.31Å; A545-Y547 PolarHBondContact O-N 3.45Å; A545-L548 WeakPolarHBondContact O-CB 3.37Å; A545-L548 PolarHBondContact O-N 3.18Å; A545-A549 PolarHBondContact O-N 3.44Å
546	T	51.6	Low	50.5	Low	12 Å²	12	38 Å²	38	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-43.2	175	-52.8	0	0	0	0	110.9	I458 Y491 R542 Y544 L548 F550	I458-T546 HydrophobicContact CG2-CG2 3.59Å; Y491-T546 VanDerWaalsContact CE2-CA 3.45Å; Y491-T546 PolarHBondContact OH-OG1 3.06Å; R542-T546 PolarHBondContact O-N 2.58Å; R542-T546 PolarHBondContact O-OG1 3.27Å; Y544-T546 VanDerWaalsContact C-N 3.31Å; Y544-T546 PolarHBondContact O-N 3.36Å; T546-L548 PolarHBondContact O-N 3.36Å; T546-F550 HydrophobicContact CG2-CD2 3.67Å; T546-F550 HydrophobicContact CG2-CE2 3.46Å; T546-F550 VanDerWaalsContact CG2-CE2 3.46Å; T546-F550 WeakPolarHBondContact O-CD2 3.41Å; T546-F550 PolarHBondContact O-N 3.43Å
547	Y	50.2	Low	50.3	Low	40 Å²	40	35.3 Å²	35.3	16%	0.157	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-42	173.5	175.5	-104.1	0	0	0	112.5	Y457 L461 Y543 Y544 A545 S551 F573	Y457-Y547 HydrophobicContact CE1-CD2 4.04Å; Y457-Y547 AromaticContact CE1-CE2 3.6Å; Y457-Y547 HydrophobicContact CE1-CE2 3.6Å; L461-Y547 HydrophobicContact CD1-CD2 3.42Å; L461-Y547 VanDerWaalsContact CD1-CD2 3.42Å; L461-Y547 HydrophobicContact CD1-CE2 3.64Å; Y543-Y547 PolarHBondContact O-N 3.04Å; Y544-Y547 HydrophobicContact CE2-CD1 4.33Å; Y544-Y547 WeakPolarHBondContact O-CB 3.44Å; Y544-Y547 PolarHBondContact O-N 3.42Å; A545-Y547 VanDerWaalsContact C-N 3.31Å; A545-Y547 PolarHBondContact O-N 3.45Å; Y547-S551 VanDerWaalsContact O-CB 3.25Å; Y547-S551 WeakPolarHBondContact O-CB 3.26Å; Y547-S551 PolarHBondContact O-N 3.5Å; Y547-S551 PolarHBondContact O-OG 2.92Å; Y547-F573 AromaticContact CE1-CD1 3.57Å; Y547-F573 HydrophobicContact CE1-CD1 3.57Å; Y547-F573 AromaticContact CE1-CE1 3.57Å; Y547-F573 HydrophobicContact CE1-CE1 3.57Å; Y547-F573 AromaticContact CZ-CE1 3.72Å; Y547-F573 WeakPolarHBondContact OH-CE1 3.43Å
548	L	51.4	Low	49.9	Very low	36 Å²	36	36 Å²	36	19%	0.188	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-46.3	178.6	-73.2	166.8	0	0	0	113.3	Y544 A545 T546 S551 G552 F573 P577	Y544-L548 HydrophobicContact CD1-CD1 3.97Å; Y544-L548 HydrophobicContact CD1-CG 4.07Å; Y544-L548 HydrophobicContact CE1-CD1 4.16Å; Y544-L548 HydrophobicContact CE1-CD2 4.14Å; Y544-L548 HydrophobicContact CE1-CG 4.01Å; Y544-L548 WeakPolarHBondContact O-CG 3.46Å; Y544-L548 PolarHBondContact O-N 2.92Å; A545-L548 WeakPolarHBondContact O-CB 3.37Å; A545-L548 PolarHBondContact O-N 3.18Å; T546-L548 PolarHBondContact O-N 3.36Å; L548-S551 WeakPolarHBondContact CA-OG 3.11Å; L548-S551 PolarHBondContact O-OG 2.94Å; L548-G552 PolarHBondContact O-N 3.28Å; L548-F573 WeakPolarHBondContact CD2-O 3.44Å; L548-P577 HydrophobicContact CD1-CB 3.5Å; L548-P577 VanDerWaalsContact CD1-CB 3.5Å; L548-P577 HydrophobicContact CD1-CG 4.16Å; L548-P577 HydrophobicContact CD2-CB 4.01Å; L548-P577 HydrophobicContact CD2-CG 3.73Å; L548-P577 HydrophobicContact CG-CB 4.28Å; L548-P577 HydrophobicContact CG-CG 4.42Å
549	A	52.7	Low	49.3	Very low	5 Å²	5	42.4 Å²	42.4	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-64	-48.1	-178.8	0	0	0	0	0	111.3	Y491 A545 G552 V553	Y491-A549 HydrophobicContact CD1-CB 3.87Å; Y491-A549 HydrophobicContact CD2-CB 3.37Å; Y491-A549 HydrophobicContact CE1-CB 4.45Å; Y491-A549 HydrophobicContact CE2-CB 4.02Å; Y491-A549 HydrophobicContact CG-CB 3.26Å; A545-A549 PolarHBondContact O-N 3.44Å; A549-G552 PolarHBondContact O-N 3.39Å; A549-V553 WeakPolarHBondContact O-CG2 3.26Å; A549-V553 PolarHBondContact O-N 3.34Å
550	F	53.9	Low	48.6	Very low	16 Å²	16	43.8 Å²	43.8	7%	0.07	22%	0.224	C	C	.	.	H	α-helix	trans	-73.7	-35.3	-177.8	-67	-54.5	0	0	0	113.1	L461 Q462 A465 T546 V553 L554	L461-F550 HydrophobicContact CB-CB 4.15Å; Q462-F550 HydrophobicContact CB-CD2 4.15Å; Q462-F550 HydrophobicContact CB-CE2 3.74Å; Q462-F550 HydrophobicContact CB-CZ 4.02Å; Q462-F550 HydrophobicContact CG-CE1 4.34Å; Q462-F550 HydrophobicContact CG-CE2 3.75Å; Q462-F550 HydrophobicContact CG-CZ 3.61Å; A465-F550 HydrophobicContact CB-CB 4.48Å; A465-F550 HydrophobicContact CB-CD1 3.28Å; A465-F550 HydrophobicContact CB-CE1 3.81Å; A465-F550 HydrophobicContact CB-CG 4.2Å; T546-F550 HydrophobicContact CG2-CD2 3.67Å; T546-F550 HydrophobicContact CG2-CE2 3.46Å; T546-F550 VanDerWaalsContact CG2-CE2 3.46Å; T546-F550 WeakPolarHBondContact O-CD2 3.41Å; T546-F550 PolarHBondContact O-N 3.43Å; F550-V553 PolarHBondContact O-N 2.86Å; F550-L554 VanDerWaalsContact O-CG 3.3Å; F550-L554 WeakPolarHBondContact O-CG 3.38Å; F550-L554 PolarHBondContact O-N 3.05Å
551	S	48.9	Very low	48	Very low	24 Å²	24	48 Å²	48	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-37.3	171.4	56.6	0	0	0	0	112.3	Y547 L548 L554 A555	Y547-S551 VanDerWaalsContact O-CB 3.25Å; Y547-S551 WeakPolarHBondContact O-CB 3.26Å; Y547-S551 PolarHBondContact O-N 3.5Å; Y547-S551 PolarHBondContact O-OG 2.92Å; L548-S551 WeakPolarHBondContact CA-OG 3.11Å; L548-S551 PolarHBondContact O-OG 2.94Å; S551-L554 PolarHBondContact O-N 3.41Å; S551-A555 WeakPolarHBondContact O-CB 3.46Å; S551-A555 PolarHBondContact O-N 3.03Å
552	G	51.1	Low	47	Very low	13 Å²	13	50.2 Å²	50.2	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-43.7	173.3	0	0	0	0	0	112.9	L548 A549 L554 A555 C556	L548-G552 PolarHBondContact O-N 3.28Å; A549-G552 PolarHBondContact O-N 3.39Å; G552-L554 PolarHBondContact O-N 2.98Å; G552-A555 PolarHBondContact O-N 3.33Å; G552-C556 PolarHBondContact O-N 3.29Å; G552-C556 PolarHBondContact O-SG 3.22Å; G552-C556 VanDerWaalsContact O-SG 3.33Å
553	V	49.4	Very low	45.9	Very low	3 Å²	3	53.5 Å²	53.5	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-42.8	174.4	171.1	0	0	0	0	111.5	L468 V484 L488 A549 F550 C556 S557	L468-V553 HydrophobicContact CD1-CG1 3.98Å; V484-V553 HydrophobicContact CG1-CG2 4.3Å; L488-V553 HydrophobicContact CD2-CG2 4.37Å; L488-V553 HydrophobicContact CG-CG2 4.46Å; A549-V553 WeakPolarHBondContact O-CG2 3.26Å; A549-V553 PolarHBondContact O-N 3.34Å; F550-V553 PolarHBondContact O-N 2.86Å; V553-C556 PolarHBondContact O-N 3.12Å; V553-S557 PolarHBondContact O-N 3.15Å
554	L	48.4	Very low	45	Very low	36 Å²	36	57.2 Å²	57.2	19%	0.188	30%	0.3	C	S	.	.	H	α-helix	trans	-66.8	-41.4	176.5	-70.5	170.6	0	0	0	112	L461 F550 S551 G552 C556 S557 D558	L461-L554 HydrophobicContact CD2-CD1 3.45Å; L461-L554 VanDerWaalsContact CD2-CD1 3.45Å; F550-L554 VanDerWaalsContact O-CG 3.3Å; F550-L554 WeakPolarHBondContact O-CG 3.38Å; F550-L554 PolarHBondContact O-N 3.05Å; S551-L554 PolarHBondContact O-N 3.41Å; G552-L554 PolarHBondContact O-N 2.98Å; L554-C556 VanDerWaalsContact C-N 3.33Å; L554-C556 PolarHBondContact O-N 3.49Å; L554-S557 CarbonylContact O-C 3.56Å; L554-S557 WeakPolarHBondContact O-CA 3.29Å; L554-S557 VanDerWaalsContact O-CB 3.31Å; L554-S557 WeakPolarHBondContact O-CB 3.39Å; L554-S557 PolarHBondContact O-N 2.82Å; L554-D558 PolarHBondContact O-N 3.31Å
555	A	48	Very low	44.2	Very low	45 Å²	45	57 Å²	57	37%	0.372	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-40.1	175.8	0	0	0	0	0	112	S551 G552 S557 D558 F559	S551-A555 WeakPolarHBondContact O-CB 3.46Å; S551-A555 PolarHBondContact O-N 3.03Å; G552-A555 PolarHBondContact O-N 3.33Å; A555-S557 VanDerWaalsContact C-N 3.33Å; A555-D558 PolarHBondContact O-N 3.45Å; A555-F559 VanDerWaalsContact O-CB 3.27Å; A555-F559 WeakPolarHBondContact O-CB 3.37Å; A555-F559 PolarHBondContact O-N 3.18Å
556	C	44.3	Very low	43.5	Very low	36 Å²	36	60 Å²	60	24%	0.243	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-38.5	172	-69.2	0	0	0	0	112.3	G552 V553 L554 L560	G552-C556 PolarHBondContact O-N 3.29Å; G552-C556 PolarHBondContact O-SG 3.22Å; G552-C556 VanDerWaalsContact O-SG 3.33Å; V553-C556 PolarHBondContact O-N 3.12Å; L554-C556 VanDerWaalsContact C-N 3.33Å; L554-C556 PolarHBondContact O-N 3.49Å; C556-L560 PolarHBondContact O-N 2.92Å
557	S	42.9	Very low	42.6	Very low	17 Å²	17	65.3 Å²	65.3	12%	0.119	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-43.1	173.8	172.5	0	0	0	0	112	V553 L554 A555 R561	V553-S557 PolarHBondContact O-N 3.15Å; L554-S557 CarbonylContact O-C 3.56Å; L554-S557 WeakPolarHBondContact O-CA 3.29Å; L554-S557 VanDerWaalsContact O-CB 3.31Å; L554-S557 WeakPolarHBondContact O-CB 3.39Å; L554-S557 PolarHBondContact O-N 2.82Å; A555-S557 VanDerWaalsContact C-N 3.33Å; S557-R561 WeakPolarHBondContact O-CG 3.49Å; S557-R561 PolarHBondContact O-N 3.1Å; S557-R561 VanDerWaalsContact O-N 3.12Å
558	D	43	Very low	42	Very low	71 Å²	71	67.4 Å²	67.4	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-73.7	-37.6	-177.3	-69.3	-22.8	0	0	0	112.6	L554 A555 L560 R561 G562 F563	L554-D558 PolarHBondContact O-N 3.31Å; A555-D558 PolarHBondContact O-N 3.45Å; D558-L560 VanDerWaalsContact C-N 3.27Å; D558-L560 PolarHBondContact O-N 2.87Å; D558-R561 PolarHBondContact O-N 2.67Å; D558-R561 VanDerWaalsContact O-N 3.12Å; D558-G562 PolarHBondContact O-N 2.66Å; D558-F563 PolarHBondContact O-N 3.37Å
559	F	37.9	Very low	41	Very low	139 Å²	139	71.3 Å²	71.3	61%	0.61	39%	0.392	S	S	*	.	H	α-helix	trans	-56.1	-41.2	173.1	178.4	-101.2	0	0	0	111.7	A555 G562	A555-F559 VanDerWaalsContact O-CB 3.27Å; A555-F559 WeakPolarHBondContact O-CB 3.37Å; A555-F559 PolarHBondContact O-N 3.18Å; F559-G562 PolarHBondContact O-N 2.72Å
560	L	34.9	Very low	40.1	Very low	100 Å²	100	74.9 Å²	74.9	52%	0.524	41%	0.41	S	S	.	.	H	α-helix	trans	-82.9	-19.2	178.4	-70	169.4	0	0	0	113.6	I480 C556 D558 G562	I480-L560 HydrophobicContact CD1-CD1 3.12Å; I480-L560 HydrophobicContact CD1-CG 4.49Å; I480-L560 HydrophobicContact CG1-CD1 3.3Å; C556-L560 PolarHBondContact O-N 2.92Å; D558-L560 VanDerWaalsContact C-N 3.27Å; D558-L560 PolarHBondContact O-N 2.87Å; L560-G562 PolarHBondContact O-N 3.35Å
561	R	38	Very low	39.2	Very low	176 Å²	176	78 Å²	78	66%	0.664	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	5.2	166.5	-75	178.8	175.7	175.3	-0.2	113.3	S557 D558 F563	S557-R561 WeakPolarHBondContact O-CG 3.49Å; S557-R561 PolarHBondContact O-N 3.1Å; S557-R561 VanDerWaalsContact O-N 3.12Å; D558-R561 PolarHBondContact O-N 2.67Å; D558-R561 VanDerWaalsContact O-N 3.12Å; R561-F563 VanDerWaalsContact C-N 3.33Å; R561-F563 HydrophobicContact CB-CD2 4.1Å; R561-F563 HydrophobicContact CB-CE2 4.47Å
562	G	30.1	Very low	38.4	Very low	55 Å²	55	79.4 Å²	79.4	57%	0.567	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	15.3	173.3	0	0	0	0	0	113.9	D558 F559 L560 N564	D558-G562 PolarHBondContact O-N 2.66Å; F559-G562 PolarHBondContact O-N 2.72Å; L560-G562 PolarHBondContact O-N 3.35Å; G562-N564 PolarHBondContact O-N 3.16Å
563	F	31	Very low	37.6	Very low	147 Å²	147	80.5 Å²	80.5	65%	0.645	44%	0.436	S	S	*	.			trans	-80.8	108.2	172.3	-75.6	-79.8	0	0	0	109.7	D558 R561 S565	D558-F563 PolarHBondContact O-N 3.37Å; R561-F563 VanDerWaalsContact C-N 3.33Å; R561-F563 HydrophobicContact CB-CD2 4.1Å; R561-F563 HydrophobicContact CB-CE2 4.47Å; F563-S565 PolarHBondContact O-N 3.04Å
564	N	30.8	Very low	37.2	Very low	160 Å²	160	83 Å²	83	86%	0.856	45%	0.449	S	S	*	.			trans	-69.2	86.7	175.6	-74.9	-26.6	0	0	0	111.1	G562	G562-N564 PolarHBondContact O-N 3.16Å
565	S	36.1	Very low	36.8	Very low	64 Å²	64	84.8 Å²	84.8	45%	0.448	46%	0.456	S	S	.	.			trans	-140.6	78.6	161	64.4	0	0	0	0	111.1	F563	F563-S565 PolarHBondContact O-N 3.04Å
566	P	38.8	Very low	36.2	Very low	66 Å²	66	87.9 Å²	87.9	43%	0.429	46%	0.461	S	S	.	.			trans	-82.6	-41.4	-165.7	-12.5	29.6	0	0	0	114.9
567	D	33.9	Very low	35.9	Very low	122 Å²	122	86.2 Å²	86.2	65%	0.652	45%	0.45	S	S	*	.	H	α-helix	trans	-109.2	-33.9	-156	-60.3	-37.2	0	0	0	115.8	D571	D567-D571 PolarHBondContact O-N 3.42Å
568	S	36	Very low	36	Very low	84 Å²	84	88.3 Å²	88.3	59%	0.587	46%	0.457	S	S	*	.	H	α-helix	trans	-76.2	-28.3	-177.8	61.7	0	0	0	0	113.5	V572	S568-V572 PolarHBondContact O-N 3.08Å
569	F	31.5	Very low	36.1	Very low	118 Å²	118	89.5 Å²	89.5	52%	0.518	46%	0.463	S	S	.	.	H	α-helix	trans	-75	-38.8	177	-94.9	-90	0	0	0	111.8	F573	F569-F573 AromaticContact CD1-CD2 3.82Å; F569-F573 HydrophobicContact CD1-CD2 3.82Å; F569-F573 AromaticContact CD1-CE2 3.84Å; F569-F573 HydrophobicContact CD1-CE2 3.84Å; F569-F573 HydrophobicContact CE1-CD2 4.37Å; F569-F573 AromaticContact CE1-CE2 3.93Å; F569-F573 HydrophobicContact CE1-CE2 3.93Å; F569-F573 WeakPolarHBondContact O-CB 3.48Å; F569-F573 WeakPolarHBondContact O-CD2 3.3Å; F569-F573 PolarHBondContact O-N 3.41Å
570	L	32.5	Very low	36.3	Very low	81 Å²	81	85.9 Å²	85.9	42%	0.424	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-43.2	177.2	-114.9	91.3	0	0	0	111.8	I574 Q575	L570-I574 HydrophobicContact CD1-CD1 4.48Å; L570-I574 HydrophobicContact CD2-CD1 4.33Å; L570-I574 HydrophobicContact CG-CD1 3.8Å; L570-I574 HydrophobicContact CG-CG1 4.45Å; L570-I574 WeakPolarHBondContact O-CA 3.46Å; L570-I574 WeakPolarHBondContact O-CB 3.44Å; L570-I574 PolarHBondContact O-N 3.39Å; L570-Q575 PolarHBondContact O-N 3.01Å
571	D	35.5	Very low	36.9	Very low	80 Å²	80	81.7 Å²	81.7	43%	0.428	43%	0.431	S	S	.	.	I	π-helix	trans	-73.2	-42.7	-174.3	-81.4	-11.7	0	0	0	113.4	D567 Q575 F576	D567-D571 PolarHBondContact O-N 3.42Å; D571-Q575 VanDerWaalsContact O-CB 3.27Å; D571-Q575 WeakPolarHBondContact O-CB 3.45Å; D571-Q575 PolarHBondContact O-N 2.98Å; D571-F576 PolarHBondContact O-N 2.91Å
572	V	32.9	Very low	37.7	Very low	54 Å²	54	74.8 Å²	74.8	33%	0.327	41%	0.406	S	S	.	.	I	π-helix	trans	-76.8	-35.8	-177.8	177.1	0	0	0	0	111.4	S568 F576	S568-V572 PolarHBondContact O-N 3.08Å; V572-F576 WeakPolarHBondContact O-CB 3.35Å
573	F	34.8	Very low	38.8	Very low	36 Å²	36	74.2 Å²	74.2	16%	0.158	39%	0.391	C	S	.	.	I	π-helix	trans	-93.4	-36.1	-177.2	-67.4	-74	0	0	0	112.7	Y547 L548 F569 P577	Y547-F573 AromaticContact CE1-CD1 3.57Å; Y547-F573 HydrophobicContact CE1-CD1 3.57Å; Y547-F573 AromaticContact CE1-CE1 3.57Å; Y547-F573 HydrophobicContact CE1-CE1 3.57Å; Y547-F573 AromaticContact CZ-CE1 3.72Å; Y547-F573 WeakPolarHBondContact OH-CE1 3.43Å; L548-F573 WeakPolarHBondContact CD2-O 3.44Å; F569-F573 AromaticContact CD1-CD2 3.82Å; F569-F573 HydrophobicContact CD1-CD2 3.82Å; F569-F573 AromaticContact CD1-CE2 3.84Å; F569-F573 HydrophobicContact CD1-CE2 3.84Å; F569-F573 HydrophobicContact CE1-CD2 4.37Å; F569-F573 AromaticContact CE1-CE2 3.93Å; F569-F573 HydrophobicContact CE1-CE2 3.93Å; F569-F573 WeakPolarHBondContact O-CB 3.48Å; F569-F573 WeakPolarHBondContact O-CD2 3.3Å; F569-F573 PolarHBondContact O-N 3.41Å; F573-P577 WeakPolarHBondContact O-CD 3.49Å; F573-P577 WeakPolarHBondContact O-CG 3.38Å
574	I	39.5	Very low	39.7	Very low	55 Å²	55	70.5 Å²	70.5	28%	0.282	38%	0.377	S	S	.	.	I	π-helix	trans	-91.8	-43.3	-179.6	-50.9	-170.5	0	0	0	112.2	L570 K578	L570-I574 HydrophobicContact CD1-CD1 4.48Å; L570-I574 HydrophobicContact CD2-CD1 4.33Å; L570-I574 HydrophobicContact CG-CD1 3.8Å; L570-I574 HydrophobicContact CG-CG1 4.45Å; L570-I574 WeakPolarHBondContact O-CA 3.46Å; L570-I574 WeakPolarHBondContact O-CB 3.44Å; L570-I574 PolarHBondContact O-N 3.39Å; I574-K578 HydrophobicContact CG2-CD 4.1Å; I574-K578 WeakPolarHBondContact O-CB 3.34Å; I574-K578 VanDerWaalsContact O-CG 3.26Å; I574-K578 WeakPolarHBondContact O-CG 3.34Å; I574-K578 PolarHBondContact O-N 3.31Å
575	Q	40	Very low	41	Very low	74 Å²	74	62.9 Å²	62.9	35%	0.346	34%	0.337	S	S	.	.	I	π-helix	trans	-80.8	-46.7	-171.7	-63.6	-98.1	-20.9	0	0	113.7	L570 D571 K578 L579	L570-Q575 PolarHBondContact O-N 3.01Å; D571-Q575 VanDerWaalsContact O-CB 3.27Å; D571-Q575 WeakPolarHBondContact O-CB 3.45Å; D571-Q575 PolarHBondContact O-N 2.98Å; Q575-K578 WeakPolarHBondContact O-CB 3.28Å; Q575-K578 PolarHBondContact O-N 3.48Å; Q575-L579 PolarHBondContact O-N 3.22Å
576	F	35.8	Very low	42	Very low	110 Å²	110	61.3 Å²	61.3	48%	0.482	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-41.1	-179	-177.3	-99.4	0	0	0	113.2	D571 V572 L579 V580	D571-F576 PolarHBondContact O-N 2.91Å; V572-F576 WeakPolarHBondContact O-CB 3.35Å; F576-L579 PolarHBondContact O-N 2.82Å; F576-V580 HydrophobicContact CD2-CG2 4.49Å; F576-V580 HydrophobicContact CE1-CG2 4.34Å; F576-V580 HydrophobicContact CE2-CG2 4.2Å; F576-V580 HydrophobicContact CZ-CG2 4.12Å; F576-V580 WeakPolarHBondContact O-CG2 3.43Å; F576-V580 PolarHBondContact O-N 3.14Å
577	P	38.9	Very low	42.8	Very low	1 Å²	1	63 Å²	63	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-78.7	-32.6	177	-19.3	38.9	0	0	0	112.3	Y544 L548 F573 L579 V580 V581 F582	Y544-P577 HydrophobicContact CD1-CB 4.05Å; Y544-P577 HydrophobicContact CD1-CG 4.25Å; Y544-P577 HydrophobicContact CE1-CB 3.59Å; Y544-P577 HydrophobicContact CE1-CG 3.3Å; L548-P577 HydrophobicContact CD1-CB 3.5Å; L548-P577 VanDerWaalsContact CD1-CB 3.5Å; L548-P577 HydrophobicContact CD1-CG 4.16Å; L548-P577 HydrophobicContact CD2-CB 4.01Å; L548-P577 HydrophobicContact CD2-CG 3.73Å; L548-P577 HydrophobicContact CG-CB 4.28Å; L548-P577 HydrophobicContact CG-CG 4.42Å; F573-P577 WeakPolarHBondContact O-CD 3.49Å; F573-P577 WeakPolarHBondContact O-CG 3.38Å; P577-L579 PolarHBondContact O-N 3.31Å; P577-V580 PolarHBondContact O-N 3.08Å; P577-V581 HydrophobicContact CB-CG2 3.98Å; P577-V581 WeakPolarHBondContact O-CA 3.33Å; P577-V581 WeakPolarHBondContact O-CB 3.14Å; P577-V581 PolarHBondContact O-N 3.03Å; P577-F582 PolarHBondContact O-N 3.28Å
578	K	44.5	Very low	43.8	Very low	61 Å²	61	58.1 Å²	58.1	27%	0.265	30%	0.298	S	S	.	.	H	α-helix	trans	-54.8	-40.3	167	-85.9	179.1	-174.1	175.4	0	111	I574 Q575 F582 E768	I574-K578 HydrophobicContact CG2-CD 4.1Å; I574-K578 WeakPolarHBondContact O-CB 3.34Å; I574-K578 VanDerWaalsContact O-CG 3.26Å; I574-K578 WeakPolarHBondContact O-CG 3.34Å; I574-K578 PolarHBondContact O-N 3.31Å; Q575-K578 WeakPolarHBondContact O-CB 3.28Å; Q575-K578 PolarHBondContact O-N 3.48Å; K578-F582 HydrophobicContact CB-CD2 4.37Å; K578-F582 HydrophobicContact CG-CD2 4.28Å; K578-F582 HydrophobicContact CG-CE2 3.94Å; K578-F582 VanDerWaalsContact O-CB 3.23Å; K578-F582 WeakPolarHBondContact O-CB 3.17Å; K578-E768 IonicContact NZ-OE2 2.74Å; K578-E768 PolarHBondContact NZ-OE2 3.45Å
579	L	44.5	Very low	45	Very low	96 Å²	96	54.1 Å²	54.1	50%	0.503	27%	0.27	S	S	.	.	H	α-helix	trans	-76.4	-41.2	179.4	-76.7	158.3	0	0	0	113	Q575 F576 P577 T583	Q575-L579 PolarHBondContact O-N 3.22Å; F576-L579 PolarHBondContact O-N 2.82Å; P577-L579 PolarHBondContact O-N 3.31Å; L579-T583 WeakPolarHBondContact O-CB 3.46Å; L579-T583 PolarHBondContact O-OG1 3.45Å
580	V	42.1	Very low	46.4	Very low	63 Å²	63	48.7 Å²	48.7	38%	0.382	25%	0.246	S	C	.	.	H	α-helix	trans	-91.6	-51.1	-174.3	178.9	0	0	0	0	112.2	F576 P577 T583 L584	F576-V580 HydrophobicContact CD2-CG2 4.49Å; F576-V580 HydrophobicContact CE1-CG2 4.34Å; F576-V580 HydrophobicContact CE2-CG2 4.2Å; F576-V580 HydrophobicContact CZ-CG2 4.12Å; F576-V580 WeakPolarHBondContact O-CG2 3.43Å; F576-V580 PolarHBondContact O-N 3.14Å; P577-V580 PolarHBondContact O-N 3.08Å; V580-T583 PolarHBondContact O-N 3.42Å; V580-L584 HydrophobicContact CG1-CD1 3.82Å; V580-L584 HydrophobicContact CG1-CG 4.48Å; V580-L584 WeakPolarHBondContact O-CB 3.48Å; V580-L584 VanDerWaalsContact O-CG 3.24Å; V580-L584 WeakPolarHBondContact O-CG 3.34Å; V580-L584 PolarHBondContact O-N 3.16Å
581	V	48.1	Very low	47.7	Very low	13 Å²	13	45.9 Å²	45.9	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-44.1	-176.2	-179	0	0	0	0	111.1	C541 Y544 P577 L585	C541-V581 HydrophobicContact CB-CG1 4.15Å; Y544-V581 HydrophobicContact CD1-CG2 4.28Å; P577-V581 HydrophobicContact CB-CG2 3.98Å; P577-V581 WeakPolarHBondContact O-CA 3.33Å; P577-V581 WeakPolarHBondContact O-CB 3.14Å; P577-V581 PolarHBondContact O-N 3.03Å; V581-L585 HydrophobicContact CG1-CD1 3.7Å; V581-L585 HydrophobicContact CG1-CG 4.38Å; V581-L585 VanDerWaalsContact O-CB 3.3Å; V581-L585 WeakPolarHBondContact O-CB 3.46Å; V581-L585 WeakPolarHBondContact O-CD1 3.25Å; V581-L585 VanDerWaalsContact O-CG 3.29Å; V581-L585 WeakPolarHBondContact O-CG 3.48Å; V581-L585 PolarHBondContact O-N 2.66Å
582	F	55.3	Low	48.8	Very low	31 Å²	31	42.4 Å²	42.4	14%	0.136	22%	0.218	C	C	.	.	H	α-helix	trans	-69.9	-38	177.2	-72.5	-113.5	0	0	0	112.1	L494 P577 K578 L585 R586 M762 L765	L494-F582 HydrophobicContact CD1-CZ 4.49Å; P577-F582 PolarHBondContact O-N 3.28Å; K578-F582 HydrophobicContact CB-CD2 4.37Å; K578-F582 HydrophobicContact CG-CD2 4.28Å; K578-F582 HydrophobicContact CG-CE2 3.94Å; K578-F582 VanDerWaalsContact O-CB 3.23Å; K578-F582 WeakPolarHBondContact O-CB 3.17Å; F582-L585 PolarHBondContact O-N 3.25Å; F582-R586 VanDerWaalsContact O-CB 3.22Å; F582-R586 WeakPolarHBondContact O-CB 3.45Å; F582-R586 WeakPolarHBondContact O-CG 3.43Å; F582-R586 PolarHBondContact O-N 3.26Å; F582-M762 HydrophobicContact CB-CE 4.09Å; F582-M762 HydrophobicContact CD1-CE 3.31Å; F582-M762 HydrophobicContact CD1-SD 4.2Å; F582-M762 HydrophobicContact CE1-CE 3.93Å; F582-M762 HydrophobicContact CE1-SD 4.24Å; F582-M762 HydrophobicContact CG-CE 3.89Å; F582-L765 HydrophobicContact CE1-CB 4.23Å; F582-L765 HydrophobicContact CE1-CD1 3.47Å; F582-L765 VanDerWaalsContact CE1-CD1 3.47Å; F582-L765 HydrophobicContact CE1-CG 4.39Å; F582-L765 HydrophobicContact CZ-CD1 4.06Å
583	T	53	Low	50.1	Low	43 Å²	43	40 Å²	40	26%	0.264	20%	0.204	S	C	.	.	H	α-helix	trans	-65.6	-41.4	177.8	-58.2	0	0	0	0	110.9	L579 V580 R586 Q587 N664	L579-T583 WeakPolarHBondContact O-CB 3.46Å; L579-T583 PolarHBondContact O-OG1 3.45Å; V580-T583 PolarHBondContact O-N 3.42Å; T583-R586 PolarHBondContact O-N 3.24Å; T583-Q587 WeakPolarHBondContact O-CB 3.44Å; T583-Q587 PolarHBondContact O-N 3.22Å; T583-N664 WeakPolarHBondContact CG2-OD1 3.46Å
584	L	49.7	Very low	51.2	Low	68 Å²	68	39.6 Å²	39.6	36%	0.356	21%	0.205	S	C	.	.	H	α-helix	trans	-64.3	-49.3	173.3	-73.3	171.8	0	0	0	111.7	V580 R586 Q587 V588	V580-L584 HydrophobicContact CG1-CD1 3.82Å; V580-L584 HydrophobicContact CG1-CG 4.48Å; V580-L584 WeakPolarHBondContact O-CB 3.48Å; V580-L584 VanDerWaalsContact O-CG 3.24Å; V580-L584 WeakPolarHBondContact O-CG 3.34Å; V580-L584 PolarHBondContact O-N 3.16Å; L584-R586 VanDerWaalsContact C-N 3.29Å; L584-R586 PolarHBondContact O-N 2.89Å; L584-Q587 PolarHBondContact O-N 2.96Å; L584-V588 VanDerWaalsContact O-CG2 3.29Å; L584-V588 WeakPolarHBondContact O-CG2 3.47Å; L584-V588 PolarHBondContact O-N 3.1Å
585	L	56.7	Low	52.2	Low	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-58.2	-41.2	176.5	-78.6	164.2	0	0	0	112.1	L494 I498 L501 L538 V581 F582 V588 L589 M762	L494-L585 HydrophobicContact CD1-CD1 3.73Å; I498-L585 HydrophobicContact CD1-CD1 4.15Å; I498-L585 HydrophobicContact CG1-CD1 4.11Å; I498-L585 HydrophobicContact CG1-CD2 3.8Å; L501-L585 HydrophobicContact CD1-CD2 3.72Å; L538-L585 HydrophobicContact CD2-CD2 4.26Å; V581-L585 HydrophobicContact CG1-CD1 3.7Å; V581-L585 HydrophobicContact CG1-CG 4.38Å; V581-L585 VanDerWaalsContact O-CB 3.3Å; V581-L585 WeakPolarHBondContact O-CB 3.46Å; V581-L585 WeakPolarHBondContact O-CD1 3.25Å; V581-L585 VanDerWaalsContact O-CG 3.29Å; V581-L585 WeakPolarHBondContact O-CG 3.48Å; V581-L585 PolarHBondContact O-N 2.66Å; F582-L585 PolarHBondContact O-N 3.25Å; L585-V588 PolarHBondContact O-N 2.82Å; L585-L589 WeakPolarHBondContact O-CB 3.3Å; L585-L589 VanDerWaalsContact O-CG 3.31Å; L585-L589 WeakPolarHBondContact O-CG 3.48Å; L585-L589 PolarHBondContact O-N 2.94Å; L585-M762 HydrophobicContact CB-CE 3.76Å; L585-M762 HydrophobicContact CD1-CE 4.02Å
586	R	59	Low	53	Low	30 Å²	30	37.2 Å²	37.2	11%	0.113	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-49.2	174.5	-78.4	175.4	-179	178.2	0.7	111.2	F582 T583 L584 V588 L589 Y590 E763	F582-R586 VanDerWaalsContact O-CB 3.22Å; F582-R586 WeakPolarHBondContact O-CB 3.45Å; F582-R586 WeakPolarHBondContact O-CG 3.43Å; F582-R586 PolarHBondContact O-N 3.26Å; T583-R586 PolarHBondContact O-N 3.24Å; L584-R586 VanDerWaalsContact C-N 3.29Å; L584-R586 PolarHBondContact O-N 2.89Å; R586-V588 VanDerWaalsContact C-N 3.26Å; R586-V588 PolarHBondContact O-N 3.35Å; R586-L589 PolarHBondContact O-N 3.49Å; R586-Y590 HydrophobicContact CB-CD2 4.1Å; R586-Y590 HydrophobicContact CB-CE2 4.09Å; R586-Y590 HydrophobicContact CG-CE2 4.34Å; R586-Y590 WeakPolarHBondContact O-CB 3.36Å; R586-Y590 WeakPolarHBondContact O-CD2 3.35Å; R586-Y590 PolarHBondContact O-N 2.8Å; R586-E763 WeakPolarHBondContact CD-OE1 3.16Å; R586-E763 IonicContact CZ-OE1 2.76Å; R586-E763 IonicContact CZ-OE2 2.89Å; R586-E763 IonicContact NE-OE1 3Å; R586-E763 PolarHBondContact NE-OE1 2.87Å; R586-E763 IonicContact NH1-OE1 3.69Å; R586-E763 IonicContact NH2-OE1 3.45Å; R586-E763 IonicContact NH2-OE2 2.83Å
587	Q	55.1	Low	54.1	Low	101 Å²	101	32 Å²	32	47%	0.472	17%	0.171	S	C	.	.	H	α-helix	trans	-57.9	-41.8	178.2	-176.6	179	-11.3	0	0	111.5	T583 L584 G591 N664	T583-Q587 WeakPolarHBondContact O-CB 3.44Å; T583-Q587 PolarHBondContact O-N 3.22Å; L584-Q587 PolarHBondContact O-N 2.96Å; Q587-G591 PolarHBondContact O-N 2.68Å; Q587-N664 PolarHBondContact OE1-ND2 3.18Å
588	V	55.5	Low	55	Low	20 Å²	20	38.2 Å²	38.2	12%	0.121	20%	0.195	C	C	.	.	H	α-helix	trans	-62.5	-52.2	175	166.9	0	0	0	0	111.2	L501 F534 L538 L584 L585 R586 Y590 G591 L592	L501-V588 HydrophobicContact CD2-CG1 4.34Å; F534-V588 HydrophobicContact CE1-CG1 4.03Å; F534-V588 HydrophobicContact CE1-CG2 4.44Å; F534-V588 HydrophobicContact CE2-CG2 3.59Å; F534-V588 HydrophobicContact CZ-CB 3.99Å; F534-V588 HydrophobicContact CZ-CG1 3.51Å; F534-V588 HydrophobicContact CZ-CG2 3.42Å; F534-V588 VanDerWaalsContact CZ-CG2 3.42Å; L538-V588 HydrophobicContact CD2-CG1 4.46Å; L584-V588 VanDerWaalsContact O-CG2 3.29Å; L584-V588 WeakPolarHBondContact O-CG2 3.47Å; L584-V588 PolarHBondContact O-N 3.1Å; L585-V588 PolarHBondContact O-N 2.82Å; R586-V588 VanDerWaalsContact C-N 3.26Å; R586-V588 PolarHBondContact O-N 3.35Å; V588-Y590 PolarHBondContact O-N 2.82Å; V588-G591 PolarHBondContact O-N 3.46Å; V588-L592 HydrophobicContact CG1-CD1 3.7Å; V588-L592 HydrophobicContact CG1-CG 4.4Å; V588-L592 WeakPolarHBondContact O-CB 3.48Å; V588-L592 WeakPolarHBondContact O-CG 3.32Å; V588-L592 PolarHBondContact O-N 3.44Å
589	L	59.8	Low	55.6	Low	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-47.4	-179.1	-80.3	164.3	0	0	0	112.3	V497 L501 L585 R586 L592 A593 A758 V759 M762	V497-L589 HydrophobicContact CG1-CD1 4.29Å; L501-L589 HydrophobicContact CD1-CD1 4.36Å; L501-L589 HydrophobicContact CD1-CD2 3.97Å; L501-L589 HydrophobicContact CD1-CG 3.91Å; L501-L589 HydrophobicContact CD2-CD2 3.46Å; L501-L589 VanDerWaalsContact CD2-CD2 3.46Å; L501-L589 HydrophobicContact CD2-CG 4.05Å; L501-L589 HydrophobicContact CG-CD2 3.93Å; L501-L589 HydrophobicContact CG-CG 4.41Å; L585-L589 WeakPolarHBondContact O-CB 3.3Å; L585-L589 VanDerWaalsContact O-CG 3.31Å; L585-L589 WeakPolarHBondContact O-CG 3.48Å; L585-L589 PolarHBondContact O-N 2.94Å; R586-L589 PolarHBondContact O-N 3.49Å; L589-L592 PolarHBondContact O-N 3.48Å; L589-A593 WeakPolarHBondContact O-CB 3.41Å; L589-A593 PolarHBondContact O-N 2.82Å; L589-A758 HydrophobicContact CD2-CB 3.66Å; L589-V759 HydrophobicContact CB-CG2 3.72Å; L589-V759 HydrophobicContact CD1-CG2 4.44Å; L589-V759 HydrophobicContact CD2-CG2 4.31Å; L589-V759 HydrophobicContact CG-CG2 4.4Å; L589-M762 HydrophobicContact CD1-CB 4.44Å; L589-M762 HydrophobicContact CD1-CG 3.81Å
590	Y	61.8	Low	56.1	Low	4 Å²	4	32.6 Å²	32.6	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-66.1	-39.3	178	-76.5	-59.8	0	0	0	111.9	R586 V588 S594 V653 V656 S657 F660 V759 E763	R586-Y590 HydrophobicContact CB-CD2 4.1Å; R586-Y590 HydrophobicContact CB-CE2 4.09Å; R586-Y590 HydrophobicContact CG-CE2 4.34Å; R586-Y590 WeakPolarHBondContact O-CB 3.36Å; R586-Y590 WeakPolarHBondContact O-CD2 3.35Å; R586-Y590 PolarHBondContact O-N 2.8Å; V588-Y590 PolarHBondContact O-N 2.82Å; Y590-S594 WeakPolarHBondContact O-CB 3.02Å; Y590-S594 PolarHBondContact O-N 2.97Å; Y590-V653 HydrophobicContact CD1-CG1 4.45Å; Y590-V656 HydrophobicContact CD1-CG1 4.06Å; Y590-V656 HydrophobicContact CE1-CB 4.43Å; Y590-V656 HydrophobicContact CE1-CG1 3.53Å; Y590-V656 HydrophobicContact CE2-CG1 4.33Å; Y590-S657 PolarHBondContact O-OG 2.95Å; Y590-F660 AromaticContact CD2-CD2 3.78Å; Y590-F660 HydrophobicContact CD2-CD2 3.78Å; Y590-F660 AromaticContact CD2-CE2 3.85Å; Y590-F660 HydrophobicContact CD2-CE2 3.85Å; Y590-F660 HydrophobicContact CD2-CG 4.43Å; Y590-F660 AromaticContact CE2-CD2 3.62Å; Y590-F660 HydrophobicContact CE2-CD2 3.62Å; Y590-F660 AromaticContact CE2-CE2 3.18Å; Y590-F660 HydrophobicContact CE2-CE2 3.18Å; Y590-F660 AromaticContact CE2-CZ 3.75Å; Y590-F660 HydrophobicContact CE2-CZ 3.75Å; Y590-F660 AromaticContact CZ-CE2 3.63Å; Y590-V759 HydrophobicContact CD1-CG1 4.48Å; Y590-V759 HydrophobicContact CE1-CG1 3.62Å; Y590-V759 WeakPolarHBondContact OH-CG1 3.39Å; Y590-E763 PolarHBondContact OH-OE1 2.73Å
591	G	60.1	Low	56.8	Low	21 Å²	21	34 Å²	34	22%	0.216	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-48.2	174.3	0	0	0	0	0	112.8	Q587 V588 H595	Q587-G591 PolarHBondContact O-N 2.68Å; V588-G591 PolarHBondContact O-N 3.46Å; G591-H595 WeakPolarHBondContact O-CB 3.41Å; G591-H595 PolarHBondContact O-N 3.19Å
592	L	57.1	Low	57.3	Low	8 Å²	8	35.3 Å²	35.3	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-46.5	176.7	-71.5	170.9	0	0	0	111.4	L501 V505 V529 V588 L589 S594 H595 V596 Y755	L501-L592 HydrophobicContact CD2-CD1 3.84Å; V505-L592 HydrophobicContact CG2-CD1 4.05Å; V529-L592 HydrophobicContact CG2-CD2 4.07Å; V588-L592 HydrophobicContact CG1-CD1 3.7Å; V588-L592 HydrophobicContact CG1-CG 4.4Å; V588-L592 WeakPolarHBondContact O-CB 3.48Å; V588-L592 WeakPolarHBondContact O-CG 3.32Å; V588-L592 PolarHBondContact O-N 3.44Å; L589-L592 PolarHBondContact O-N 3.48Å; L592-S594 PolarHBondContact O-N 2.88Å; L592-H595 PolarHBondContact O-N 3.35Å; L592-V596 VanDerWaalsContact O-CG2 3.3Å; L592-V596 WeakPolarHBondContact O-CG2 3.33Å; L592-V596 PolarHBondContact O-N 2.74Å; L592-Y755 HydrophobicContact CB-CD1 4.23Å; L592-Y755 HydrophobicContact CB-CE1 3.89Å; L592-Y755 HydrophobicContact CD1-CE1 3.89Å; L592-Y755 HydrophobicContact CG-CE1 4.43Å
593	A	60.1	Low	57.3	Low	4 Å²	4	36.5 Å²	36.5	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-45.4	178.1	0	0	0	0	0	112	L589 H595 V596 L597 V653	L589-A593 WeakPolarHBondContact O-CB 3.41Å; L589-A593 PolarHBondContact O-N 2.82Å; A593-H595 VanDerWaalsContact C-N 3.33Å; A593-H595 PolarHBondContact O-N 3.07Å; A593-V596 PolarHBondContact O-N 3.23Å; A593-L597 WeakPolarHBondContact O-CB 2.91Å; A593-L597 WeakPolarHBondContact O-CD1 3.29Å; A593-L597 WeakPolarHBondContact O-CG 3.38Å; A593-L597 PolarHBondContact O-N 3.28Å; A593-V653 HydrophobicContact CB-CG1 3.93Å
594	S	59.7	Low	57.3	Low	26 Å²	26	35.3 Å²	35.3	18%	0.182	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-43.3	175.2	-178.6	0	0	0	0	111.8	Y590 L592 Y598	Y590-S594 WeakPolarHBondContact O-CB 3.02Å; Y590-S594 PolarHBondContact O-N 2.97Å; L592-S594 PolarHBondContact O-N 2.88Å; S594-Y598 PolarHBondContact O-N 3.31Å
595	H	59.3	Low	57.5	Low	68 Å²	68	38 Å²	38	32%	0.315	19%	0.19	S	C	.	.	H	α-helix	trans	-67.4	-45.9	178	-174.9	72.5	0	0	0	112.7	F514 G591 L592 A593 L597 Y598 V599	F514-H595 AromaticContact CE1-NE2 3.74Å; G591-H595 WeakPolarHBondContact O-CB 3.41Å; G591-H595 PolarHBondContact O-N 3.19Å; L592-H595 PolarHBondContact O-N 3.35Å; A593-H595 VanDerWaalsContact C-N 3.33Å; A593-H595 PolarHBondContact O-N 3.07Å; H595-L597 VanDerWaalsContact C-N 3.33Å; H595-L597 PolarHBondContact O-N 2.98Å; H595-Y598 WeakPolarHBondContact O-CB 3.34Å; H595-Y598 PolarHBondContact O-N 3.14Å; H595-Y598 VanDerWaalsContact O-N 3.12Å; H595-V599 WeakPolarHBondContact O-CG2 3.36Å; H595-V599 PolarHBondContact O-N 3.46Å
596	V	57.5	Low	57.2	Low	12 Å²	12	44.3 Å²	44.3	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-44	177.3	171.7	0	0	0	0	110.8	L592 A593 Y598 V599 V600 T748 L752 Y755	L592-V596 VanDerWaalsContact O-CG2 3.3Å; L592-V596 WeakPolarHBondContact O-CG2 3.33Å; L592-V596 PolarHBondContact O-N 2.74Å; A593-V596 PolarHBondContact O-N 3.23Å; V596-Y598 VanDerWaalsContact C-N 3.28Å; V596-Y598 PolarHBondContact O-N 2.86Å; V596-V599 PolarHBondContact O-N 3.47Å; V596-V600 HydrophobicContact CG1-CG2 4.41Å; V596-V600 VanDerWaalsContact O-CG2 3.29Å; V596-V600 WeakPolarHBondContact O-CG2 3.43Å; V596-V600 PolarHBondContact O-N 3.3Å; V596-T748 HydrophobicContact CG1-CG2 4.28Å; V596-L752 HydrophobicContact CB-CD1 4.5Å; V596-L752 HydrophobicContact CG1-CB 4.12Å; V596-L752 HydrophobicContact CG1-CD1 4.09Å; V596-Y755 HydrophobicContact CG2-CD2 4.08Å; V596-Y755 HydrophobicContact CG2-CE2 3.64Å
597	L	58.1	Low	56.4	Low	1 Å²	1	53.7 Å²	53.7	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-38.8	175.6	-71.8	164.4	0	0	0	111.8	A593 H595 K601 F646 L650 V653 L752	A593-L597 WeakPolarHBondContact O-CB 2.91Å; A593-L597 WeakPolarHBondContact O-CD1 3.29Å; A593-L597 WeakPolarHBondContact O-CG 3.38Å; A593-L597 PolarHBondContact O-N 3.28Å; H595-L597 VanDerWaalsContact C-N 3.33Å; H595-L597 PolarHBondContact O-N 2.98Å; L597-K601 WeakPolarHBondContact O-CB 3.3Å; L597-K601 PolarHBondContact O-N 3.27Å; L597-F646 HydrophobicContact CD2-CB 4.48Å; L597-F646 HydrophobicContact CD2-CD1 3.57Å; L597-F646 HydrophobicContact CD2-CE1 4.19Å; L597-F646 HydrophobicContact CD2-CG 4.35Å; L597-L650 HydrophobicContact CB-CB 4.28Å; L597-L650 HydrophobicContact CB-CD1 3.4Å; L597-L650 VanDerWaalsContact CB-CD1 3.4Å; L597-L650 HydrophobicContact CB-CG 4.4Å; L597-L650 HydrophobicContact CD1-CD1 4.27Å; L597-L650 HydrophobicContact CG-CD1 4.43Å; L597-V653 HydrophobicContact CD1-CB 3.71Å; L597-V653 HydrophobicContact CD1-CG1 3.94Å; L597-V653 HydrophobicContact CD1-CG2 3.84Å; L597-L752 HydrophobicContact CD2-CD1 4Å; L597-L752 HydrophobicContact CD2-CD2 3.44Å; L597-L752 VanDerWaalsContact CD2-CD2 3.44Å; L597-L752 HydrophobicContact CD2-CG 4.4Å; L597-L752 HydrophobicContact CG-CD1 3.91Å; L597-L752 HydrophobicContact CG-CD2 4.26Å
598	Y	58	Low	55.9	Low	131 Å²	131	52.4 Å²	52.4	51%	0.514	26%	0.257	S	S	.	.	H	α-helix	trans	-65.1	-48.8	174.4	179.2	-94.2	0	0	0	112.1	S594 H595 V596 V600 K601 T602	S594-Y598 PolarHBondContact O-N 3.31Å; H595-Y598 WeakPolarHBondContact O-CB 3.34Å; H595-Y598 PolarHBondContact O-N 3.14Å; H595-Y598 VanDerWaalsContact O-N 3.12Å; V596-Y598 VanDerWaalsContact C-N 3.28Å; V596-Y598 PolarHBondContact O-N 2.86Å; Y598-V600 VanDerWaalsContact C-N 3.32Å; Y598-V600 PolarHBondContact O-N 2.82Å; Y598-K601 WeakPolarHBondContact O-CB 3.24Å; Y598-K601 PolarHBondContact O-N 3.21Å; Y598-K601 VanDerWaalsContact O-N 3.14Å; Y598-T602 HydrophobicContact CD1-CG2 4.25Å; Y598-T602 HydrophobicContact CE1-CG2 3.76Å; Y598-T602 HydrophobicContact CE2-CG2 4.28Å; Y598-T602 PolarHBondContact O-N 3.48Å; Y598-T602 PolarHBondContact O-OG1 2.99Å
599	V	56.8	Low	55.2	Low	32 Å²	32	57.3 Å²	57.3	19%	0.194	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-40.8	178.3	171.9	0	0	0	0	111.5	H595 V596 T602 N603	H595-V599 WeakPolarHBondContact O-CG2 3.36Å; H595-V599 PolarHBondContact O-N 3.46Å; V596-V599 PolarHBondContact O-N 3.47Å; V599-T602 WeakPolarHBondContact CA-OG1 3.32Å; V599-T602 PolarHBondContact O-N 3.48Å; V599-T602 PolarHBondContact O-OG1 2.9Å; V599-N603 WeakPolarHBondContact O-CB 3.31Å; V599-N603 VanDerWaalsContact O-CG 3.24Å; V599-N603 PolarHBondContact O-N 2.96Å; V599-N603 PolarHBondContact O-ND2 2.87Å
600	V	56.1	Low	54	Low	6 Å²	6	62.4 Å²	62.4	4%	0.036	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-46.3	174.7	173.2	0	0	0	0	110.4	V596 Y598 T602 N603 V604 I642 F646 T748	V596-V600 HydrophobicContact CG1-CG2 4.41Å; V596-V600 VanDerWaalsContact O-CG2 3.29Å; V596-V600 WeakPolarHBondContact O-CG2 3.43Å; V596-V600 PolarHBondContact O-N 3.3Å; Y598-V600 VanDerWaalsContact C-N 3.32Å; Y598-V600 PolarHBondContact O-N 2.82Å; V600-T602 VanDerWaalsContact C-N 3.32Å; V600-T602 PolarHBondContact O-N 3.03Å; V600-N603 PolarHBondContact O-N 3.33Å; V600-V604 HydrophobicContact CG1-CG2 4.01Å; V600-V604 WeakPolarHBondContact O-CB 3.3Å; V600-V604 WeakPolarHBondContact O-CG2 3.3Å; V600-V604 PolarHBondContact O-N 3.34Å; V600-I642 HydrophobicContact CG1-CG2 3.98Å; V600-F646 HydrophobicContact CB-CD1 3.82Å; V600-F646 HydrophobicContact CB-CE1 3.84Å; V600-F646 HydrophobicContact CG1-CD1 3.46Å; V600-F646 VanDerWaalsContact CG1-CD1 3.46Å; V600-F646 HydrophobicContact CG1-CD2 4.42Å; V600-F646 HydrophobicContact CG1-CE1 3.49Å; V600-F646 VanDerWaalsContact CG1-CE1 3.49Å; V600-F646 HydrophobicContact CG1-CE2 4.42Å; V600-F646 HydrophobicContact CG1-CG 3.97Å; V600-F646 HydrophobicContact CG1-CZ 4Å; V600-F646 HydrophobicContact CG2-CD1 4.27Å; V600-F646 HydrophobicContact CG2-CE1 3.79Å; V600-T748 HydrophobicContact CG2-CG2 3.27Å
601	K	57.3	Low	53	Low	92 Å²	92	66.5 Å²	66.5	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-58.1	-45.6	178.1	-176	178.2	175.7	-178.9	0	111.4	L597 Y598 V604 E605 L650	L597-K601 WeakPolarHBondContact O-CB 3.3Å; L597-K601 PolarHBondContact O-N 3.27Å; Y598-K601 WeakPolarHBondContact O-CB 3.24Å; Y598-K601 PolarHBondContact O-N 3.21Å; Y598-K601 VanDerWaalsContact O-N 3.14Å; K601-V604 PolarHBondContact O-N 2.83Å; K601-E605 WeakPolarHBondContact CE-OE1 3.24Å; K601-E605 WeakPolarHBondContact O-CB 3.39Å; K601-E605 VanDerWaalsContact O-CG 3.3Å; K601-E605 WeakPolarHBondContact O-CG 3.31Å; K601-E605 PolarHBondContact O-N 2.94Å; K601-L650 HydrophobicContact CD-CD2 4.04Å
602	T	57.4	Low	51.9	Low	41 Å²	41	74.7 Å²	74.7	25%	0.252	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	-43.6	177.9	54	0	0	0	0	112.2	Y598 V599 V600 V604 E605 E606	Y598-T602 HydrophobicContact CD1-CG2 4.25Å; Y598-T602 HydrophobicContact CE1-CG2 3.76Å; Y598-T602 HydrophobicContact CE2-CG2 4.28Å; Y598-T602 PolarHBondContact O-N 3.48Å; Y598-T602 PolarHBondContact O-OG1 2.99Å; V599-T602 WeakPolarHBondContact CA-OG1 3.32Å; V599-T602 PolarHBondContact O-N 3.48Å; V599-T602 PolarHBondContact O-OG1 2.9Å; V600-T602 VanDerWaalsContact C-N 3.32Å; V600-T602 PolarHBondContact O-N 3.03Å; T602-V604 VanDerWaalsContact C-N 3.3Å; T602-V604 PolarHBondContact O-N 2.82Å; T602-E605 PolarHBondContact O-N 3.27Å; T602-E606 PolarHBondContact O-N 3.31Å
603	N	55	Low	51.2	Low	56 Å²	56	76.5 Å²	76.5	30%	0.299	39%	0.386	S	S	.	.	H	α-helix	trans	-66	-32.1	178.5	-73.8	-13.7	0	0	0	112.8	V599 V600	V599-N603 WeakPolarHBondContact O-CB 3.31Å; V599-N603 VanDerWaalsContact O-CG 3.24Å; V599-N603 PolarHBondContact O-N 2.96Å; V599-N603 PolarHBondContact O-ND2 2.87Å; V600-N603 PolarHBondContact O-N 3.33Å
604	V	53.5	Low	50.3	Low	18 Å²	18	85.6 Å²	85.6	11%	0.109	43%	0.428	C	S	.	.	H	α-helix	trans	-72.4	-35.6	174.6	169.8	0	0	0	0	111.1	V600 K601 T602 K639 I642 A643	V600-V604 HydrophobicContact CG1-CG2 4.01Å; V600-V604 WeakPolarHBondContact O-CB 3.3Å; V600-V604 WeakPolarHBondContact O-CG2 3.3Å; V600-V604 PolarHBondContact O-N 3.34Å; K601-V604 PolarHBondContact O-N 2.83Å; T602-V604 VanDerWaalsContact C-N 3.3Å; T602-V604 PolarHBondContact O-N 2.82Å; V604-K639 HydrophobicContact CG1-CB 3.98Å; V604-K639 HydrophobicContact CG1-CG 4.03Å; V604-K639 WeakPolarHBondContact O-CD 3.41Å; V604-K639 VanDerWaalsContact O-CE 3.25Å; V604-K639 WeakPolarHBondContact O-CE 3.44Å; V604-I642 HydrophobicContact CG2-CB 4.38Å; V604-I642 HydrophobicContact CG2-CG2 3.57Å; V604-A643 HydrophobicContact CG1-CB 4.19Å
605	E	54	Low	49.6	Very low	126 Å²	126	84.8 Å²	84.8	59%	0.589	42%	0.423	S	S	*	.	H	α-helix	trans	-75.6	-24.9	177.8	-74.7	176.8	-173.1	0	0	113.2	K601 T602 R607	K601-E605 WeakPolarHBondContact CE-OE1 3.24Å; K601-E605 WeakPolarHBondContact O-CB 3.39Å; K601-E605 VanDerWaalsContact O-CG 3.3Å; K601-E605 WeakPolarHBondContact O-CG 3.31Å; K601-E605 PolarHBondContact O-N 2.94Å; T602-E605 PolarHBondContact O-N 3.27Å; E605-R607 PolarHBondContact O-N 2.95Å
606	E	50.7	Low	49.2	Very low	133 Å²	133	86.1 Å²	86.1	62%	0.621	44%	0.44	S	S	*	.	S	Bend	trans	-61	111.8	173.9	-79	-170.1	176.2	0	0	111.1	T602 S608 K639	T602-E606 PolarHBondContact O-N 3.31Å; E606-S608 PolarHBondContact O-N 2.97Å; E606-K639 PolarHBondContact O-NZ 3.18Å
607	R	42.7	Very low	49.2	Very low	227 Å²	227	87 Å²	87	86%	0.857	45%	0.446	S	S	*	.			trans	-66.3	126.4	173.2	-70.4	-179.1	177.9	-179.8	-0.6	108.3	E605 T609	E605-R607 PolarHBondContact O-N 2.95Å; R607-T609 PolarHBondContact O-N 3.31Å
608	S	42.9	Very low	49.5	Very low	74 Å²	74	90.8 Å²	90.8	52%	0.517	48%	0.478	S	S	.	.			trans	-55.3	110.3	169.8	39.1	0	0	0	0	109	E606	E606-S608 PolarHBondContact O-N 2.97Å
609	T	40.8	Very low	49.7	Very low	122 Å²	122	87.2 Å²	87.2	75%	0.748	48%	0.475	S	S	*	.			trans	-63.4	130.1	174.6	47.5	0	0	0	0	108.8	R607 L611	R607-T609 PolarHBondContact O-N 3.31Å; T609-L611 PolarHBondContact O-N 3.38Å
610	P	35.6	Very low	50.1	Low	109 Å²	109	86.1 Å²	86.1	71%	0.708	47%	0.468	S	S	*	.			trans	-64.3	124.4	-177.7	23.8	-31.1	0	0	0	110.6	E612	P610-E612 PolarHBondContact O-N 3.32Å
611	L	39.6	Very low	50.7	Low	89 Å²	89	91.1 Å²	91.1	47%	0.466	49%	0.489	S	S	.	.			trans	-63.9	114.5	164.7	-96	138	0	0	0	108.8	T609 T613 R628 A734	T609-L611 PolarHBondContact O-N 3.38Å; L611-T613 PolarHBondContact O-N 3.31Å; L611-R628 PolarHBondContact O-NH2 2.99Å; L611-R628 VanDerWaalsContact O-NH2 3.16Å; L611-A734 HydrophobicContact CD1-CB 4.44Å
612	E	38.7	Very low	51.3	Low	194 Å²	194	91.6 Å²	91.6	91%	0.907	50%	0.496	S	S	*	.			trans	-75.7	92	163.3	-70	-176.4	170.1	0	0	108.3	P610	P610-E612 PolarHBondContact O-N 3.32Å
613	T	41.4	Very low	51.8	Low	46 Å²	46	92.1 Å²	92.1	28%	0.282	50%	0.497	S	S	.	.			trans	-102	112.7	166	31.6	0	0	0	0	109.1	L611 A615 E624	L611-T613 PolarHBondContact O-N 3.31Å; T613-A615 PolarHBondContact O-N 3.34Å; T613-E624 PolarHBondContact OG1-OE1 3.22Å
614	E	41.6	Very low	52.4	Low	195 Å²	195	90.7 Å²	90.7	91%	0.911	49%	0.488	S	S	*	.			trans	-67.4	75.4	171.4	-70.3	-174.1	157.2	0	0	110.4
615	A	44.9	Very low	53.3	Low	9 Å²	9	95.2 Å²	95.2	7%	0.074	51%	0.508	C	S	.	.			trans	-79.2	123.5	175	0	0	0	0	0	111.1	T613 S617 F620 K621	T613-A615 PolarHBondContact O-N 3.34Å; A615-S617 VanDerWaalsContact C-N 3.33Å; A615-S617 PolarHBondContact O-N 3.47Å; A615-F620 HydrophobicContact CB-CD1 3.45Å; A615-F620 VanDerWaalsContact CB-CD1 3.45Å; A615-F620 HydrophobicContact CB-CE1 4Å; A615-F620 HydrophobicContact CB-CG 4.38Å; A615-K621 HydrophobicContact CB-CG 4.2Å; A615-K621 VanDerWaalsContact O-CE 3.3Å; A615-K621 WeakPolarHBondContact O-CE 3.42Å
616	S	50.8	Low	54.1	Low	96 Å²	96	93.3 Å²	93.3	67%	0.671	50%	0.502	S	S	*	.			trans	-79.4	-9.1	-177.2	69	0	0	0	0	114.8	H727	S616-H727 PolarHBondContact N-NE2 2.87Å
617	S	58.5	Low	55.3	Low	30 Å²	30	87.3 Å²	87.3	21%	0.21	47%	0.473	C	S	.	.			trans	-115.3	123.4	-173.4	168.2	0	0	0	0	111.9	A615 A619 F620 K621 W724	A615-S617 VanDerWaalsContact C-N 3.33Å; A615-S617 PolarHBondContact O-N 3.47Å; S617-A619 PolarHBondContact O-N 2.98Å; S617-F620 WeakPolarHBondContact O-CB 3.23Å; S617-F620 PolarHBondContact O-N 3.11Å; S617-F620 PolarHBondContact OG-N 3.41Å; S617-K621 PolarHBondContact O-N 3.4Å; S617-K621 VanDerWaalsContact O-N 3.08Å; S617-W724 WeakPolarHBondContact OG-CZ2 3.5Å
618	A	63.8	Low	56.7	Low	81 Å²	81	80.7 Å²	80.7	67%	0.669	45%	0.448	S	S	*	.	H	α-helix	trans	-57.9	-35.3	177	0	0	0	0	0	112.9	F620 K621 L622	A618-F620 VanDerWaalsContact C-N 3.33Å; A618-K621 PolarHBondContact O-N 2.84Å; A618-L622 PolarHBondContact O-N 3.23Å; A618-L622 VanDerWaalsContact O-N 3.14Å
619	A	62.1	Low	58.1	Low	56 Å²	56	81.6 Å²	81.6	46%	0.463	45%	0.447	S	S	.	.	H	α-helix	trans	-68.5	-33.4	176.4	0	0	0	0	0	112.3	S617 L623 W724	S617-A619 PolarHBondContact O-N 2.98Å; A619-L623 PolarHBondContact O-N 2.98Å; A619-W724 HydrophobicContact CB-CH2 4Å; A619-W724 HydrophobicContact CB-CZ2 4.48Å
620	F	65.7	Low	59.5	Low	8 Å²	8	78.7 Å²	78.7	4%	0.035	43%	0.429	C	S	.	.	H	α-helix	trans	-69.8	-43	174.9	-171.2	-89.1	0	0	0	111.1	A615 S617 A618 L622 L623 E624 L714 W724 H727 F731	A615-F620 HydrophobicContact CB-CD1 3.45Å; A615-F620 VanDerWaalsContact CB-CD1 3.45Å; A615-F620 HydrophobicContact CB-CE1 4Å; A615-F620 HydrophobicContact CB-CG 4.38Å; S617-F620 WeakPolarHBondContact O-CB 3.23Å; S617-F620 PolarHBondContact O-N 3.11Å; S617-F620 PolarHBondContact OG-N 3.41Å; A618-F620 VanDerWaalsContact C-N 3.33Å; F620-L622 VanDerWaalsContact C-N 3.27Å; F620-L622 PolarHBondContact O-N 3.33Å; F620-L623 PolarHBondContact O-N 3.23Å; F620-E624 WeakPolarHBondContact O-CB 3.35Å; F620-E624 PolarHBondContact O-N 3.41Å; F620-L714 HydrophobicContact CD2-CD2 4.45Å; F620-W724 HydrophobicContact CB-CH2 4.06Å; F620-W724 HydrophobicContact CB-CZ3 3.86Å; F620-W724 AromaticContact CD2-CE3 3.99Å; F620-W724 HydrophobicContact CD2-CE3 3.99Å; F620-W724 AromaticContact CD2-CZ3 3.71Å; F620-W724 HydrophobicContact CD2-CZ3 3.71Å; F620-W724 HydrophobicContact CG-CZ3 4.29Å; F620-H727 HydrophobicContact CD2-CB 3.87Å; F620-H727 HydrophobicContact CE1-CB 4.3Å; F620-H727 HydrophobicContact CE2-CB 3.51Å; F620-H727 HydrophobicContact CG-CB 4.4Å; F620-H727 HydrophobicContact CZ-CB 3.71Å; F620-H727 VanDerWaalsContact CZ-O 3.25Å; F620-H727 WeakPolarHBondContact CZ-O 3.43Å; F620-F731 HydrophobicContact CE2-CB 4.24Å; F620-F731 HydrophobicContact CZ-CB 3.83Å
621	K	67.9	Low	61.1	Low	111 Å²	111	75 Å²	75	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-56.1	-41.2	174.2	-72.8	-173	176.8	-176.4	0	112.5	A615 S617 A618 E624 E625	A615-K621 HydrophobicContact CB-CG 4.2Å; A615-K621 VanDerWaalsContact O-CE 3.3Å; A615-K621 WeakPolarHBondContact O-CE 3.42Å; S617-K621 PolarHBondContact O-N 3.4Å; S617-K621 VanDerWaalsContact O-N 3.08Å; A618-K621 PolarHBondContact O-N 2.84Å; K621-E624 WeakPolarHBondContact O-CB 3.25Å; K621-E624 PolarHBondContact O-N 3.33Å; K621-E625 WeakPolarHBondContact O-CB 3.06Å; K621-E625 WeakPolarHBondContact O-CG 3.49Å; K621-E625 PolarHBondContact O-N 3.41Å
622	L	69.4	Low	62.5	Low	103 Å²	103	73.2 Å²	73.2	54%	0.539	40%	0.399	S	S	.	.	H	α-helix	trans	-69.2	-37.4	-179.2	-142.4	147.8	0	0	0	112.2	A618 F620 L626	A618-L622 PolarHBondContact O-N 3.23Å; A618-L622 VanDerWaalsContact O-N 3.14Å; F620-L622 VanDerWaalsContact C-N 3.27Å; F620-L622 PolarHBondContact O-N 3.33Å; L622-L626 HydrophobicContact CD2-CD1 4.13Å; L622-L626 HydrophobicContact CD2-CG 4.46Å; L622-L626 WeakPolarHBondContact O-CB 3.35Å; L622-L626 VanDerWaalsContact O-CG 3.28Å; L622-L626 WeakPolarHBondContact O-CG 3.13Å; L622-L626 PolarHBondContact O-N 3.5Å
623	L	67.7	Low	63.8	Low	51 Å²	51	71.5 Å²	71.5	27%	0.267	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-41.6	170.7	-83.6	157.6	0	0	0	111.5	A619 F620 L626 Y627 M710 L714	A619-L623 PolarHBondContact O-N 2.98Å; F620-L623 PolarHBondContact O-N 3.23Å; L623-L626 PolarHBondContact O-N 3.34Å; L623-Y627 PolarHBondContact O-N 2.86Å; L623-M710 HydrophobicContact CB-CE 3.76Å; L623-M710 HydrophobicContact CD2-CE 3.28Å; L623-M710 HydrophobicContact CG-CE 4.11Å; L623-M710 WeakPolarHBondContact O-CE 3.12Å; L623-L714 HydrophobicContact CD1-CD2 3.94Å
624	E	68.2	Low	65	Low	26 Å²	26	71.3 Å²	71.3	12%	0.121	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-43.1	176.7	-158.1	-171.5	143.1	0	0	111.5	T613 F620 K621 Y627 R628	T613-E624 PolarHBondContact OG1-OE1 3.22Å; F620-E624 WeakPolarHBondContact O-CB 3.35Å; F620-E624 PolarHBondContact O-N 3.41Å; K621-E624 WeakPolarHBondContact O-CB 3.25Å; K621-E624 PolarHBondContact O-N 3.33Å; E624-Y627 PolarHBondContact O-N 3.46Å; E624-R628 WeakPolarHBondContact O-CB 3.26Å; E624-R628 WeakPolarHBondContact O-CG 3.36Å; E624-R628 PolarHBondContact O-N 3.45Å; E624-R628 IonicContact OE1-CZ 3.64Å; E624-R628 IonicContact OE1-NE 2.87Å; E624-R628 PolarHBondContact OE1-NE 2.97Å; E624-R628 IonicContact OE1-NH2 2.76Å; E624-R628 PolarHBondContact OE1-NH2 3.34Å
625	E	72	Confident	66.1	Low	113 Å²	113	63.7 Å²	63.7	53%	0.528	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-40.7	173.5	-78.5	174.5	-170.8	0	0	112.3	K621 R628 N629	K621-E625 WeakPolarHBondContact O-CB 3.06Å; K621-E625 WeakPolarHBondContact O-CG 3.49Å; K621-E625 PolarHBondContact O-N 3.41Å; E625-R628 PolarHBondContact O-N 2.89Å; E625-N629 VanDerWaalsContact O-CB 3.27Å; E625-N629 WeakPolarHBondContact O-CB 3.38Å; E625-N629 VanDerWaalsContact O-CG 3.26Å; E625-N629 PolarHBondContact O-N 2.82Å; E625-N629 PolarHBondContact O-ND2 3.41Å
626	L	72.2	Confident	67.1	Low	87 Å²	87	67 Å²	67	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-45.8	174.9	-77.5	169.4	0	0	0	111.3	L622 L623 N629 V630	L622-L626 HydrophobicContact CD2-CD1 4.13Å; L622-L626 HydrophobicContact CD2-CG 4.46Å; L622-L626 WeakPolarHBondContact O-CB 3.35Å; L622-L626 VanDerWaalsContact O-CG 3.28Å; L622-L626 WeakPolarHBondContact O-CG 3.13Å; L622-L626 PolarHBondContact O-N 3.5Å; L623-L626 PolarHBondContact O-N 3.34Å; L626-N629 PolarHBondContact O-N 2.96Å; L626-V630 WeakPolarHBondContact O-CG2 3.45Å; L626-V630 PolarHBondContact O-N 3.23Å
627	Y	74.3	Confident	67.8	Low	6 Å²	6	69.8 Å²	69.8	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-60	-46.4	173.8	179.4	-99.8	0	0	0	111.4	L623 E624 N629 V630 L631 L703 F706 M710 F731 V735	L623-Y627 PolarHBondContact O-N 2.86Å; E624-Y627 PolarHBondContact O-N 3.46Å; Y627-N629 VanDerWaalsContact C-N 3.33Å; Y627-N629 PolarHBondContact O-N 2.93Å; Y627-V630 PolarHBondContact O-N 3.38Å; Y627-L631 HydrophobicContact CE1-CD2 4.44Å; Y627-L631 WeakPolarHBondContact O-CB 3.48Å; Y627-L631 PolarHBondContact O-N 3.18Å; Y627-L703 HydrophobicContact CE2-CD1 3.84Å; Y627-L703 HydrophobicContact CE2-CG 4.44Å; Y627-F706 HydrophobicContact CD2-CD1 4.3Å; Y627-F706 HydrophobicContact CD2-CE1 4.12Å; Y627-M710 HydrophobicContact CD2-SD 4.38Å; Y627-F731 AromaticContact CD1-CE2 3.93Å; Y627-F731 HydrophobicContact CD1-CE2 3.93Å; Y627-F731 HydrophobicContact CD1-CZ 4.38Å; Y627-F731 HydrophobicContact CD2-CE2 4.37Å; Y627-F731 AromaticContact CD2-CZ 3.99Å; Y627-F731 HydrophobicContact CD2-CZ 3.99Å; Y627-F731 AromaticContact CG-CE2 3.81Å; Y627-F731 HydrophobicContact CG-CE2 3.81Å; Y627-F731 AromaticContact CG-CZ 3.86Å; Y627-F731 HydrophobicContact CG-CZ 3.86Å; Y627-V735 HydrophobicContact CD2-CG2 4.44Å; Y627-V735 HydrophobicContact CE1-CG2 4.17Å; Y627-V735 HydrophobicContact CE2-CG2 3.84Å
628	R	72	Confident	68	Low	88 Å²	88	69 Å²	69	33%	0.332	36%	0.361	S	S	.	.	H	α-helix	trans	-64.6	-32.9	177.6	-72.4	174.2	-175.9	-83.5	10.1	112.9	L611 E624 E625 S632	L611-R628 PolarHBondContact O-NH2 2.99Å; L611-R628 VanDerWaalsContact O-NH2 3.16Å; E624-R628 WeakPolarHBondContact O-CB 3.26Å; E624-R628 WeakPolarHBondContact O-CG 3.36Å; E624-R628 PolarHBondContact O-N 3.45Å; E624-R628 IonicContact OE1-CZ 3.64Å; E624-R628 IonicContact OE1-NE 2.87Å; E624-R628 PolarHBondContact OE1-NE 2.97Å; E624-R628 IonicContact OE1-NH2 2.76Å; E624-R628 PolarHBondContact OE1-NH2 3.34Å; E625-R628 PolarHBondContact O-N 2.89Å; R628-S632 VanDerWaalsContact O-CB 3.26Å; R628-S632 WeakPolarHBondContact O-CB 3.46Å; R628-S632 PolarHBondContact O-N 3.45Å; R628-S632 PolarHBondContact O-OG 3.42Å
629	N	72.5	Confident	68	Low	94 Å²	94	67.3 Å²	67.3	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-71	-38.4	174.9	-82	-28.9	0	0	0	112	E625 L626 Y627 S632 K633	E625-N629 VanDerWaalsContact O-CB 3.27Å; E625-N629 WeakPolarHBondContact O-CB 3.38Å; E625-N629 VanDerWaalsContact O-CG 3.26Å; E625-N629 PolarHBondContact O-N 2.82Å; E625-N629 PolarHBondContact O-ND2 3.41Å; L626-N629 PolarHBondContact O-N 2.96Å; Y627-N629 VanDerWaalsContact C-N 3.33Å; Y627-N629 PolarHBondContact O-N 2.93Å; N629-S632 WeakPolarHBondContact CA-OG 3.43Å; N629-S632 PolarHBondContact O-OG 2.88Å; N629-S632 VanDerWaalsContact O-OG 3.12Å; N629-K633 WeakPolarHBondContact O-CB 3.35Å; N629-K633 WeakPolarHBondContact O-CG 3.46Å; N629-K633 PolarHBondContact O-N 2.92Å; N629-K633 VanDerWaalsContact O-N 3.12Å
630	V	70.3	Confident	68.2	Low	61 Å²	61	70.4 Å²	70.4	37%	0.37	34%	0.344	S	S	.	.	H	α-helix	trans	-67	-45.7	172.5	174.6	0	0	0	0	110	L626 Y627 K633 W634 L703 F706	L626-V630 WeakPolarHBondContact O-CG2 3.45Å; L626-V630 PolarHBondContact O-N 3.23Å; Y627-V630 PolarHBondContact O-N 3.38Å; V630-K633 PolarHBondContact O-N 3.31Å; V630-W634 WeakPolarHBondContact O-CB 3.27Å; V630-W634 PolarHBondContact O-N 3.06Å; V630-L703 HydrophobicContact CG1-CD1 4.47Å; V630-F706 HydrophobicContact CB-CE1 4.49Å; V630-F706 HydrophobicContact CG2-CE1 4.21Å; V630-F706 HydrophobicContact CG2-CZ 4.24Å
631	L	69.8	Low	68.1	Low	31 Å²	31	76.5 Å²	76.5	16%	0.162	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-42	178	-167.3	80.1	0	0	0	112.2	Y627 W634 D635 L703 D738	Y627-L631 HydrophobicContact CE1-CD2 4.44Å; Y627-L631 WeakPolarHBondContact O-CB 3.48Å; Y627-L631 PolarHBondContact O-N 3.18Å; L631-W634 HydrophobicContact CD1-CE3 4.4Å; L631-W634 CarbonylContact O-C 3.6Å; L631-W634 WeakPolarHBondContact O-CB 3.38Å; L631-W634 PolarHBondContact O-N 3.35Å; L631-D635 VanDerWaalsContact O-CB 3.31Å; L631-D635 WeakPolarHBondContact O-CB 3.47Å; L631-D635 PolarHBondContact O-N 2.81Å; L631-L703 HydrophobicContact CD1-CD1 4.45Å; L631-L703 HydrophobicContact CD1-CD2 4.42Å; L631-D738 HydrophobicContact CD1-CB 4.31Å; L631-D738 WeakPolarHBondContact CD2-OD2 3.4Å
632	S	68	Low	67.9	Low	52 Å²	52	71.5 Å²	71.5	36%	0.364	35%	0.345	S	S	.	.	H	α-helix	trans	-71	-39	179.1	56.7	0	0	0	0	112.8	R628 N629 W634 D635 V636	R628-S632 VanDerWaalsContact O-CB 3.26Å; R628-S632 WeakPolarHBondContact O-CB 3.46Å; R628-S632 PolarHBondContact O-N 3.45Å; R628-S632 PolarHBondContact O-OG 3.42Å; N629-S632 WeakPolarHBondContact CA-OG 3.43Å; N629-S632 PolarHBondContact O-OG 2.88Å; N629-S632 VanDerWaalsContact O-OG 3.12Å; S632-W634 PolarHBondContact O-N 2.85Å; S632-D635 PolarHBondContact O-N 2.92Å; S632-V636 WeakPolarHBondContact O-CG2 3.38Å; S632-V636 PolarHBondContact O-N 2.98Å
633	K	67.5	Low	67.7	Low	157 Å²	157	69 Å²	69	68%	0.683	34%	0.34	S	S	*	.	H	α-helix	trans	-61.3	-36.3	171.5	-77.8	-179.7	-179.4	179.2	0	111.6	N629 V630 K637	N629-K633 WeakPolarHBondContact O-CB 3.35Å; N629-K633 WeakPolarHBondContact O-CG 3.46Å; N629-K633 PolarHBondContact O-N 2.92Å; N629-K633 VanDerWaalsContact O-N 3.12Å; V630-K633 PolarHBondContact O-N 3.31Å; K633-K637 WeakPolarHBondContact O-CG 3.48Å; K633-K637 PolarHBondContact O-N 3.5Å
634	W	66.3	Low	67.6	Low	42 Å²	42	72 Å²	72	16%	0.159	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-54.3	170.7	173.3	87.8	0	0	0	111.1	V630 L631 S632 V636 K637 C638 L696 I742	V630-W634 WeakPolarHBondContact O-CB 3.27Å; V630-W634 PolarHBondContact O-N 3.06Å; L631-W634 HydrophobicContact CD1-CE3 4.4Å; L631-W634 CarbonylContact O-C 3.6Å; L631-W634 WeakPolarHBondContact O-CB 3.38Å; L631-W634 PolarHBondContact O-N 3.35Å; S632-W634 PolarHBondContact O-N 2.85Å; W634-V636 VanDerWaalsContact C-N 3.34Å; W634-V636 PolarHBondContact O-N 3.45Å; W634-K637 PolarHBondContact O-N 2.75Å; W634-K637 VanDerWaalsContact O-N 3.17Å; W634-C638 HydrophobicContact CD2-CB 4.48Å; W634-C638 VanDerWaalsContact CE2-SG 3.56Å; W634-C638 HydrophobicContact CH2-CB 4.39Å; W634-C638 HydrophobicContact CZ2-CB 4.02Å; W634-C638 PolarHBondContact NE1-SG 2.76Å; W634-C638 WeakPolarHBondContact O-CB 3.19Å; W634-C638 PolarHBondContact O-N 3.45Å; W634-L696 HydrophobicContact CZ2-CD2 4.1Å; W634-I742 HydrophobicContact CD2-CD1 4.27Å; W634-I742 HydrophobicContact CE3-CD1 4.36Å; W634-I742 HydrophobicContact CH2-CB 4.44Å; W634-I742 HydrophobicContact CH2-CD1 3.95Å; W634-I742 HydrophobicContact CH2-CG1 3.47Å; W634-I742 VanDerWaalsContact CH2-CG1 3.47Å; W634-I742 HydrophobicContact CH2-CG2 4.49Å; W634-I742 HydrophobicContact CZ2-CB 4.29Å; W634-I742 HydrophobicContact CZ2-CD1 3.75Å; W634-I742 HydrophobicContact CZ2-CG1 3.56Å; W634-I742 HydrophobicContact CZ2-CG2 3.88Å; W634-I742 HydrophobicContact CZ3-CD1 4.22Å; W634-I742 HydrophobicContact CZ3-CG1 4.04Å
635	D	65	Low	67.4	Low	35 Å²	35	71.6 Å²	71.6	19%	0.187	36%	0.355	C	S	.	.	H	α-helix	trans	-58	-45.1	-174.3	-166.5	51.7	0	0	0	111	L631 S632 K639	L631-D635 VanDerWaalsContact O-CB 3.31Å; L631-D635 WeakPolarHBondContact O-CB 3.47Å; L631-D635 PolarHBondContact O-N 2.81Å; S632-D635 PolarHBondContact O-N 2.92Å; D635-K639 WeakPolarHBondContact O-CA 3.22Å; D635-K639 WeakPolarHBondContact O-CB 3.5Å; D635-K639 WeakPolarHBondContact O-CG 3.44Å; D635-K639 PolarHBondContact O-N 3.25Å; D635-K639 WeakPolarHBondContact OD1-CD 3.46Å; D635-K639 WeakPolarHBondContact OD1-CE 3.44Å; D635-K639 IonicContact OD1-NZ 3.19Å; D635-K639 PolarHBondContact OD1-NZ 3.38Å; D635-K639 VanDerWaalsContact OD1-NZ 3.16Å; D635-K639 WeakPolarHBondContact OD2-CD 3.36Å; D635-K639 WeakPolarHBondContact OD2-CE 3.25Å; D635-K639 IonicContact OD2-NZ 2.69Å; D635-K639 PolarHBondContact OD2-NZ 2.93Å
636	V	64.8	Low	67	Low	78 Å²	78	66.5 Å²	66.5	47%	0.473	33%	0.331	S	S	.	.	H	α-helix	trans	-64.4	-48	178.3	174.2	0	0	0	0	111.7	S632 W634 Q640	S632-V636 WeakPolarHBondContact O-CG2 3.38Å; S632-V636 PolarHBondContact O-N 2.98Å; W634-V636 VanDerWaalsContact C-N 3.34Å; W634-V636 PolarHBondContact O-N 3.45Å; V636-Q640 HydrophobicContact CG1-CG 4.49Å; V636-Q640 VanDerWaalsContact O-CB 3.24Å; V636-Q640 WeakPolarHBondContact O-CB 3.34Å; V636-Q640 VanDerWaalsContact O-CG 3.23Å; V636-Q640 WeakPolarHBondContact O-CG 3.29Å; V636-Q640 PolarHBondContact O-N 3.45Å
637	K	65.8	Low	66.6	Low	156 Å²	156	64 Å²	64	68%	0.678	33%	0.326	S	S	*	.	H	α-helix	trans	-67.2	-41.6	-178.6	-78.1	-173.5	176.3	-175.1	0	112	K633 W634 R641	K633-K637 WeakPolarHBondContact O-CG 3.48Å; K633-K637 PolarHBondContact O-N 3.5Å; W634-K637 PolarHBondContact O-N 2.75Å; W634-K637 VanDerWaalsContact O-N 3.17Å; K637-R641 WeakPolarHBondContact O-CB 3.44Å; K637-R641 PolarHBondContact O-N 2.93Å; K637-R641 VanDerWaalsContact O-N 3.15Å
638	C	62.7	Low	66.1	Low	14 Å²	14	70 Å²	70	10%	0.095	35%	0.354	C	S	.	.	H	α-helix	trans	-70.5	-49.5	179.1	-74.1	0	0	0	0	111.2	W634 Q640 R641 I642 L696	W634-C638 HydrophobicContact CD2-CB 4.48Å; W634-C638 VanDerWaalsContact CE2-SG 3.56Å; W634-C638 HydrophobicContact CH2-CB 4.39Å; W634-C638 HydrophobicContact CZ2-CB 4.02Å; W634-C638 PolarHBondContact NE1-SG 2.76Å; W634-C638 WeakPolarHBondContact O-CB 3.19Å; W634-C638 PolarHBondContact O-N 3.45Å; C638-Q640 PolarHBondContact O-N 3.17Å; C638-R641 PolarHBondContact O-N 3.42Å; C638-I642 WeakPolarHBondContact O-CB 3.2Å; C638-I642 VanDerWaalsContact O-CG1 3.23Å; C638-I642 WeakPolarHBondContact O-CG1 3.41Å; C638-I642 PolarHBondContact O-N 2.89Å; C638-L696 HydrophobicContact CB-CD2 4.19Å
639	K	64	Low	65.5	Low	45 Å²	45	65.9 Å²	65.9	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-61.7	-40.2	177.3	-72	-177.9	167.6	162.1	0	112.4	V604 E606 D635 A643	V604-K639 HydrophobicContact CG1-CB 3.98Å; V604-K639 HydrophobicContact CG1-CG 4.03Å; V604-K639 WeakPolarHBondContact O-CD 3.41Å; V604-K639 VanDerWaalsContact O-CE 3.25Å; V604-K639 WeakPolarHBondContact O-CE 3.44Å; E606-K639 PolarHBondContact O-NZ 3.18Å; D635-K639 WeakPolarHBondContact O-CA 3.22Å; D635-K639 WeakPolarHBondContact O-CB 3.5Å; D635-K639 WeakPolarHBondContact O-CG 3.44Å; D635-K639 PolarHBondContact O-N 3.25Å; D635-K639 WeakPolarHBondContact OD1-CD 3.46Å; D635-K639 WeakPolarHBondContact OD1-CE 3.44Å; D635-K639 IonicContact OD1-NZ 3.19Å; D635-K639 PolarHBondContact OD1-NZ 3.38Å; D635-K639 VanDerWaalsContact OD1-NZ 3.16Å; D635-K639 WeakPolarHBondContact OD2-CD 3.36Å; D635-K639 WeakPolarHBondContact OD2-CE 3.25Å; D635-K639 IonicContact OD2-NZ 2.69Å; D635-K639 PolarHBondContact OD2-NZ 2.93Å; K639-A643 WeakPolarHBondContact O-CB 3.25Å; K639-A643 PolarHBondContact O-N 3.47Å
640	Q	65.4	Low	64.9	Low	120 Å²	120	62.8 Å²	62.8	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-62.3	-45.7	175.2	-79.3	179	-15.9	0	0	111.8	V636 C638 L644	V636-Q640 HydrophobicContact CG1-CG 4.49Å; V636-Q640 VanDerWaalsContact O-CB 3.24Å; V636-Q640 WeakPolarHBondContact O-CB 3.34Å; V636-Q640 VanDerWaalsContact O-CG 3.23Å; V636-Q640 WeakPolarHBondContact O-CG 3.29Å; V636-Q640 PolarHBondContact O-N 3.45Å; C638-Q640 PolarHBondContact O-N 3.17Å; Q640-L644 WeakPolarHBondContact O-CB 3.4Å; Q640-L644 VanDerWaalsContact O-CG 3.22Å; Q640-L644 WeakPolarHBondContact O-CG 3.26Å; Q640-L644 PolarHBondContact O-N 3.45Å
641	R	65.2	Low	64.5	Low	136 Å²	136	62.7 Å²	62.7	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-65.8	-46.5	179.6	-171.6	175.6	-70.7	-128.1	-2.5	111.6	K637 C638 L644 T645 V692	K637-R641 WeakPolarHBondContact O-CB 3.44Å; K637-R641 PolarHBondContact O-N 2.93Å; K637-R641 VanDerWaalsContact O-N 3.15Å; C638-R641 PolarHBondContact O-N 3.42Å; R641-L644 PolarHBondContact O-N 3.42Å; R641-T645 WeakPolarHBondContact O-CB 3.33Å; R641-T645 PolarHBondContact O-N 3.19Å; R641-T645 PolarHBondContact O-OG1 3.19Å; R641-V692 HydrophobicContact CG-CG2 4.46Å
642	I	63.4	Low	63.9	Low	6 Å²	6	62.7 Å²	62.7	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-49.1	176.7	-65.1	168.7	0	0	0	110	V600 V604 C638 L644 T645 F646 V692 L696 T745	V600-I642 HydrophobicContact CG1-CG2 3.98Å; V604-I642 HydrophobicContact CG2-CB 4.38Å; V604-I642 HydrophobicContact CG2-CG2 3.57Å; C638-I642 WeakPolarHBondContact O-CB 3.2Å; C638-I642 VanDerWaalsContact O-CG1 3.23Å; C638-I642 WeakPolarHBondContact O-CG1 3.41Å; C638-I642 PolarHBondContact O-N 2.89Å; I642-L644 VanDerWaalsContact C-N 3.31Å; I642-L644 PolarHBondContact O-N 2.84Å; I642-T645 PolarHBondContact O-N 3.08Å; I642-F646 HydrophobicContact CB-CD2 4.37Å; I642-F646 HydrophobicContact CG2-CD2 3.55Å; I642-F646 HydrophobicContact CG2-CE2 3.7Å; I642-F646 HydrophobicContact CG2-CG 4.22Å; I642-F646 VanDerWaalsContact O-CB 3.24Å; I642-F646 WeakPolarHBondContact O-CB 3.37Å; I642-F646 WeakPolarHBondContact O-CD2 3.38Å; I642-F646 PolarHBondContact O-N 3.31Å; I642-V692 HydrophobicContact CG1-CG1 4.13Å; I642-L696 HydrophobicContact CD1-CD1 4.31Å; I642-L696 HydrophobicContact CD1-CD2 4.39Å; I642-T745 HydrophobicContact CD1-CG2 3.86Å
643	A	64.2	Low	63.4	Low	52 Å²	52	60.4 Å²	60.4	43%	0.43	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-37.7	-179.8	0	0	0	0	0	112.9	V604 K639 G647	V604-A643 HydrophobicContact CG1-CB 4.19Å; K639-A643 WeakPolarHBondContact O-CB 3.25Å; K639-A643 PolarHBondContact O-N 3.47Å; A643-G647 WeakPolarHBondContact O-CA 3.26Å; A643-G647 PolarHBondContact O-N 3.19Å
644	L	65.4	Low	62.9	Low	112 Å²	112	57.3 Å²	57.3	59%	0.586	30%	0.298	S	S	*	.	H	α-helix	trans	-66.8	-55.1	175.4	-74.3	169.6	0	0	0	111.3	Q640 R641 I642 F646 G647 E648	Q640-L644 WeakPolarHBondContact O-CB 3.4Å; Q640-L644 VanDerWaalsContact O-CG 3.22Å; Q640-L644 WeakPolarHBondContact O-CG 3.26Å; Q640-L644 PolarHBondContact O-N 3.45Å; R641-L644 PolarHBondContact O-N 3.42Å; I642-L644 VanDerWaalsContact C-N 3.31Å; I642-L644 PolarHBondContact O-N 2.84Å; L644-F646 VanDerWaalsContact C-N 3.32Å; L644-F646 PolarHBondContact O-N 2.95Å; L644-G647 PolarHBondContact O-N 2.77Å; L644-E648 WeakPolarHBondContact O-CG 3.32Å; L644-E648 PolarHBondContact O-N 3.41Å
645	T	65.1	Low	62.2	Low	19 Å²	19	60.2 Å²	60.2	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-43.1	-179	-55.7	0	0	0	0	111.8	R641 I642 G649 L685 L689	R641-T645 WeakPolarHBondContact O-CB 3.33Å; R641-T645 PolarHBondContact O-N 3.19Å; R641-T645 PolarHBondContact O-OG1 3.19Å; I642-T645 PolarHBondContact O-N 3.08Å; T645-G649 PolarHBondContact O-N 3.38Å; T645-G649 VanDerWaalsContact O-N 3.11Å; T645-L685 HydrophobicContact CG2-CD1 4.11Å; T645-L685 WeakPolarHBondContact O-CD1 3.32Å; T645-L689 HydrophobicContact CG2-CD2 3.91Å; T645-L689 HydrophobicContact CG2-CG 4.13Å
646	F	63.6	Low	61.6	Low	6 Å²	6	59.6 Å²	59.6	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-79.2	-30.5	-179.2	-75.6	-109.8	0	0	0	112.6	L597 V600 I642 L644 L650 L689 C749 L752	L597-F646 HydrophobicContact CD2-CB 4.48Å; L597-F646 HydrophobicContact CD2-CD1 3.57Å; L597-F646 HydrophobicContact CD2-CE1 4.19Å; L597-F646 HydrophobicContact CD2-CG 4.35Å; V600-F646 HydrophobicContact CB-CD1 3.82Å; V600-F646 HydrophobicContact CB-CE1 3.84Å; V600-F646 HydrophobicContact CG1-CD1 3.46Å; V600-F646 VanDerWaalsContact CG1-CD1 3.46Å; V600-F646 HydrophobicContact CG1-CD2 4.42Å; V600-F646 HydrophobicContact CG1-CE1 3.49Å; V600-F646 VanDerWaalsContact CG1-CE1 3.49Å; V600-F646 HydrophobicContact CG1-CE2 4.42Å; V600-F646 HydrophobicContact CG1-CG 3.97Å; V600-F646 HydrophobicContact CG1-CZ 4Å; V600-F646 HydrophobicContact CG2-CD1 4.27Å; V600-F646 HydrophobicContact CG2-CE1 3.79Å; I642-F646 HydrophobicContact CB-CD2 4.37Å; I642-F646 HydrophobicContact CG2-CD2 3.55Å; I642-F646 HydrophobicContact CG2-CE2 3.7Å; I642-F646 HydrophobicContact CG2-CG 4.22Å; I642-F646 VanDerWaalsContact O-CB 3.24Å; I642-F646 WeakPolarHBondContact O-CB 3.37Å; I642-F646 WeakPolarHBondContact O-CD2 3.38Å; I642-F646 PolarHBondContact O-N 3.31Å; L644-F646 VanDerWaalsContact C-N 3.32Å; L644-F646 PolarHBondContact O-N 2.95Å; F646-L650 WeakPolarHBondContact O-CB 3.44Å; F646-L650 PolarHBondContact O-N 2.9Å; F646-L689 HydrophobicContact CD2-CD2 3.96Å; F646-L689 HydrophobicContact CE1-CD2 4.21Å; F646-L689 HydrophobicContact CE2-CD2 3.29Å; F646-L689 HydrophobicContact CZ-CD2 3.43Å; F646-L689 VanDerWaalsContact CZ-CD2 3.43Å; F646-C749 HydrophobicContact CZ-CB 4.43Å; F646-L752 HydrophobicContact CD1-CD2 3.75Å; F646-L752 HydrophobicContact CE1-CD2 3.12Å; F646-L752 HydrophobicContact CE1-CG 4.39Å; F646-L752 HydrophobicContact CZ-CD2 3.7Å
647	G	64.2	Low	60.9	Low	35 Å²	35	56.9 Å²	56.9	36%	0.361	30%	0.298	S	S	.	.	H	α-helix	trans	-65.8	-44.6	175.1	0	0	0	0	0	112.1	A643 L644 S651	A643-G647 WeakPolarHBondContact O-CA 3.26Å; A643-G647 PolarHBondContact O-N 3.19Å; L644-G647 PolarHBondContact O-N 2.77Å; G647-S651 PolarHBondContact O-N 2.91Å
648	E	63.1	Low	60	Low	131 Å²	131	54.9 Å²	54.9	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-63.4	-49.2	173.3	-70.1	178.1	178.6	0	0	110.7	L644 L650 S651 V652	L644-E648 WeakPolarHBondContact O-CG 3.32Å; L644-E648 PolarHBondContact O-N 3.41Å; E648-L650 PolarHBondContact O-N 2.88Å; E648-S651 PolarHBondContact O-N 3.33Å; E648-S651 PolarHBondContact O-OG 3.46Å; E648-V652 PolarHBondContact O-N 3.46Å
649	G	59.3	Low	59.1	Low	2 Å²	2	56.4 Å²	56.4	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-62.5	-40.6	178.8	0	0	0	0	0	114.6	T645 S651 V652 V653	T645-G649 PolarHBondContact O-N 3.38Å; T645-G649 VanDerWaalsContact O-N 3.11Å; G649-S651 VanDerWaalsContact C-N 3.31Å; G649-S651 PolarHBondContact O-N 3.29Å; G649-V652 PolarHBondContact O-N 3.32Å; G649-V653 WeakPolarHBondContact O-CG2 3.31Å; G649-V653 PolarHBondContact O-N 3.34Å
650	L	59.6	Low	58.2	Low	28 Å²	28	55.4 Å²	55.4	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-41.1	176.2	-177.4	73	0	0	0	110.8	L597 K601 F646 E648 V652 H654	L597-L650 HydrophobicContact CB-CB 4.28Å; L597-L650 HydrophobicContact CB-CD1 3.4Å; L597-L650 VanDerWaalsContact CB-CD1 3.4Å; L597-L650 HydrophobicContact CB-CG 4.4Å; L597-L650 HydrophobicContact CD1-CD1 4.27Å; L597-L650 HydrophobicContact CG-CD1 4.43Å; K601-L650 HydrophobicContact CD-CD2 4.04Å; F646-L650 WeakPolarHBondContact O-CB 3.44Å; F646-L650 PolarHBondContact O-N 2.9Å; E648-L650 PolarHBondContact O-N 2.88Å; L650-V652 PolarHBondContact O-N 3.2Å; L650-H654 WeakPolarHBondContact O-CA 2.94Å; L650-H654 WeakPolarHBondContact O-CB 3.42Å; L650-H654 PolarHBondContact O-N 3.34Å
651	S	61.9	Low	57	Low	59 Å²	59	59.1 Å²	59.1	41%	0.413	31%	0.308	S	S	.	.	H	α-helix	trans	-61.8	-44.2	177.7	75.9	0	0	0	0	111.7	G647 E648 G649 N655	G647-S651 PolarHBondContact O-N 2.91Å; E648-S651 PolarHBondContact O-N 3.33Å; E648-S651 PolarHBondContact O-OG 3.46Å; G649-S651 VanDerWaalsContact C-N 3.31Å; G649-S651 PolarHBondContact O-N 3.29Å; S651-N655 WeakPolarHBondContact O-CB 3.46Å; S651-N655 PolarHBondContact O-N 3.22Å; S651-N655 PolarHBondContact O-ND2 3Å
652	V	58.8	Low	55.5	Low	32 Å²	32	61.6 Å²	61.6	19%	0.194	32%	0.317	C	S	.	.	H	α-helix	trans	-65.8	-53.4	179.3	177.4	0	0	0	0	110.6	E648 G649 L650 H654 N655 V656 L678 Q681	E648-V652 PolarHBondContact O-N 3.46Å; G649-V652 PolarHBondContact O-N 3.32Å; L650-V652 PolarHBondContact O-N 3.2Å; V652-H654 PolarHBondContact O-N 2.86Å; V652-N655 PolarHBondContact O-N 3.27Å; V652-V656 WeakPolarHBondContact O-CB 3.48Å; V652-V656 WeakPolarHBondContact O-CG2 3.25Å; V652-V656 PolarHBondContact O-N 3.39Å; V652-L678 HydrophobicContact CG1-CD1 4.24Å; V652-Q681 HydrophobicContact CG1-CB 3.81Å; V652-Q681 HydrophobicContact CG2-CB 4.24Å
653	V	55.6	Low	54.2	Low	4 Å²	4	63.3 Å²	63.3	2%	0.024	33%	0.329	C	S	.	.	H	α-helix	trans	-66	-40.8	-178.1	174.7	0	0	0	0	111.3	Y590 A593 L597 G649 V656 S657 L682 L685	Y590-V653 HydrophobicContact CD1-CG1 4.45Å; A593-V653 HydrophobicContact CB-CG1 3.93Å; L597-V653 HydrophobicContact CD1-CB 3.71Å; L597-V653 HydrophobicContact CD1-CG1 3.94Å; L597-V653 HydrophobicContact CD1-CG2 3.84Å; G649-V653 WeakPolarHBondContact O-CG2 3.31Å; G649-V653 PolarHBondContact O-N 3.34Å; V653-V656 PolarHBondContact O-N 3.3Å; V653-S657 VanDerWaalsContact O-CB 3.28Å; V653-S657 WeakPolarHBondContact O-CB 3.36Å; V653-S657 PolarHBondContact O-N 3.38Å; V653-S657 PolarHBondContact O-OG 3.43Å; V653-L682 HydrophobicContact CG2-CD2 4.19Å; V653-L685 HydrophobicContact CG2-CD2 4.49Å
654	H	57.2	Low	52.8	Low	92 Å²	92	64.8 Å²	64.8	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-66	-46.5	177.9	-175.1	83.5	0	0	0	111.5	L650 V652 V656 S657 F658	L650-H654 WeakPolarHBondContact O-CA 2.94Å; L650-H654 WeakPolarHBondContact O-CB 3.42Å; L650-H654 PolarHBondContact O-N 3.34Å; V652-H654 PolarHBondContact O-N 2.86Å; H654-V656 PolarHBondContact O-N 3.02Å; H654-S657 PolarHBondContact O-N 2.93Å; H654-F658 WeakPolarHBondContact O-CB 3.49Å; H654-F658 PolarHBondContact O-N 2.86Å
655	N	52.1	Low	51.1	Low	102 Å²	102	70.6 Å²	70.6	55%	0.545	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-36.3	177.9	-71.9	-19.2	0	0	0	111.5	S651 V652 A659	S651-N655 WeakPolarHBondContact O-CB 3.46Å; S651-N655 PolarHBondContact O-N 3.22Å; S651-N655 PolarHBondContact O-ND2 3Å; V652-N655 PolarHBondContact O-N 3.27Å; N655-A659 WeakPolarHBondContact O-CB 3.39Å; N655-A659 PolarHBondContact O-N 3.43Å
656	V	51.7	Low	49.4	Very low	23 Å²	23	71.3 Å²	71.3	14%	0.139	36%	0.355	C	S	.	.	H	α-helix	trans	-73.9	-45	177.5	173.1	0	0	0	0	111.2	Y590 V652 V653 H654 F658 A659 F660 L678	Y590-V656 HydrophobicContact CD1-CG1 4.06Å; Y590-V656 HydrophobicContact CE1-CB 4.43Å; Y590-V656 HydrophobicContact CE1-CG1 3.53Å; Y590-V656 HydrophobicContact CE2-CG1 4.33Å; V652-V656 WeakPolarHBondContact O-CB 3.48Å; V652-V656 WeakPolarHBondContact O-CG2 3.25Å; V652-V656 PolarHBondContact O-N 3.39Å; V653-V656 PolarHBondContact O-N 3.3Å; H654-V656 PolarHBondContact O-N 3.02Å; V656-F658 VanDerWaalsContact C-N 3.26Å; V656-F658 PolarHBondContact O-N 3.36Å; V656-A659 CarbonylContact O-C 3.56Å; V656-A659 PolarHBondContact O-N 3.17Å; V656-F660 HydrophobicContact CG1-CD2 3.56Å; V656-F660 HydrophobicContact CG1-CE2 3.57Å; V656-F660 WeakPolarHBondContact O-CB 3.44Å; V656-F660 VanDerWaalsContact O-CD2 3.27Å; V656-F660 WeakPolarHBondContact O-CD2 3.46Å; V656-F660 PolarHBondContact O-N 3.44Å; V656-L678 HydrophobicContact CB-CD1 4.21Å; V656-L678 HydrophobicContact CG1-CD1 4.08Å; V656-L678 HydrophobicContact CG1-CD2 3.89Å; V656-L678 HydrophobicContact CG2-CD1 3.27Å; V656-L678 HydrophobicContact CG2-CD2 4.31Å; V656-L678 HydrophobicContact CG2-CG 4.37Å
657	S	50	Low	47.8	Very low	20 Å²	20	76.2 Å²	76.2	14%	0.14	39%	0.385	C	S	.	.	H	α-helix	trans	-57.7	-42.7	173.3	-55	0	0	0	0	111	Y590 V653 H654 F660 R661	Y590-S657 PolarHBondContact O-OG 2.95Å; V653-S657 VanDerWaalsContact O-CB 3.28Å; V653-S657 WeakPolarHBondContact O-CB 3.36Å; V653-S657 PolarHBondContact O-N 3.38Å; V653-S657 PolarHBondContact O-OG 3.43Å; H654-S657 PolarHBondContact O-N 2.93Å; S657-F660 PolarHBondContact O-N 2.94Å; S657-R661 VanDerWaalsContact O-CB 3.27Å; S657-R661 WeakPolarHBondContact O-CB 3.35Å; S657-R661 PolarHBondContact O-N 2.83Å
658	F	47.6	Very low	46.2	Very low	115 Å²	115	79.6 Å²	79.6	50%	0.504	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-47.8	175.5	-174.5	-92.6	0	0	0	110.6	H654 V656 F660 R661 W662	H654-F658 WeakPolarHBondContact O-CB 3.49Å; H654-F658 PolarHBondContact O-N 2.86Å; V656-F658 VanDerWaalsContact C-N 3.26Å; V656-F658 PolarHBondContact O-N 3.36Å; F658-F660 PolarHBondContact O-N 3.46Å; F658-R661 PolarHBondContact O-N 2.97Å; F658-W662 AromaticContact CE1-CD1 3.91Å; F658-W662 HydrophobicContact CE1-CG 4.41Å; F658-W662 AromaticContact CZ-CD1 3.93Å; F658-W662 AromaticContact CZ-NE1 3.89Å; F658-W662 WeakPolarHBondContact O-CB 3.44Å; F658-W662 PolarHBondContact O-N 2.87Å
659	A	43.9	Very low	44.9	Very low	45 Å²	45	77.7 Å²	77.7	37%	0.372	40%	0.398	S	S	.	.	H	α-helix	trans	-58.9	-44.9	175.5	0	0	0	0	0	111.7	N655 V656 W662 C663	N655-A659 WeakPolarHBondContact O-CB 3.39Å; N655-A659 PolarHBondContact O-N 3.43Å; V656-A659 CarbonylContact O-C 3.56Å; V656-A659 PolarHBondContact O-N 3.17Å; A659-W662 CarbonylContact O-C 3.53Å; A659-W662 WeakPolarHBondContact O-CB 3.45Å; A659-W662 PolarHBondContact O-N 3.5Å; A659-C663 WeakPolarHBondContact O-CB 3.34Å; A659-C663 PolarHBondContact O-N 2.87Å; A659-C663 PolarHBondContact O-SG 3.19Å
660	F	44.1	Very low	44	Very low	25 Å²	25	79.2 Å²	79.2	11%	0.11	41%	0.405	C	S	.	.	H	α-helix	trans	-64.5	-42.7	175.2	-88.7	-75.3	0	0	0	112.5	Y590 V656 S657 F658 W662 C663 N664 I670	Y590-F660 AromaticContact CD2-CD2 3.78Å; Y590-F660 HydrophobicContact CD2-CD2 3.78Å; Y590-F660 AromaticContact CD2-CE2 3.85Å; Y590-F660 HydrophobicContact CD2-CE2 3.85Å; Y590-F660 HydrophobicContact CD2-CG 4.43Å; Y590-F660 AromaticContact CE2-CD2 3.62Å; Y590-F660 HydrophobicContact CE2-CD2 3.62Å; Y590-F660 AromaticContact CE2-CE2 3.18Å; Y590-F660 HydrophobicContact CE2-CE2 3.18Å; Y590-F660 AromaticContact CE2-CZ 3.75Å; Y590-F660 HydrophobicContact CE2-CZ 3.75Å; Y590-F660 AromaticContact CZ-CE2 3.63Å; V656-F660 HydrophobicContact CG1-CD2 3.56Å; V656-F660 HydrophobicContact CG1-CE2 3.57Å; V656-F660 WeakPolarHBondContact O-CB 3.44Å; V656-F660 VanDerWaalsContact O-CD2 3.27Å; V656-F660 WeakPolarHBondContact O-CD2 3.46Å; V656-F660 PolarHBondContact O-N 3.44Å; S657-F660 PolarHBondContact O-N 2.94Å; F658-F660 PolarHBondContact O-N 3.46Å; F660-W662 PolarHBondContact O-N 3.34Å; F660-C663 PolarHBondContact O-N 3.44Å; F660-N664 PolarHBondContact O-N 3.47Å; F660-I670 HydrophobicContact CD1-CD1 4.01Å; F660-I670 HydrophobicContact CD2-CD1 4.4Å; F660-I670 HydrophobicContact CE1-CD1 3.25Å; F660-I670 HydrophobicContact CE2-CD1 3.7Å; F660-I670 HydrophobicContact CZ-CD1 3.07Å
661	R	41.5	Very low	43.3	Very low	198 Å²	198	81.1 Å²	81.1	75%	0.747	42%	0.415	S	S	*	.	H	α-helix	trans	-62.7	-32.3	175.4	-166.9	174.4	-173.3	165	2	111.5	S657 F658	S657-R661 VanDerWaalsContact O-CB 3.27Å; S657-R661 WeakPolarHBondContact O-CB 3.35Å; S657-R661 PolarHBondContact O-N 2.83Å; F658-R661 PolarHBondContact O-N 2.97Å
662	W	32.5	Very low	42.2	Very low	187 Å²	187	86.5 Å²	86.5	71%	0.708	43%	0.427	S	S	*	.	H	α-helix	trans	-72.6	-45.9	170.8	-114.6	60.3	0	0	0	112.3	F658 A659 F660 N664 R665	F658-W662 AromaticContact CE1-CD1 3.91Å; F658-W662 HydrophobicContact CE1-CG 4.41Å; F658-W662 AromaticContact CZ-CD1 3.93Å; F658-W662 AromaticContact CZ-NE1 3.89Å; F658-W662 WeakPolarHBondContact O-CB 3.44Å; F658-W662 PolarHBondContact O-N 2.87Å; A659-W662 CarbonylContact O-C 3.53Å; A659-W662 WeakPolarHBondContact O-CB 3.45Å; A659-W662 PolarHBondContact O-N 3.5Å; F660-W662 PolarHBondContact O-N 3.34Å; W662-N664 VanDerWaalsContact C-N 3.28Å; W662-N664 PolarHBondContact O-N 3Å; W662-R665 WeakPolarHBondContact O-CB 3.15Å; W662-R665 PolarHBondContact O-N 3.28Å
663	C	37.3	Very low	41.4	Very low	43 Å²	43	90.6 Å²	90.6	29%	0.291	44%	0.442	S	S	.	.	H	α-helix	trans	-70.3	-18.9	-178.8	-68.2	0	0	0	0	113.4	A659 F660 R665 G666	A659-C663 WeakPolarHBondContact O-CB 3.34Å; A659-C663 PolarHBondContact O-N 2.87Å; A659-C663 PolarHBondContact O-SG 3.19Å; F660-C663 PolarHBondContact O-N 3.44Å; C663-R665 PolarHBondContact O-N 3.5Å; C663-G666 CarbonylContact O-C 3.59Å; C663-G666 PolarHBondContact O-N 3.15Å
664	N	34.1	Very low	41.2	Very low	82 Å²	82	94.7 Å²	94.7	44%	0.439	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-10.6	166.5	-90.3	-1.2	0	0	0	113	T583 Q587 F660 W662 G666	T583-N664 WeakPolarHBondContact CG2-OD1 3.46Å; Q587-N664 PolarHBondContact OE1-ND2 3.18Å; F660-N664 PolarHBondContact O-N 3.47Å; W662-N664 VanDerWaalsContact C-N 3.28Å; W662-N664 PolarHBondContact O-N 3Å; N664-G666 VanDerWaalsContact C-N 3.33Å
665	R	30.7	Very low	40.9	Very low	234 Å²	234	91.5 Å²	91.5	88%	0.883	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.2	167	-65.1	-169.4	173.8	-166	-2.8	113.7	W662 C663	W662-R665 WeakPolarHBondContact O-CB 3.15Å; W662-R665 PolarHBondContact O-N 3.28Å; C663-R665 PolarHBondContact O-N 3.5Å
666	G	28.3	Very low	41.2	Very low	34 Å²	34	89.4 Å²	89.4	35%	0.351	45%	0.446	S	S	.	.	S	Bend	trans	-176.2	110.7	177.4	0	0	0	0	0	109.9	C663 N664 V668	C663-G666 CarbonylContact O-C 3.59Å; C663-G666 PolarHBondContact O-N 3.15Å; N664-G666 VanDerWaalsContact C-N 3.33Å; G666-V668 PolarHBondContact O-N 3.4Å
667	V	29.9	Very low	41.5	Very low	110 Å²	110	91.9 Å²	91.9	67%	0.667	46%	0.456	S	S	*	.			trans	-64.5	82.5	-176.4	-176.5	0	0	0	0	109.8	P669	V667-P669 WeakPolarHBondContact O-CD 3.22Å
668	V	31.9	Very low	42.1	Very low	105 Å²	105	91.5 Å²	91.5	64%	0.636	45%	0.452	S	S	*	.			trans	-91.1	112.9	161.3	-176.7	0	0	0	0	105.8	G666 I670	G666-V668 PolarHBondContact O-N 3.4Å; V668-I670 PolarHBondContact O-N 3.26Å
669	P	34.8	Very low	43.1	Very low	92 Å²	92	87 Å²	87	60%	0.597	43%	0.433	S	S	*	.			trans	-56.2	118.8	172.2	-17.1	28.9	0	0	0	107.3	V667 D671	V667-P669 WeakPolarHBondContact O-CD 3.22Å; P669-D671 PolarHBondContact O-N 3.25Å
670	I	40.6	Very low	44.4	Very low	34 Å²	34	88.7 Å²	88.7	17%	0.174	44%	0.435	C	S	.	.			trans	-51.3	111.3	177	-64.3	165.4	0	0	0	107.3	F660 V668 V674 H675	F660-I670 HydrophobicContact CD1-CD1 4.01Å; F660-I670 HydrophobicContact CD2-CD1 4.4Å; F660-I670 HydrophobicContact CE1-CD1 3.25Å; F660-I670 HydrophobicContact CE2-CD1 3.7Å; F660-I670 HydrophobicContact CZ-CD1 3.07Å; V668-I670 PolarHBondContact O-N 3.26Å; I670-V674 HydrophobicContact CG2-CB 3.86Å; I670-V674 HydrophobicContact CG2-CG1 3.89Å; I670-H675 HydrophobicContact CG2-CB 4.11Å
671	D	45.1	Very low	45.6	Very low	67 Å²	67	90.5 Å²	90.5	36%	0.358	44%	0.444	S	S	.	.			trans	-51	144.1	-179.4	-170	-7.2	0	0	0	109.7	P669 F673 V674 H675	P669-D671 PolarHBondContact O-N 3.25Å; D671-F673 PolarHBondContact O-N 3.44Å; D671-V674 PolarHBondContact O-N 3.08Å; D671-V674 VanDerWaalsContact O-N 3.08Å; D671-H675 PolarHBondContact O-N 3.34Å; D671-H675 VanDerWaalsContact O-N 3.1Å
672	R	38.7	Very low	47	Very low	173 Å²	173	81.1 Å²	81.1	65%	0.653	41%	0.409	S	S	*	.	H	α-helix	trans	-49.9	-31.6	-176.2	-152.4	-178.8	-159.9	-163.6	8.8	111.9	S676 D770	R672-S676 WeakPolarHBondContact O-CB 3.37Å; R672-S676 PolarHBondContact O-N 2.87Å; R672-S676 PolarHBondContact O-OG 3.22Å; R672-D770 IonicContact CZ-OD2 3.25Å; R672-D770 IonicContact NE-OD2 3.64Å; R672-D770 IonicContact NH2-OD2 3.68Å; R672-D770 PolarHBondContact NH2-OD2 3.39Å
673	F	42	Very low	49.2	Very low	118 Å²	118	78.3 Å²	78.3	52%	0.518	40%	0.398	S	S	.	.	H	α-helix	trans	-74.6	-47	179.6	-169	-94.6	0	0	0	114.1	D671 H675 S676 E677 L784	D671-F673 PolarHBondContact O-N 3.44Å; F673-H675 PolarHBondContact O-N 3.15Å; F673-S676 WeakPolarHBondContact CA-OG 3.46Å; F673-S676 PolarHBondContact O-N 3.07Å; F673-S676 PolarHBondContact O-OG 2.82Å; F673-E677 PolarHBondContact O-N 3.48Å; F673-L784 HydrophobicContact CD1-CD2 4.49Å; F673-L784 HydrophobicContact CG-CD2 4.36Å
674	V	50.4	Low	51.1	Low	90 Å²	90	81 Å²	81	55%	0.545	41%	0.405	S	S	.	.	H	α-helix	trans	-60.5	-38.5	175.3	178.8	0	0	0	0	109.1	I670 D671 L678	I670-V674 HydrophobicContact CG2-CB 3.86Å; I670-V674 HydrophobicContact CG2-CG1 3.89Å; D671-V674 PolarHBondContact O-N 3.08Å; D671-V674 VanDerWaalsContact O-N 3.08Å; V674-L678 WeakPolarHBondContact O-CB 3.2Å; V674-L678 PolarHBondContact O-N 3.47Å
675	H	52.8	Low	53	Low	24 Å²	24	77.7 Å²	77.7	11%	0.111	39%	0.387	C	S	.	.	H	α-helix	trans	-68.6	-41.9	175.5	179.6	77.9	0	0	0	113.5	I670 D671 F673 L678 L679 E763 R767	I670-H675 HydrophobicContact CG2-CB 4.11Å; D671-H675 PolarHBondContact O-N 3.34Å; D671-H675 VanDerWaalsContact O-N 3.1Å; F673-H675 PolarHBondContact O-N 3.15Å; H675-L678 WeakPolarHBondContact O-CB 3.39Å; H675-L678 PolarHBondContact O-N 3.41Å; H675-L679 VanDerWaalsContact NE2-CD1 3.28Å; H675-L679 WeakPolarHBondContact NE2-CD1 3.32Å; H675-L679 WeakPolarHBondContact O-CB 3.15Å; H675-L679 WeakPolarHBondContact O-CG 3.47Å; H675-L679 PolarHBondContact O-N 2.92Å; H675-E763 PolarHBondContact CE1-O 2.83Å; H675-E763 IonicContact CE1-OE2 3.79Å; H675-E763 PolarHBondContact CE1-OE2 3.45Å; H675-E763 IonicContact ND1-OE2 2.67Å; H675-E763 PolarHBondContact ND1-OE2 3.41Å; H675-E763 PolarHBondContact NE2-O 3.38Å; H675-R767 PolarHBondContact ND1-NH2 2.98Å
676	S	57.7	Low	55.2	Low	59 Å²	59	68.2 Å²	68.2	41%	0.413	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-40.7	177.8	60.2	0	0	0	0	112.5	R672 F673 L679 L680	R672-S676 WeakPolarHBondContact O-CB 3.37Å; R672-S676 PolarHBondContact O-N 2.87Å; R672-S676 PolarHBondContact O-OG 3.22Å; F673-S676 WeakPolarHBondContact CA-OG 3.46Å; F673-S676 PolarHBondContact O-N 3.07Å; F673-S676 PolarHBondContact O-OG 2.82Å; S676-L679 PolarHBondContact O-N 2.91Å; S676-L680 WeakPolarHBondContact O-CB 3.49Å; S676-L680 PolarHBondContact O-N 3.49Å
677	E	58	Low	57.8	Low	75 Å²	75	72.7 Å²	72.7	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-68.7	-41.2	175.2	-175.4	56.9	-149.4	0	0	110.5	F673 L679 L680 Q681	F673-E677 PolarHBondContact O-N 3.48Å; E677-L679 PolarHBondContact O-N 3.23Å; E677-L680 WeakPolarHBondContact O-CB 3.47Å; E677-L680 PolarHBondContact O-N 2.93Å; E677-L680 VanDerWaalsContact O-N 3.16Å; E677-Q681 HydrophobicContact CG-CG 4.49Å; E677-Q681 VanDerWaalsContact O-CG 3.29Å; E677-Q681 WeakPolarHBondContact O-CG 3.43Å; E677-Q681 PolarHBondContact O-N 3.42Å; E677-Q681 PolarHBondContact OE1-NE2 3.49Å
678	L	63.1	Low	60	Low	12 Å²	12	69.7 Å²	69.7	6%	0.063	35%	0.349	C	S	.	.	H	α-helix	trans	-56.3	-50.9	172.5	174.9	59.8	0	0	0	111.6	V652 V656 V674 H675 L680 Q681 L682	V652-L678 HydrophobicContact CG1-CD1 4.24Å; V656-L678 HydrophobicContact CB-CD1 4.21Å; V656-L678 HydrophobicContact CG1-CD1 4.08Å; V656-L678 HydrophobicContact CG1-CD2 3.89Å; V656-L678 HydrophobicContact CG2-CD1 3.27Å; V656-L678 HydrophobicContact CG2-CD2 4.31Å; V656-L678 HydrophobicContact CG2-CG 4.37Å; V674-L678 WeakPolarHBondContact O-CB 3.2Å; V674-L678 PolarHBondContact O-N 3.47Å; H675-L678 WeakPolarHBondContact O-CB 3.39Å; H675-L678 PolarHBondContact O-N 3.41Å; L678-L680 VanDerWaalsContact C-N 3.27Å; L678-L680 PolarHBondContact O-N 3.23Å; L678-Q681 PolarHBondContact O-N 3.36Å; L678-L682 HydrophobicContact CD1-CD1 3.8Å; L678-L682 HydrophobicContact CD1-CD2 4.41Å; L678-L682 HydrophobicContact CD1-CG 3.89Å; L678-L682 HydrophobicContact CD2-CD1 4.49Å; L678-L682 HydrophobicContact CG-CD1 3.78Å; L678-L682 HydrophobicContact CG-CG 4.29Å; L678-L682 WeakPolarHBondContact O-CB 3.49Å; L678-L682 VanDerWaalsContact O-CG 3.25Å; L678-L682 WeakPolarHBondContact O-CG 3.26Å; L678-L682 PolarHBondContact O-N 2.97Å
679	L	67.7	Low	61.9	Low	20 Å²	20	64.7 Å²	64.7	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-37.8	176.7	-81.6	178.4	0	0	0	111.8	H675 S676 E677 R683 I760 E763 T764	H675-L679 VanDerWaalsContact NE2-CD1 3.28Å; H675-L679 WeakPolarHBondContact NE2-CD1 3.32Å; H675-L679 WeakPolarHBondContact O-CB 3.15Å; H675-L679 WeakPolarHBondContact O-CG 3.47Å; H675-L679 PolarHBondContact O-N 2.92Å; S676-L679 PolarHBondContact O-N 2.91Å; E677-L679 PolarHBondContact O-N 3.23Å; L679-R683 VanDerWaalsContact O-CB 3.31Å; L679-R683 WeakPolarHBondContact O-CB 3.32Å; L679-R683 WeakPolarHBondContact O-CG 3.45Å; L679-R683 PolarHBondContact O-N 3.36Å; L679-I760 HydrophobicContact CD2-CG2 4.47Å; L679-E763 HydrophobicContact CD2-CB 3.6Å; L679-E763 HydrophobicContact CG-CB 4.33Å; L679-T764 HydrophobicContact CD1-CG2 4.43Å; L679-T764 HydrophobicContact CD2-CG2 4.2Å
680	L	72.3	Confident	63.9	Low	81 Å²	81	62.6 Å²	62.6	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-46.3	175.5	-174	71.6	0	0	0	111.3	S676 E677 L678 R683 K684	S676-L680 WeakPolarHBondContact O-CB 3.49Å; S676-L680 PolarHBondContact O-N 3.49Å; E677-L680 WeakPolarHBondContact O-CB 3.47Å; E677-L680 PolarHBondContact O-N 2.93Å; E677-L680 VanDerWaalsContact O-N 3.16Å; L678-L680 VanDerWaalsContact C-N 3.27Å; L678-L680 PolarHBondContact O-N 3.23Å; L680-R683 PolarHBondContact O-N 3.42Å; L680-K684 WeakPolarHBondContact O-CG 3.47Å; L680-K684 PolarHBondContact O-N 2.87Å
681	Q	67.9	Low	65.8	Low	63 Å²	63	67.1 Å²	67.1	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-67.7	-42.6	179.3	-65	-65.6	-22.7	0	0	111.9	V652 E677 L678 R683 K684 L685	V652-Q681 HydrophobicContact CG1-CB 3.81Å; V652-Q681 HydrophobicContact CG2-CB 4.24Å; E677-Q681 HydrophobicContact CG-CG 4.49Å; E677-Q681 VanDerWaalsContact O-CG 3.29Å; E677-Q681 WeakPolarHBondContact O-CG 3.43Å; E677-Q681 PolarHBondContact O-N 3.42Å; E677-Q681 PolarHBondContact OE1-NE2 3.49Å; L678-Q681 PolarHBondContact O-N 3.36Å; Q681-R683 PolarHBondContact O-N 2.91Å; Q681-K684 PolarHBondContact O-N 3.47Å; Q681-L685 PolarHBondContact O-N 3.36Å
682	L	70.7	Confident	67.3	Low	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-40.8	175.6	-68	172.1	0	0	0	111.5	V653 L678 L685 D686 L756 V759 I760	V653-L682 HydrophobicContact CG2-CD2 4.19Å; L678-L682 HydrophobicContact CD1-CD1 3.8Å; L678-L682 HydrophobicContact CD1-CD2 4.41Å; L678-L682 HydrophobicContact CD1-CG 3.89Å; L678-L682 HydrophobicContact CD2-CD1 4.49Å; L678-L682 HydrophobicContact CG-CD1 3.78Å; L678-L682 HydrophobicContact CG-CG 4.29Å; L678-L682 WeakPolarHBondContact O-CB 3.49Å; L678-L682 VanDerWaalsContact O-CG 3.25Å; L678-L682 WeakPolarHBondContact O-CG 3.26Å; L678-L682 PolarHBondContact O-N 2.97Å; L682-L685 PolarHBondContact O-N 3.42Å; L682-D686 WeakPolarHBondContact O-CB 3.34Å; L682-D686 PolarHBondContact O-N 3.15Å; L682-L756 HydrophobicContact CB-CD1 4.13Å; L682-L756 HydrophobicContact CD2-CD1 3.54Å; L682-L756 HydrophobicContact CG-CD1 4.38Å; L682-V759 HydrophobicContact CD1-CG1 3.84Å; L682-I760 HydrophobicContact CB-CD1 4.14Å; L682-I760 HydrophobicContact CB-CG1 3.84Å; L682-I760 HydrophobicContact CD1-CG1 4.49Å
683	R	78.8	Confident	69.3	Low	127 Å²	127	56.9 Å²	56.9	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-36.4	175.7	-75	177.6	-176.7	175.6	2.7	113.1	L679 L680 Q681 L685 D686 Q687 I760	L679-R683 VanDerWaalsContact O-CB 3.31Å; L679-R683 WeakPolarHBondContact O-CB 3.32Å; L679-R683 WeakPolarHBondContact O-CG 3.45Å; L679-R683 PolarHBondContact O-N 3.36Å; L680-R683 PolarHBondContact O-N 3.42Å; Q681-R683 PolarHBondContact O-N 2.91Å; R683-L685 VanDerWaalsContact C-N 3.34Å; R683-D686 PolarHBondContact O-N 3.38Å; R683-Q687 WeakPolarHBondContact O-CG 3.29Å; R683-Q687 PolarHBondContact O-N 3.07Å; R683-I760 HydrophobicContact CG-CD1 4.37Å
684	K	78.4	Confident	71.2	Confident	99 Å²	99	55.2 Å²	55.2	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-41	172.7	-76.5	174.8	-178.8	173.1	0	111.6	L680 Q681 S688	L680-K684 WeakPolarHBondContact O-CG 3.47Å; L680-K684 PolarHBondContact O-N 2.87Å; Q681-K684 PolarHBondContact O-N 3.47Å; K684-S688 WeakPolarHBondContact O-CB 3.49Å; K684-S688 PolarHBondContact O-N 2.83Å; K684-S688 PolarHBondContact O-OG 3.25Å
685	L	73.1	Confident	72.5	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-43	175.1	-177.3	63.8	0	0	0	111.2	T645 V653 Q681 L682 R683 S688 L689 L756	T645-L685 HydrophobicContact CG2-CD1 4.11Å; T645-L685 WeakPolarHBondContact O-CD1 3.32Å; V653-L685 HydrophobicContact CG2-CD2 4.49Å; Q681-L685 PolarHBondContact O-N 3.36Å; L682-L685 PolarHBondContact O-N 3.42Å; R683-L685 VanDerWaalsContact C-N 3.34Å; L685-S688 PolarHBondContact O-N 3.05Å; L685-L689 HydrophobicContact CD1-CD1 4.17Å; L685-L689 HydrophobicContact CD1-CG 4.21Å; L685-L689 HydrophobicContact CG-CD1 3.9Å; L685-L689 HydrophobicContact CG-CG 4.36Å; L685-L689 WeakPolarHBondContact O-CB 3.42Å; L685-L689 WeakPolarHBondContact O-CG 3.21Å; L685-L689 PolarHBondContact O-N 3.49Å; L685-L756 HydrophobicContact CB-CD2 4.04Å; L685-L756 HydrophobicContact CD2-CD1 4.19Å; L685-L756 HydrophobicContact CD2-CD2 3.91Å; L685-L756 HydrophobicContact CG-CD2 3.77Å
686	D	78.1	Confident	73.5	Confident	35 Å²	35	52.5 Å²	52.5	19%	0.187	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-47.1	177.3	179.6	62.2	0	0	0	111.5	L682 R683 S688 L689 A690 L756 N757 I760	L682-D686 WeakPolarHBondContact O-CB 3.34Å; L682-D686 PolarHBondContact O-N 3.15Å; R683-D686 PolarHBondContact O-N 3.38Å; D686-S688 VanDerWaalsContact C-N 3.32Å; D686-S688 PolarHBondContact O-N 3.47Å; D686-L689 PolarHBondContact O-N 3.14Å; D686-A690 WeakPolarHBondContact O-CB 3.16Å; D686-A690 PolarHBondContact O-N 3.42Å; D686-L756 HydrophobicContact CB-CD2 3.71Å; D686-L756 HydrophobicContact CB-CG 4.32Å; D686-N757 PolarHBondContact OD1-ND2 2.83Å; D686-N757 PolarHBondContact OD1-OD1 2.96Å; D686-I760 HydrophobicContact CB-CD1 3.94Å
687	Q	81.4	Confident	74.7	Confident	129 Å²	129	52.7 Å²	52.7	60%	0.603	27%	0.272	S	S	*	.	H	α-helix	trans	-57.8	-44.7	173.2	-72.9	176.5	-3.9	0	0	112.1	R683 A690 E691	R683-Q687 WeakPolarHBondContact O-CG 3.29Å; R683-Q687 PolarHBondContact O-N 3.07Å; Q687-A690 PolarHBondContact O-N 3.15Å; Q687-E691 WeakPolarHBondContact O-CG 3.3Å; Q687-E691 PolarHBondContact O-N 3.21Å
688	S	75.9	Confident	75.8	Confident	46 Å²	46	50.6 Å²	50.6	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-66.1	-42.2	-179.2	-57.7	0	0	0	0	112.2	K684 L685 D686 E691 V692	K684-S688 WeakPolarHBondContact O-CB 3.49Å; K684-S688 PolarHBondContact O-N 2.83Å; K684-S688 PolarHBondContact O-OG 3.25Å; L685-S688 PolarHBondContact O-N 3.05Å; D686-S688 VanDerWaalsContact C-N 3.32Å; D686-S688 PolarHBondContact O-N 3.47Å; S688-E691 PolarHBondContact O-N 3.31Å; S688-V692 WeakPolarHBondContact O-CG2 3.3Å; S688-V692 PolarHBondContact O-N 2.84Å
689	L	72.5	Confident	76.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.7	-35.2	177.5	-70.4	169.9	0	0	0	112.4	T645 F646 L685 D686 E691 V692 V693 L752 N753 L756	T645-L689 HydrophobicContact CG2-CD2 3.91Å; T645-L689 HydrophobicContact CG2-CG 4.13Å; F646-L689 HydrophobicContact CD2-CD2 3.96Å; F646-L689 HydrophobicContact CE1-CD2 4.21Å; F646-L689 HydrophobicContact CE2-CD2 3.29Å; F646-L689 HydrophobicContact CZ-CD2 3.43Å; F646-L689 VanDerWaalsContact CZ-CD2 3.43Å; L685-L689 HydrophobicContact CD1-CD1 4.17Å; L685-L689 HydrophobicContact CD1-CG 4.21Å; L685-L689 HydrophobicContact CG-CD1 3.9Å; L685-L689 HydrophobicContact CG-CG 4.36Å; L685-L689 WeakPolarHBondContact O-CB 3.42Å; L685-L689 WeakPolarHBondContact O-CG 3.21Å; L685-L689 PolarHBondContact O-N 3.49Å; D686-L689 PolarHBondContact O-N 3.14Å; L689-E691 PolarHBondContact O-N 3.09Å; L689-V692 PolarHBondContact O-N 3.4Å; L689-V692 VanDerWaalsContact O-N 3.12Å; L689-V693 PolarHBondContact O-N 3.41Å; L689-L752 HydrophobicContact CD1-CD2 3.54Å; L689-L752 HydrophobicContact CD1-CG 3.94Å; L689-L752 HydrophobicContact CD2-CD2 3.99Å; L689-L752 HydrophobicContact CG-CD2 4.44Å; L689-N753 WeakPolarHBondContact CB-OD1 3.31Å; L689-N753 WeakPolarHBondContact CD1-OD1 3.25Å; L689-L756 HydrophobicContact CD1-CD2 3.81Å
690	A	77.4	Confident	76.9	Confident	48 Å²	48	51.2 Å²	51.2	40%	0.397	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-29.5	173.5	0	0	0	0	0	112.3	D686 Q687 P694	D686-A690 WeakPolarHBondContact O-CB 3.16Å; D686-A690 PolarHBondContact O-N 3.42Å; Q687-A690 PolarHBondContact O-N 3.15Å; A690-P694 WeakPolarHBondContact O-CD 3.17Å; A690-P694 WeakPolarHBondContact O-CG 3.16Å
691	E	79.9	Confident	77.5	Confident	130 Å²	130	52.7 Å²	52.7	61%	0.607	28%	0.281	S	S	*	.	H	α-helix	trans	-78.4	-29.7	173	-70.2	-179.2	-174.6	0	0	113.6	Q687 S688 L689 S695	Q687-E691 WeakPolarHBondContact O-CG 3.3Å; Q687-E691 PolarHBondContact O-N 3.21Å; S688-E691 PolarHBondContact O-N 3.31Å; L689-E691 PolarHBondContact O-N 3.09Å; E691-S695 WeakPolarHBondContact O-CB 3.45Å; E691-S695 PolarHBondContact O-N 3.47Å
692	V	76.6	Confident	78.1	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.03	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-43.1	-177.8	169.2	0	0	0	0	111.6	R641 I642 S688 L689 S695 L696	R641-V692 HydrophobicContact CG-CG2 4.46Å; I642-V692 HydrophobicContact CG1-CG1 4.13Å; S688-V692 WeakPolarHBondContact O-CG2 3.3Å; S688-V692 PolarHBondContact O-N 2.84Å; L689-V692 PolarHBondContact O-N 3.4Å; L689-V692 VanDerWaalsContact O-N 3.12Å; V692-S695 PolarHBondContact O-N 3.47Å; V692-L696 HydrophobicContact CG1-CD1 3.78Å; V692-L696 HydrophobicContact CG1-CG 4.21Å; V692-L696 WeakPolarHBondContact O-CG 3.34Å; V692-L696 PolarHBondContact O-N 3.43Å
693	V	80.7	Confident	78.5	Confident	20 Å²	20	53.8 Å²	53.8	12%	0.121	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-53.5	-175.7	176.5	0	0	0	0	112	L689 S695 L696 Q697 M746 C749 R750	L689-V693 PolarHBondContact O-N 3.41Å; V693-S695 VanDerWaalsContact C-N 3.28Å; V693-S695 PolarHBondContact O-N 3.45Å; V693-L696 PolarHBondContact O-N 2.82Å; V693-Q697 PolarHBondContact O-N 2.86Å; V693-M746 HydrophobicContact CG1-CE 3.39Å; V693-M746 HydrophobicContact CG1-CG 4.16Å; V693-M746 WeakPolarHBondContact O-CE 3.24Å; V693-C749 HydrophobicContact CG2-CB 3.85Å; V693-R750 HydrophobicContact CG1-CG 4.03Å; V693-R750 HydrophobicContact CG2-CG 4.31Å
694	P	81.9	Confident	78.7	Confident	82 Å²	82	50.6 Å²	50.6	53%	0.532	29%	0.29	S	S	.	.	H	α-helix	trans	-59.8	-35.7	175.4	-22.9	33.7	0	0	0	113.4	A690 Q697 G698	A690-P694 WeakPolarHBondContact O-CD 3.17Å; A690-P694 WeakPolarHBondContact O-CG 3.16Å; P694-Q697 WeakPolarHBondContact O-CB 3.11Å; P694-Q697 PolarHBondContact O-N 3.15Å; P694-G698 PolarHBondContact O-N 2.81Å
695	S	76.9	Confident	79	Confident	53 Å²	53	51.9 Å²	51.9	37%	0.371	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-40.8	176.6	-177.3	0	0	0	0	112.3	E691 V692 V693 S699	E691-S695 WeakPolarHBondContact O-CB 3.45Å; E691-S695 PolarHBondContact O-N 3.47Å; V692-S695 PolarHBondContact O-N 3.47Å; V693-S695 VanDerWaalsContact C-N 3.28Å; V693-S695 PolarHBondContact O-N 3.45Å; S695-S699 WeakPolarHBondContact O-CB 3.33Å; S695-S699 PolarHBondContact O-N 3.08Å; S695-S699 PolarHBondContact O-OG 3.33Å
696	L	75.7	Confident	79.4	Confident	4 Å²	4	54 Å²	54	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-65.9	-41.5	173.3	-70.9	173.1	0	0	0	111.5	W634 C638 I642 V692 V693 S699 L700 M746	W634-L696 HydrophobicContact CZ2-CD2 4.1Å; C638-L696 HydrophobicContact CB-CD2 4.19Å; I642-L696 HydrophobicContact CD1-CD1 4.31Å; I642-L696 HydrophobicContact CD1-CD2 4.39Å; V692-L696 HydrophobicContact CG1-CD1 3.78Å; V692-L696 HydrophobicContact CG1-CG 4.21Å; V692-L696 WeakPolarHBondContact O-CG 3.34Å; V692-L696 PolarHBondContact O-N 3.43Å; V693-L696 PolarHBondContact O-N 2.82Å; L696-S699 PolarHBondContact O-N 2.8Å; L696-L700 WeakPolarHBondContact O-CB 3.39Å; L696-L700 PolarHBondContact O-N 3.2Å; L696-M746 HydrophobicContact CB-CG 4.44Å; L696-M746 HydrophobicContact CD1-CB 4.5Å
697	Q	82.6	Confident	79.6	Confident	64 Å²	64	52.3 Å²	52.3	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-53	177.1	-172.5	58.4	33.8	0	0	112.1	V693 P694 S699 L700 E701 M746	V693-Q697 PolarHBondContact O-N 2.86Å; P694-Q697 WeakPolarHBondContact O-CB 3.11Å; P694-Q697 PolarHBondContact O-N 3.15Å; Q697-S699 PolarHBondContact O-N 3.09Å; Q697-L700 WeakPolarHBondContact O-CB 3.28Å; Q697-L700 PolarHBondContact O-N 3.43Å; Q697-L700 VanDerWaalsContact O-N 3.12Å; Q697-E701 WeakPolarHBondContact CG-OE1 3.13Å; Q697-E701 PolarHBondContact NE2-OE1 3.32Å; Q697-E701 WeakPolarHBondContact O-CG 3.49Å; Q697-E701 PolarHBondContact O-N 3.3Å; Q697-M746 HydrophobicContact CB-CE 3.54Å; Q697-M746 HydrophobicContact CB-SD 4.5Å; Q697-M746 HydrophobicContact CG-CE 4.19Å; Q697-M746 PolarHBondContact OE1-SD 3.08Å; Q697-M746 VanDerWaalsContact OE1-SD 3.37Å
698	G	80.1	Confident	79.7	Confident	30 Å²	30	47.9 Å²	47.9	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-30.5	-179.9	0	0	0	0	0	112.7	P694 S702	P694-G698 PolarHBondContact O-N 2.81Å; G698-S702 WeakPolarHBondContact O-CB 3.2Å; G698-S702 PolarHBondContact O-N 2.92Å; G698-S702 PolarHBondContact O-OG 3.12Å
699	S	72.8	Confident	80	Confident	36 Å²	36	50.1 Å²	50.1	25%	0.252	29%	0.291	S	S	.	.	H	α-helix	trans	-72	-40.2	173.9	-58.7	0	0	0	0	112.3	S695 L696 Q697 E701 S702 L703	S695-S699 WeakPolarHBondContact O-CB 3.33Å; S695-S699 PolarHBondContact O-N 3.08Å; S695-S699 PolarHBondContact O-OG 3.33Å; L696-S699 PolarHBondContact O-N 2.8Å; Q697-S699 PolarHBondContact O-N 3.09Å; S699-E701 VanDerWaalsContact C-N 3.34Å; S699-S702 WeakPolarHBondContact O-CB 3.37Å; S699-S702 PolarHBondContact O-N 3.44Å; S699-L703 WeakPolarHBondContact O-CB 3.42Å; S699-L703 PolarHBondContact O-N 2.9Å
700	L	81.7	Confident	80.4	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-38.4	174.9	179.3	62.6	0	0	0	111.6	L696 Q697 L703 T704 K739 I742 E743	L696-L700 WeakPolarHBondContact O-CB 3.39Å; L696-L700 PolarHBondContact O-N 3.2Å; Q697-L700 WeakPolarHBondContact O-CB 3.28Å; Q697-L700 PolarHBondContact O-N 3.43Å; Q697-L700 VanDerWaalsContact O-N 3.12Å; L700-L703 PolarHBondContact O-N 3.07Å; L700-T704 VanDerWaalsContact O-CB 3.25Å; L700-T704 WeakPolarHBondContact O-CB 3.47Å; L700-T704 PolarHBondContact O-N 2.89Å; L700-T704 PolarHBondContact O-OG1 2.8Å; L700-K739 HydrophobicContact CD1-CB 4.2Å; L700-K739 HydrophobicContact CD1-CG 3.94Å; L700-I742 HydrophobicContact CB-CG2 4.23Å; L700-I742 HydrophobicContact CD1-CB 4.22Å; L700-I742 HydrophobicContact CD1-CD1 4.3Å; L700-I742 HydrophobicContact CD1-CG2 4.08Å; L700-E743 HydrophobicContact CD2-CG 3.7Å
701	E	83.5	Confident	80.7	Confident	111 Å²	111	50.1 Å²	50.1	52%	0.519	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-44	173.2	-73.9	168.7	-167.9	0	0	111.4	Q697 S699 T704 H705	Q697-E701 WeakPolarHBondContact CG-OE1 3.13Å; Q697-E701 PolarHBondContact NE2-OE1 3.32Å; Q697-E701 WeakPolarHBondContact O-CG 3.49Å; Q697-E701 PolarHBondContact O-N 3.3Å; S699-E701 VanDerWaalsContact C-N 3.34Å; E701-T704 PolarHBondContact O-N 3.23Å; E701-T704 VanDerWaalsContact O-N 3.15Å; E701-H705 WeakPolarHBondContact O-CB 3.17Å; E701-H705 PolarHBondContact O-N 3.05Å
702	S	81	Confident	80.7	Confident	79 Å²	79	47.1 Å²	47.1	55%	0.552	28%	0.276	S	S	*	.	H	α-helix	trans	-61.6	-44.1	175	-59.7	0	0	0	0	111.9	G698 S699 T704 F706	G698-S702 WeakPolarHBondContact O-CB 3.2Å; G698-S702 PolarHBondContact O-N 2.92Å; G698-S702 PolarHBondContact O-OG 3.12Å; S699-S702 WeakPolarHBondContact O-CB 3.37Å; S699-S702 PolarHBondContact O-N 3.44Å; S702-T704 VanDerWaalsContact C-N 3.29Å; S702-T704 PolarHBondContact O-N 3.28Å; S702-F706 VanDerWaalsContact O-CB 3.32Å; S702-F706 WeakPolarHBondContact O-CB 3.35Å; S702-F706 PolarHBondContact O-N 3.46Å
703	L	79.1	Confident	80.6	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-37.2	174.2	-170.7	76.5	0	0	0	111.2	Y627 V630 L631 S699 L700 S707 K739 I742	Y627-L703 HydrophobicContact CE2-CD1 3.84Å; Y627-L703 HydrophobicContact CE2-CG 4.44Å; V630-L703 HydrophobicContact CG1-CD1 4.47Å; L631-L703 HydrophobicContact CD1-CD1 4.45Å; L631-L703 HydrophobicContact CD1-CD2 4.42Å; S699-L703 WeakPolarHBondContact O-CB 3.42Å; S699-L703 PolarHBondContact O-N 2.9Å; L700-L703 PolarHBondContact O-N 3.07Å; L703-S707 VanDerWaalsContact O-CB 3.26Å; L703-S707 WeakPolarHBondContact O-CB 3.47Å; L703-S707 PolarHBondContact O-N 2.72Å; L703-S707 PolarHBondContact O-OG 2.95Å; L703-K739 HydrophobicContact CD2-CG 4.19Å; L703-I742 HydrophobicContact CD2-CD1 3.6Å
704	T	83.2	Confident	80.4	Confident	60 Å²	60	55.1 Å²	55.1	37%	0.368	30%	0.304	S	S	.	.	H	α-helix	trans	-68.9	-46.1	179	-65.6	0	0	0	0	111.7	L700 E701 S702 S707 G708 K739	L700-T704 VanDerWaalsContact O-CB 3.25Å; L700-T704 WeakPolarHBondContact O-CB 3.47Å; L700-T704 PolarHBondContact O-N 2.89Å; L700-T704 PolarHBondContact O-OG1 2.8Å; E701-T704 PolarHBondContact O-N 3.23Å; E701-T704 VanDerWaalsContact O-N 3.15Å; S702-T704 VanDerWaalsContact C-N 3.29Å; S702-T704 PolarHBondContact O-N 3.28Å; T704-S707 WeakPolarHBondContact CA-OG 3.41Å; T704-S707 PolarHBondContact O-N 3.38Å; T704-S707 PolarHBondContact O-OG 2.79Å; T704-G708 PolarHBondContact O-N 2.79Å; T704-K739 WeakPolarHBondContact OG1-CE 3.44Å; T704-K739 PolarHBondContact OG1-NZ 2.86Å
705	H	84.3	Confident	80.4	Confident	126 Å²	126	55 Å²	55	58%	0.583	30%	0.299	S	S	*	.	H	α-helix	trans	-57.9	-50.9	172.8	-176.1	-86.5	0	0	0	111.2	E701 S707 G708 E709	E701-H705 WeakPolarHBondContact O-CB 3.17Å; E701-H705 PolarHBondContact O-N 3.05Å; H705-S707 PolarHBondContact O-N 2.94Å; H705-G708 PolarHBondContact O-N 3.48Å; H705-G708 VanDerWaalsContact O-N 3.13Å; H705-E709 IonicContact CE1-OE1 2.82Å; H705-E709 PolarHBondContact CE1-OE1 2.85Å; H705-E709 IonicContact ND1-OE1 3.01Å; H705-E709 IonicContact NE2-OE1 3.96Å; H705-E709 PolarHBondContact O-N 3.47Å
706	F	82.1	Confident	80.4	Confident	57 Å²	57	62.8 Å²	62.8	25%	0.25	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-46.3	177.4	-179.1	-108.5	0	0	0	112.2	Y627 V630 S702 G708 E709 M710	Y627-F706 HydrophobicContact CD2-CD1 4.3Å; Y627-F706 HydrophobicContact CD2-CE1 4.12Å; V630-F706 HydrophobicContact CB-CE1 4.49Å; V630-F706 HydrophobicContact CG2-CE1 4.21Å; V630-F706 HydrophobicContact CG2-CZ 4.24Å; S702-F706 VanDerWaalsContact O-CB 3.32Å; S702-F706 WeakPolarHBondContact O-CB 3.35Å; S702-F706 PolarHBondContact O-N 3.46Å; F706-G708 VanDerWaalsContact C-N 3.32Å; F706-G708 PolarHBondContact O-N 2.94Å; F706-E709 PolarHBondContact O-N 3.37Å; F706-M710 HydrophobicContact CD1-SD 3.96Å; F706-M710 HydrophobicContact CE1-CG 4.27Å; F706-M710 HydrophobicContact CE1-SD 3.33Å; F706-M710 WeakPolarHBondContact CE1-SD 3.27Å; F706-M710 HydrophobicContact CE2-SD 4.47Å; F706-M710 HydrophobicContact CZ-CG 4.25Å; F706-M710 HydrophobicContact CZ-SD 3.64Å; F706-M710 WeakPolarHBondContact O-CG 3.45Å; F706-M710 PolarHBondContact O-N 3.05Å
707	S	82.8	Confident	80.2	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-37.1	176.3	69	0	0	0	0	112.7	L703 T704 H705 M710 F711 K739	L703-S707 VanDerWaalsContact O-CB 3.26Å; L703-S707 WeakPolarHBondContact O-CB 3.47Å; L703-S707 PolarHBondContact O-N 2.72Å; L703-S707 PolarHBondContact O-OG 2.95Å; T704-S707 WeakPolarHBondContact CA-OG 3.41Å; T704-S707 PolarHBondContact O-N 3.38Å; T704-S707 PolarHBondContact O-OG 2.79Å; H705-S707 PolarHBondContact O-N 2.94Å; S707-M710 PolarHBondContact O-N 2.94Å; S707-F711 WeakPolarHBondContact O-CB 3.48Å; S707-F711 WeakPolarHBondContact O-CD2 3.46Å; S707-F711 WeakPolarHBondContact O-CG 3.35Å; S707-F711 PolarHBondContact O-N 2.72Å; S707-K739 WeakPolarHBondContact OG-CE 3.27Å; S707-K739 PolarHBondContact OG-NZ 3.33Å
708	G	83.1	Confident	79.8	Confident	35 Å²	35	61.8 Å²	61.8	36%	0.361	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-42.7	177.7	0	0	0	0	0	112.4	T704 H705 F706 M710 F711 S712	T704-G708 PolarHBondContact O-N 2.79Å; H705-G708 PolarHBondContact O-N 3.48Å; H705-G708 VanDerWaalsContact O-N 3.13Å; F706-G708 VanDerWaalsContact C-N 3.32Å; F706-G708 PolarHBondContact O-N 2.94Å; G708-M710 VanDerWaalsContact C-N 3.34Å; G708-F711 PolarHBondContact O-N 2.96Å; G708-S712 WeakPolarHBondContact O-CB 3.24Å; G708-S712 PolarHBondContact O-N 3.04Å
709	E	82	Confident	79.5	Confident	93 Å²	93	63.8 Å²	63.8	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-60.8	-43.8	172	-70.1	-172.7	158.8	0	0	111.6	H705 F706 S712 R713	H705-E709 IonicContact CE1-OE1 2.82Å; H705-E709 PolarHBondContact CE1-OE1 2.85Å; H705-E709 IonicContact ND1-OE1 3.01Å; H705-E709 IonicContact NE2-OE1 3.96Å; H705-E709 PolarHBondContact O-N 3.47Å; F706-E709 PolarHBondContact O-N 3.37Å; E709-S712 PolarHBondContact O-N 3.38Å; E709-R713 WeakPolarHBondContact O-CG 3.4Å; E709-R713 PolarHBondContact O-N 2.97Å; E709-R713 VanDerWaalsContact O-N 3.08Å
710	M	80.4	Confident	79.6	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.049	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-44.4	175.8	-70.1	-173.3	86.4	0	0	112	L623 Y627 F706 S707 G708 R713 L714 F731	L623-M710 HydrophobicContact CB-CE 3.76Å; L623-M710 HydrophobicContact CD2-CE 3.28Å; L623-M710 HydrophobicContact CG-CE 4.11Å; L623-M710 WeakPolarHBondContact O-CE 3.12Å; Y627-M710 HydrophobicContact CD2-SD 4.38Å; F706-M710 HydrophobicContact CD1-SD 3.96Å; F706-M710 HydrophobicContact CE1-CG 4.27Å; F706-M710 HydrophobicContact CE1-SD 3.33Å; F706-M710 WeakPolarHBondContact CE1-SD 3.27Å; F706-M710 HydrophobicContact CE2-SD 4.47Å; F706-M710 HydrophobicContact CZ-CG 4.25Å; F706-M710 HydrophobicContact CZ-SD 3.64Å; F706-M710 WeakPolarHBondContact O-CG 3.45Å; F706-M710 PolarHBondContact O-N 3.05Å; S707-M710 PolarHBondContact O-N 2.94Å; G708-M710 VanDerWaalsContact C-N 3.34Å; M710-R713 PolarHBondContact O-N 3.26Å; M710-L714 WeakPolarHBondContact O-CB 3.42Å; M710-L714 VanDerWaalsContact O-CG 3.32Å; M710-L714 WeakPolarHBondContact O-CG 3.45Å; M710-L714 PolarHBondContact O-N 3.31Å; M710-F731 HydrophobicContact CB-CE1 4.31Å; M710-F731 HydrophobicContact CE-CE1 4.3Å; M710-F731 HydrophobicContact CE-CZ 3.88Å; M710-F731 HydrophobicContact SD-CE1 4.28Å; M710-F731 HydrophobicContact SD-CZ 3.9Å
711	F	83.8	Confident	79.1	Confident	38 Å²	38	69.2 Å²	69.2	17%	0.167	38%	0.383	C	S	.	.	H	α-helix	trans	-64.5	-39.3	177.7	-66.4	-39.6	0	0	0	112.5	S707 G708 L714 N715 L728 F731 K732 V735	S707-F711 WeakPolarHBondContact O-CB 3.48Å; S707-F711 WeakPolarHBondContact O-CD2 3.46Å; S707-F711 WeakPolarHBondContact O-CG 3.35Å; S707-F711 PolarHBondContact O-N 2.72Å; G708-F711 PolarHBondContact O-N 2.96Å; F711-L714 PolarHBondContact O-N 3.29Å; F711-N715 VanDerWaalsContact O-CB 3.24Å; F711-N715 WeakPolarHBondContact O-CB 3.39Å; F711-N715 PolarHBondContact O-N 2.78Å; F711-L728 HydrophobicContact CD1-CD1 4.34Å; F711-F731 HydrophobicContact CD1-CD1 4.13Å; F711-F731 HydrophobicContact CD1-CE1 4.3Å; F711-F731 AromaticContact CE1-CD1 3.59Å; F711-F731 HydrophobicContact CE1-CD1 3.59Å; F711-F731 AromaticContact CE1-CE1 3.82Å; F711-F731 HydrophobicContact CE1-CE1 3.82Å; F711-K732 HydrophobicContact CD1-CG 3.74Å; F711-K732 HydrophobicContact CE1-CB 4.06Å; F711-K732 HydrophobicContact CE1-CG 3.35Å; F711-K732 HydrophobicContact CZ-CB 4.27Å; F711-K732 HydrophobicContact CZ-CG 3.85Å; F711-V735 HydrophobicContact CE1-CG2 4.38Å; F711-V735 HydrophobicContact CE2-CG1 4.23Å; F711-V735 HydrophobicContact CZ-CB 3.85Å; F711-V735 HydrophobicContact CZ-CG1 3.87Å; F711-V735 HydrophobicContact CZ-CG2 3.95Å
712	S	79.7	Confident	78.6	Confident	67 Å²	67	72.9 Å²	72.9	47%	0.469	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-47.7	174.4	-175.4	0	0	0	0	111	G708 E709 N715 W716	G708-S712 WeakPolarHBondContact O-CB 3.24Å; G708-S712 PolarHBondContact O-N 3.04Å; E709-S712 PolarHBondContact O-N 3.38Å; S712-N715 PolarHBondContact O-N 3.42Å; S712-W716 VanDerWaalsContact O-CD1 3.22Å; S712-W716 PolarHBondContact O-N 2.76Å; S712-W716 VanDerWaalsContact O-N 3.15Å
713	R	76	Confident	78.2	Confident	188 Å²	188	73.2 Å²	73.2	71%	0.709	40%	0.396	S	S	*	.	H	α-helix	trans	-64	-43.2	177.2	-69.9	-178.3	-177.3	-154.9	3.1	112.7	E709 M710 W716 A717	E709-R713 WeakPolarHBondContact O-CG 3.4Å; E709-R713 PolarHBondContact O-N 2.97Å; E709-R713 VanDerWaalsContact O-N 3.08Å; M710-R713 PolarHBondContact O-N 3.26Å; R713-W716 PolarHBondContact O-N 3.08Å; R713-A717 PolarHBondContact O-N 2.95Å; R713-A717 VanDerWaalsContact O-N 3.14Å
714	L	76.7	Confident	77.7	Confident	6 Å²	6	74.8 Å²	74.8	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-70.3	-34	178.8	-72.5	169.1	0	0	0	112.2	F620 L623 M710 F711 A717 A718 W724 L728 F731	F620-L714 HydrophobicContact CD2-CD2 4.45Å; L623-L714 HydrophobicContact CD1-CD2 3.94Å; M710-L714 WeakPolarHBondContact O-CB 3.42Å; M710-L714 VanDerWaalsContact O-CG 3.32Å; M710-L714 WeakPolarHBondContact O-CG 3.45Å; M710-L714 PolarHBondContact O-N 3.31Å; F711-L714 PolarHBondContact O-N 3.29Å; L714-A717 PolarHBondContact O-N 3.48Å; L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.1Å; L714-A718 PolarHBondContact O-N 3.29Å; L714-W724 HydrophobicContact CD2-CE3 3.8Å; L714-W724 HydrophobicContact CD2-CZ3 3.72Å; L714-L728 HydrophobicContact CB-CD1 3.4Å; L714-L728 HydrophobicContact CD1-CD1 4.08Å; L714-L728 HydrophobicContact CG-CD1 4.37Å; L714-F731 HydrophobicContact CD1-CD1 3.75Å; L714-F731 HydrophobicContact CD1-CE1 4.08Å
715	N	80.7	Confident	77.3	Confident	80 Å²	80	75 Å²	75	43%	0.428	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-42.9	173.3	-87	-18.6	0	0	0	111.7	F711 S712 A717 A718 G719 L728	F711-N715 VanDerWaalsContact O-CB 3.24Å; F711-N715 WeakPolarHBondContact O-CB 3.39Å; F711-N715 PolarHBondContact O-N 2.78Å; S712-N715 PolarHBondContact O-N 3.42Å; N715-A717 VanDerWaalsContact C-N 3.34Å; N715-A718 PolarHBondContact O-N 2.88Å; N715-G719 PolarHBondContact O-N 2.75Å; N715-L728 WeakPolarHBondContact OD1-CD2 3.18Å
716	W	76.9	Confident	76.9	Confident	215 Å²	215	73.4 Å²	73.4	81%	0.814	41%	0.405	S	S	*	.	H	α-helix	trans	-59.2	-45.5	173.2	-84	55.8	0	0	0	111.4	S712 R713 G719 A720	S712-W716 VanDerWaalsContact O-CD1 3.22Å; S712-W716 PolarHBondContact O-N 2.76Å; S712-W716 VanDerWaalsContact O-N 3.15Å; R713-W716 PolarHBondContact O-N 3.08Å; W716-G719 PolarHBondContact O-N 3.45Å; W716-A720 PolarHBondContact O-N 2.8Å
717	A	72.5	Confident	76.4	Confident	35 Å²	35	72.1 Å²	72.1	29%	0.289	40%	0.4	S	S	.	.	H	α-helix	trans	-64.7	-39.3	176.8	0	0	0	0	0	112.8	R713 L714 N715 A720 N721	R713-A717 PolarHBondContact O-N 2.95Å; R713-A717 VanDerWaalsContact O-N 3.14Å; L714-A717 PolarHBondContact O-N 3.48Å; N715-A717 VanDerWaalsContact C-N 3.34Å; A717-A720 PolarHBondContact O-N 3.01Å; A717-N721 PolarHBondContact O-N 3.34Å
718	A	73.3	Confident	76.1	Confident	12 Å²	12	72.3 Å²	72.3	10%	0.099	40%	0.401	C	S	.	.	H	α-helix	trans	-70.3	-33.7	178.5	0	0	0	0	0	113.3	L714 N715 A720 N721 W724 L728	L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.1Å; L714-A718 PolarHBondContact O-N 3.29Å; N715-A718 PolarHBondContact O-N 2.88Å; A718-A720 PolarHBondContact O-N 3.21Å; A718-N721 CarbonylContact O-C 3.57Å; A718-N721 VanDerWaalsContact O-C 3.24Å; A718-N721 PolarHBondContact O-N 3.16Å; A718-N721 VanDerWaalsContact O-N 3.15Å; A718-W724 HydrophobicContact CB-CB 3.94Å; A718-L728 HydrophobicContact CB-CD2 4.31Å
719	G	74.2	Confident	75.8	Confident	73 Å²	73	74.5 Å²	74.5	75%	0.753	40%	0.402	S	S	*	.	H	α-helix	trans	-60.6	-35.4	170.4	0	0	0	0	0	112.6	N715 W716	N715-G719 PolarHBondContact O-N 2.75Å; W716-G719 PolarHBondContact O-N 3.45Å
720	A	74.2	Confident	75.5	Confident	91 Å²	91	72.6 Å²	72.6	75%	0.752	40%	0.399	S	S	*	.	H	α-helix	trans	-79.1	-24.8	174	0	0	0	0	0	113.4	W716 A717 A718	W716-A720 PolarHBondContact O-N 2.8Å; A717-A720 PolarHBondContact O-N 3.01Å; A718-A720 PolarHBondContact O-N 3.21Å
721	N	71.2	Confident	75.4	Confident	69 Å²	69	72.6 Å²	72.6	37%	0.369	40%	0.399	S	S	.	.			trans	-149.1	112.3	-174.1	-175.5	-13	0	0	0	113.5	A717 A718 V723 W724	A717-N721 PolarHBondContact O-N 3.34Å; A718-N721 CarbonylContact O-C 3.57Å; A718-N721 VanDerWaalsContact O-C 3.24Å; A718-N721 PolarHBondContact O-N 3.16Å; A718-N721 VanDerWaalsContact O-N 3.15Å; N721-V723 PolarHBondContact O-N 3.14Å; N721-V723 VanDerWaalsContact O-N 3.11Å; N721-V723 WeakPolarHBondContact OD1-CB 3.32Å; N721-V723 WeakPolarHBondContact OD1-CG2 3.36Å; N721-V723 PolarHBondContact OD1-N 3.33Å; N721-W724 WeakPolarHBondContact O-CB 3.29Å; N721-W724 PolarHBondContact O-N 3.09Å; N721-W724 VanDerWaalsContact O-N 3.09Å
722	K	73.8	Confident	75.3	Confident	188 Å²	188	73.1 Å²	73.1	82%	0.817	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.2	-179.2	-65.1	-174.6	178.6	-177.6	0	115	W724 T725	K722-W724 PolarHBondContact O-N 3.28Å; K722-T725 WeakPolarHBondContact O-CB 3.4Å; K722-T725 PolarHBondContact O-N 2.89Å; K722-T725 VanDerWaalsContact O-N 3.16Å; K722-T725 PolarHBondContact O-OG1 3.27Å; K722-T725 VanDerWaalsContact O-OG1 3.08Å
723	V	71.5	Confident	75.3	Confident	85 Å²	85	75.6 Å²	75.6	52%	0.515	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-29.3	178.5	179	0	0	0	0	111.4	N721 T725 H727	N721-V723 PolarHBondContact O-N 3.14Å; N721-V723 VanDerWaalsContact O-N 3.11Å; N721-V723 WeakPolarHBondContact OD1-CB 3.32Å; N721-V723 WeakPolarHBondContact OD1-CG2 3.36Å; N721-V723 PolarHBondContact OD1-N 3.33Å; V723-T725 VanDerWaalsContact C-N 3.29Å; V723-T725 PolarHBondContact O-N 3.4Å; V723-H727 PolarHBondContact O-ND1 3.13Å
724	W	69.6	Low	75.2	Confident	42 Å²	42	67.7 Å²	67.7	16%	0.159	38%	0.38	C	S	.	.	H	α-helix	trans	-75.4	-18.5	178.4	-70.3	78.8	0	0	0	112.6	S617 A619 F620 L714 A718 N721 K722 S726 H727 L728	S617-W724 WeakPolarHBondContact OG-CZ2 3.5Å; A619-W724 HydrophobicContact CB-CH2 4Å; A619-W724 HydrophobicContact CB-CZ2 4.48Å; F620-W724 HydrophobicContact CB-CH2 4.06Å; F620-W724 HydrophobicContact CB-CZ3 3.86Å; F620-W724 AromaticContact CD2-CE3 3.99Å; F620-W724 HydrophobicContact CD2-CE3 3.99Å; F620-W724 AromaticContact CD2-CZ3 3.71Å; F620-W724 HydrophobicContact CD2-CZ3 3.71Å; F620-W724 HydrophobicContact CG-CZ3 4.29Å; L714-W724 HydrophobicContact CD2-CE3 3.8Å; L714-W724 HydrophobicContact CD2-CZ3 3.72Å; A718-W724 HydrophobicContact CB-CB 3.94Å; N721-W724 WeakPolarHBondContact O-CB 3.29Å; N721-W724 PolarHBondContact O-N 3.09Å; N721-W724 VanDerWaalsContact O-N 3.09Å; K722-W724 PolarHBondContact O-N 3.28Å; W724-S726 PolarHBondContact O-N 2.92Å; W724-H727 PolarHBondContact O-N 3.41Å; W724-L728 WeakPolarHBondContact O-CB 3.19Å; W724-L728 PolarHBondContact O-N 3.41Å
725	T	73.5	Confident	75.4	Confident	64 Å²	64	67.4 Å²	67.4	39%	0.393	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-44.9	-179	-45.3	0	0	0	0	111.5	K722 V723 E729	K722-T725 WeakPolarHBondContact O-CB 3.4Å; K722-T725 PolarHBondContact O-N 2.89Å; K722-T725 VanDerWaalsContact O-N 3.16Å; K722-T725 PolarHBondContact O-OG1 3.27Å; K722-T725 VanDerWaalsContact O-OG1 3.08Å; V723-T725 VanDerWaalsContact C-N 3.29Å; V723-T725 PolarHBondContact O-N 3.4Å; T725-E729 WeakPolarHBondContact O-CG 3.42Å; T725-E729 PolarHBondContact O-N 3.35Å; T725-E729 VanDerWaalsContact O-N 3.08Å
726	S	76	Confident	75.3	Confident	92 Å²	92	67.3 Å²	67.3	64%	0.643	38%	0.377	S	S	*	.	H	α-helix	trans	-67.2	-42.8	178.7	173.8	0	0	0	0	112.6	W724 E729 S730	W724-S726 PolarHBondContact O-N 2.92Å; S726-E729 PolarHBondContact O-N 3.17Å; S726-S730 PolarHBondContact O-N 2.84Å
727	H	72	Confident	75.3	Confident	31 Å²	31	59.9 Å²	59.9	14%	0.144	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-39.9	177.8	-68.8	90.8	0	0	0	112.1	S616 F620 V723 W724 S730 F731	S616-H727 PolarHBondContact N-NE2 2.87Å; F620-H727 HydrophobicContact CD2-CB 3.87Å; F620-H727 HydrophobicContact CE1-CB 4.3Å; F620-H727 HydrophobicContact CE2-CB 3.51Å; F620-H727 HydrophobicContact CG-CB 4.4Å; F620-H727 HydrophobicContact CZ-CB 3.71Å; F620-H727 VanDerWaalsContact CZ-O 3.25Å; F620-H727 WeakPolarHBondContact CZ-O 3.43Å; V723-H727 PolarHBondContact O-ND1 3.13Å; W724-H727 PolarHBondContact O-N 3.41Å; H727-S730 PolarHBondContact O-N 3.4Å; H727-F731 WeakPolarHBondContact O-CB 3.49Å; H727-F731 PolarHBondContact O-N 2.96Å
728	L	76.4	Confident	75.4	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-59.1	-46.4	173.4	173.5	79.3	0	0	0	111.1	F711 L714 N715 A718 W724 F731 K732	F711-L728 HydrophobicContact CD1-CD1 4.34Å; L714-L728 HydrophobicContact CB-CD1 3.4Å; L714-L728 HydrophobicContact CD1-CD1 4.08Å; L714-L728 HydrophobicContact CG-CD1 4.37Å; N715-L728 WeakPolarHBondContact OD1-CD2 3.18Å; A718-L728 HydrophobicContact CB-CD2 4.31Å; W724-L728 WeakPolarHBondContact O-CB 3.19Å; W724-L728 PolarHBondContact O-N 3.41Å; L728-F731 PolarHBondContact O-N 3.38Å; L728-K732 HydrophobicContact CG-CD 4.21Å; L728-K732 HydrophobicContact CG-CG 4.5Å; L728-K732 WeakPolarHBondContact O-CB 3.48Å; L728-K732 VanDerWaalsContact O-CG 3.29Å; L728-K732 WeakPolarHBondContact O-CG 3.08Å; L728-K732 PolarHBondContact O-N 3.5Å
729	E	78.1	Confident	75.8	Confident	81 Å²	81	60.5 Å²	60.5	38%	0.379	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-41.1	178.2	-69.8	-51.1	132.2	0	0	112.1	T725 S726 F731 K732 H733	T725-E729 WeakPolarHBondContact O-CG 3.42Å; T725-E729 PolarHBondContact O-N 3.35Å; T725-E729 VanDerWaalsContact O-N 3.08Å; S726-E729 PolarHBondContact O-N 3.17Å; E729-F731 PolarHBondContact O-N 3.26Å; E729-K732 PolarHBondContact O-N 3.29Å; E729-K732 IonicContact OE1-NZ 3.45Å; E729-K732 PolarHBondContact OE1-NZ 3.5Å; E729-H733 PolarHBondContact O-CD2 2.83Å; E729-H733 PolarHBondContact O-N 2.87Å
730	S	75.5	Confident	76	Confident	53 Å²	53	61.5 Å²	61.5	37%	0.371	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-42.3	174	-171	0	0	0	0	112.3	S726 H727 H733 A734	S726-S730 PolarHBondContact O-N 2.84Å; H727-S730 PolarHBondContact O-N 3.4Å; S730-H733 PolarHBondContact O-N 2.79Å; S730-A734 PolarHBondContact O-N 3.21Å
731	F	78.6	Confident	75.8	Confident	11 Å²	11	62.1 Å²	62.1	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-68	-42	177.1	-177.7	-112	0	0	0	112	F620 Y627 M710 F711 L714 H727 L728 E729 H733 A734 V735	F620-F731 HydrophobicContact CE2-CB 4.24Å; F620-F731 HydrophobicContact CZ-CB 3.83Å; Y627-F731 AromaticContact CD1-CE2 3.93Å; Y627-F731 HydrophobicContact CD1-CE2 3.93Å; Y627-F731 HydrophobicContact CD1-CZ 4.38Å; Y627-F731 HydrophobicContact CD2-CE2 4.37Å; Y627-F731 AromaticContact CD2-CZ 3.99Å; Y627-F731 HydrophobicContact CD2-CZ 3.99Å; Y627-F731 AromaticContact CG-CE2 3.81Å; Y627-F731 HydrophobicContact CG-CE2 3.81Å; Y627-F731 AromaticContact CG-CZ 3.86Å; Y627-F731 HydrophobicContact CG-CZ 3.86Å; M710-F731 HydrophobicContact CB-CE1 4.31Å; M710-F731 HydrophobicContact CE-CE1 4.3Å; M710-F731 HydrophobicContact CE-CZ 3.88Å; M710-F731 HydrophobicContact SD-CE1 4.28Å; M710-F731 HydrophobicContact SD-CZ 3.9Å; F711-F731 HydrophobicContact CD1-CD1 4.13Å; F711-F731 HydrophobicContact CD1-CE1 4.3Å; F711-F731 AromaticContact CE1-CD1 3.59Å; F711-F731 HydrophobicContact CE1-CD1 3.59Å; F711-F731 AromaticContact CE1-CE1 3.82Å; F711-F731 HydrophobicContact CE1-CE1 3.82Å; L714-F731 HydrophobicContact CD1-CD1 3.75Å; L714-F731 HydrophobicContact CD1-CE1 4.08Å; H727-F731 WeakPolarHBondContact O-CB 3.49Å; H727-F731 PolarHBondContact O-N 2.96Å; L728-F731 PolarHBondContact O-N 3.38Å; E729-F731 PolarHBondContact O-N 3.26Å; F731-H733 VanDerWaalsContact C-N 3.3Å; F731-H733 PolarHBondContact O-N 2.97Å; F731-A734 PolarHBondContact O-N 3.33Å; F731-V735 HydrophobicContact CD1-CG2 4.23Å; F731-V735 HydrophobicContact CD2-CG2 4.34Å; F731-V735 HydrophobicContact CE1-CG2 3.85Å; F731-V735 HydrophobicContact CE2-CG2 3.98Å; F731-V735 HydrophobicContact CG-CG2 4.45Å; F731-V735 HydrophobicContact CZ-CG2 3.71Å; F731-V735 VanDerWaalsContact O-CG2 3.29Å; F731-V735 WeakPolarHBondContact O-CG2 3.31Å; F731-V735 PolarHBondContact O-N 3Å
732	K	81.4	Confident	75.8	Confident	49 Å²	49	59 Å²	59	21%	0.213	30%	0.304	C	S	.	.	H	α-helix	trans	-55	-48	172	-78.3	173.2	-178	170.9	0	110.8	F711 L728 E729 V735 I736	F711-K732 HydrophobicContact CD1-CG 3.74Å; F711-K732 HydrophobicContact CE1-CB 4.06Å; F711-K732 HydrophobicContact CE1-CG 3.35Å; F711-K732 HydrophobicContact CZ-CB 4.27Å; F711-K732 HydrophobicContact CZ-CG 3.85Å; L728-K732 HydrophobicContact CG-CD 4.21Å; L728-K732 HydrophobicContact CG-CG 4.5Å; L728-K732 WeakPolarHBondContact O-CB 3.48Å; L728-K732 VanDerWaalsContact O-CG 3.29Å; L728-K732 WeakPolarHBondContact O-CG 3.08Å; L728-K732 PolarHBondContact O-N 3.5Å; E729-K732 PolarHBondContact O-N 3.29Å; E729-K732 IonicContact OE1-NZ 3.45Å; E729-K732 PolarHBondContact OE1-NZ 3.5Å; K732-V735 PolarHBondContact O-N 2.75Å; K732-I736 WeakPolarHBondContact O-CB 3.49Å; K732-I736 WeakPolarHBondContact O-CD1 3.32Å; K732-I736 WeakPolarHBondContact O-CG1 3.4Å; K732-I736 PolarHBondContact O-N 3.42Å
733	H	78.7	Confident	76	Confident	118 Å²	118	54.2 Å²	54.2	55%	0.546	29%	0.285	S	S	.	.	H	α-helix	trans	-60.8	-45.2	176.7	-85.1	-56.8	0	0	0	112.7	E729 S730 F731 V735 I736 V737	E729-H733 PolarHBondContact O-CD2 2.83Å; E729-H733 PolarHBondContact O-N 2.87Å; S730-H733 PolarHBondContact O-N 2.79Å; F731-H733 VanDerWaalsContact C-N 3.3Å; F731-H733 PolarHBondContact O-N 2.97Å; H733-V735 PolarHBondContact O-N 3.45Å; H733-I736 PolarHBondContact O-N 2.95Å; H733-V737 WeakPolarHBondContact O-CG2 3.33Å; H733-V737 PolarHBondContact O-N 2.88Å
734	A	74.9	Confident	76	Confident	23 Å²	23	53.5 Å²	53.5	19%	0.19	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-46.5	177.9	0	0	0	0	0	112.1	L611 S730 F731 I736 V737 D738	L611-A734 HydrophobicContact CD1-CB 4.44Å; S730-A734 PolarHBondContact O-N 3.21Å; F731-A734 PolarHBondContact O-N 3.33Å; A734-I736 VanDerWaalsContact C-N 3.31Å; A734-I736 PolarHBondContact O-N 2.64Å; A734-V737 PolarHBondContact O-N 2.82Å; A734-D738 PolarHBondContact O-N 3.21Å
735	V	79.5	Confident	76	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-39.8	176	172.5	0	0	0	0	111.5	Y627 F711 F731 K732 H733 D738 K739	Y627-V735 HydrophobicContact CD2-CG2 4.44Å; Y627-V735 HydrophobicContact CE1-CG2 4.17Å; Y627-V735 HydrophobicContact CE2-CG2 3.84Å; F711-V735 HydrophobicContact CE1-CG2 4.38Å; F711-V735 HydrophobicContact CE2-CG1 4.23Å; F711-V735 HydrophobicContact CZ-CB 3.85Å; F711-V735 HydrophobicContact CZ-CG1 3.87Å; F711-V735 HydrophobicContact CZ-CG2 3.95Å; F731-V735 HydrophobicContact CD1-CG2 4.23Å; F731-V735 HydrophobicContact CD2-CG2 4.34Å; F731-V735 HydrophobicContact CE1-CG2 3.85Å; F731-V735 HydrophobicContact CE2-CG2 3.98Å; F731-V735 HydrophobicContact CG-CG2 4.45Å; F731-V735 HydrophobicContact CZ-CG2 3.71Å; F731-V735 VanDerWaalsContact O-CG2 3.29Å; F731-V735 WeakPolarHBondContact O-CG2 3.31Å; F731-V735 PolarHBondContact O-N 3Å; K732-V735 PolarHBondContact O-N 2.75Å; H733-V735 PolarHBondContact O-N 3.45Å; V735-D738 PolarHBondContact O-N 2.89Å; V735-K739 HydrophobicContact CG1-CD 4.14Å; V735-K739 HydrophobicContact CG1-CG 4.41Å; V735-K739 WeakPolarHBondContact O-CB 3.42Å; V735-K739 VanDerWaalsContact O-CG 3.26Å; V735-K739 WeakPolarHBondContact O-CG 3.41Å; V735-K739 PolarHBondContact O-N 3.33Å
736	I	79.9	Confident	76	Confident	78 Å²	78	50.7 Å²	50.7	40%	0.4	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-47.4	175.7	-71.4	163.3	0	0	0	110.2	K732 H733 A734 D738 K739 Q740	K732-I736 WeakPolarHBondContact O-CB 3.49Å; K732-I736 WeakPolarHBondContact O-CD1 3.32Å; K732-I736 WeakPolarHBondContact O-CG1 3.4Å; K732-I736 PolarHBondContact O-N 3.42Å; H733-I736 PolarHBondContact O-N 2.95Å; A734-I736 VanDerWaalsContact C-N 3.31Å; A734-I736 PolarHBondContact O-N 2.64Å; I736-D738 PolarHBondContact O-N 2.92Å; I736-K739 PolarHBondContact O-N 3.02Å; I736-Q740 HydrophobicContact CG2-CG 4.4Å; I736-Q740 WeakPolarHBondContact O-CB 3.46Å; I736-Q740 VanDerWaalsContact O-CG 3.25Å; I736-Q740 WeakPolarHBondContact O-CG 3.5Å; I736-Q740 PolarHBondContact O-N 3.02Å
737	V	76.4	Confident	75.9	Confident	58 Å²	58	49.8 Å²	49.8	35%	0.352	25%	0.253	S	S	.	.	H	α-helix	trans	-61.9	-43.1	178.7	170.1	0	0	0	0	111.2	H733 A734 Q740 K741	H733-V737 WeakPolarHBondContact O-CG2 3.33Å; H733-V737 PolarHBondContact O-N 2.88Å; A734-V737 PolarHBondContact O-N 2.82Å; V737-Q740 PolarHBondContact O-N 2.99Å; V737-K741 HydrophobicContact CG1-CD 4.49Å; V737-K741 WeakPolarHBondContact O-CG 3.29Å; V737-K741 PolarHBondContact O-N 3.29Å
738	D	75.6	Confident	75.7	Confident	25 Å²	25	49.1 Å²	49.1	13%	0.134	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-42.5	178.6	-72.8	-22.3	0	0	0	111.4	L631 A734 V735 I736 Q740 K741 I742	L631-D738 HydrophobicContact CD1-CB 4.31Å; L631-D738 WeakPolarHBondContact CD2-OD2 3.4Å; A734-D738 PolarHBondContact O-N 3.21Å; V735-D738 PolarHBondContact O-N 2.89Å; I736-D738 PolarHBondContact O-N 2.92Å; D738-Q740 VanDerWaalsContact C-N 3.35Å; D738-Q740 PolarHBondContact O-N 3.09Å; D738-K741 WeakPolarHBondContact O-CB 3.38Å; D738-K741 PolarHBondContact O-N 3.01Å; D738-K741 IonicContact OD1-NZ 3.41Å; D738-I742 WeakPolarHBondContact O-CG1 3.35Å; D738-I742 PolarHBondContact O-N 3.44Å; D738-I742 VanDerWaalsContact O-N 3.09Å
739	K	80.2	Confident	75.4	Confident	35 Å²	35	49 Å²	49	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-43.7	172.2	-75.1	-179.8	-176.3	-175.3	0	112.2	L700 L703 T704 S707 V735 I736 K741 I742 E743	L700-K739 HydrophobicContact CD1-CB 4.2Å; L700-K739 HydrophobicContact CD1-CG 3.94Å; L703-K739 HydrophobicContact CD2-CG 4.19Å; T704-K739 WeakPolarHBondContact OG1-CE 3.44Å; T704-K739 PolarHBondContact OG1-NZ 2.86Å; S707-K739 WeakPolarHBondContact OG-CE 3.27Å; S707-K739 PolarHBondContact OG-NZ 3.33Å; V735-K739 HydrophobicContact CG1-CD 4.14Å; V735-K739 HydrophobicContact CG1-CG 4.41Å; V735-K739 WeakPolarHBondContact O-CB 3.42Å; V735-K739 VanDerWaalsContact O-CG 3.26Å; V735-K739 WeakPolarHBondContact O-CG 3.41Å; V735-K739 PolarHBondContact O-N 3.33Å; I736-K739 PolarHBondContact O-N 3.02Å; K739-K741 VanDerWaalsContact C-N 3.31Å; K739-K741 PolarHBondContact O-N 2.8Å; K739-I742 WeakPolarHBondContact O-CB 3.48Å; K739-I742 PolarHBondContact O-N 3.26Å; K739-I742 VanDerWaalsContact O-N 3.14Å; K739-E743 WeakPolarHBondContact O-CG 3.35Å; K739-E743 PolarHBondContact O-N 3.46Å
740	Q	78.3	Confident	75.2	Confident	95 Å²	95	49.7 Å²	49.7	44%	0.444	25%	0.25	S	S	.	.	H	α-helix	trans	-60.9	-39.1	176.2	-76.8	173.1	-12.5	0	0	111.9	I736 V737 D738 I742 E743 N744	I736-Q740 HydrophobicContact CG2-CG 4.4Å; I736-Q740 WeakPolarHBondContact O-CB 3.46Å; I736-Q740 VanDerWaalsContact O-CG 3.25Å; I736-Q740 WeakPolarHBondContact O-CG 3.5Å; I736-Q740 PolarHBondContact O-N 3.02Å; V737-Q740 PolarHBondContact O-N 2.99Å; D738-Q740 VanDerWaalsContact C-N 3.35Å; D738-Q740 PolarHBondContact O-N 3.09Å; Q740-I742 VanDerWaalsContact C-N 3.34Å; Q740-I742 PolarHBondContact O-N 3.3Å; Q740-E743 PolarHBondContact O-N 3.48Å; Q740-N744 VanDerWaalsContact O-CB 3.31Å; Q740-N744 WeakPolarHBondContact O-CB 3.31Å; Q740-N744 PolarHBondContact O-N 3.01Å; Q740-N744 PolarHBondContact O-ND2 2.83Å; Q740-N744 PolarHBondContact O-OD1 3.11Å
741	K	71.5	Confident	74.8	Confident	103 Å²	103	49.6 Å²	49.6	45%	0.448	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-40.1	174.1	-72.4	171.8	-176.6	169.7	0	112.2	V737 D738 K739 N744 T745	V737-K741 HydrophobicContact CG1-CD 4.49Å; V737-K741 WeakPolarHBondContact O-CG 3.29Å; V737-K741 PolarHBondContact O-N 3.29Å; D738-K741 WeakPolarHBondContact O-CB 3.38Å; D738-K741 PolarHBondContact O-N 3.01Å; D738-K741 IonicContact OD1-NZ 3.41Å; K739-K741 VanDerWaalsContact C-N 3.31Å; K739-K741 PolarHBondContact O-N 2.8Å; K741-N744 PolarHBondContact O-N 3.39Å; K741-T745 PolarHBondContact O-N 3.06Å; K741-T745 PolarHBondContact O-OG1 3.34Å
742	I	71.1	Confident	74.3	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-47.9	176.1	-61.2	175.4	0	0	0	110.3	W634 L700 L703 D738 K739 Q740 N744 T745 M746	W634-I742 HydrophobicContact CD2-CD1 4.27Å; W634-I742 HydrophobicContact CE3-CD1 4.36Å; W634-I742 HydrophobicContact CH2-CB 4.44Å; W634-I742 HydrophobicContact CH2-CD1 3.95Å; W634-I742 HydrophobicContact CH2-CG1 3.47Å; W634-I742 VanDerWaalsContact CH2-CG1 3.47Å; W634-I742 HydrophobicContact CH2-CG2 4.49Å; W634-I742 HydrophobicContact CZ2-CB 4.29Å; W634-I742 HydrophobicContact CZ2-CD1 3.75Å; W634-I742 HydrophobicContact CZ2-CG1 3.56Å; W634-I742 HydrophobicContact CZ2-CG2 3.88Å; W634-I742 HydrophobicContact CZ3-CD1 4.22Å; W634-I742 HydrophobicContact CZ3-CG1 4.04Å; L700-I742 HydrophobicContact CB-CG2 4.23Å; L700-I742 HydrophobicContact CD1-CB 4.22Å; L700-I742 HydrophobicContact CD1-CD1 4.3Å; L700-I742 HydrophobicContact CD1-CG2 4.08Å; L703-I742 HydrophobicContact CD2-CD1 3.6Å; D738-I742 WeakPolarHBondContact O-CG1 3.35Å; D738-I742 PolarHBondContact O-N 3.44Å; D738-I742 VanDerWaalsContact O-N 3.09Å; K739-I742 WeakPolarHBondContact O-CB 3.48Å; K739-I742 PolarHBondContact O-N 3.26Å; K739-I742 VanDerWaalsContact O-N 3.14Å; Q740-I742 VanDerWaalsContact C-N 3.34Å; Q740-I742 PolarHBondContact O-N 3.3Å; I742-N744 VanDerWaalsContact C-N 3.32Å; I742-N744 PolarHBondContact O-N 3.38Å; I742-T745 PolarHBondContact O-N 3.4Å; I742-M746 WeakPolarHBondContact O-CB 3.23Å; I742-M746 PolarHBondContact O-N 2.85Å
743	E	77.3	Confident	73.8	Confident	89 Å²	89	48 Å²	48	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-59	-42.4	176.5	-75.3	173.5	175.4	0	0	111.5	L700 K739 Q740 M746 N747	L700-E743 HydrophobicContact CD2-CG 3.7Å; K739-E743 WeakPolarHBondContact O-CG 3.35Å; K739-E743 PolarHBondContact O-N 3.46Å; Q740-E743 PolarHBondContact O-N 3.48Å; E743-M746 WeakPolarHBondContact O-CB 3.33Å; E743-M746 PolarHBondContact O-N 3.45Å; E743-N747 WeakPolarHBondContact O-CB 3.27Å; E743-N747 PolarHBondContact O-N 3.14Å; E743-N747 PolarHBondContact O-ND2 3.32Å
744	N	71.5	Confident	73.4	Confident	70 Å²	70	46.9 Å²	46.9	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-63.5	-43.5	175.8	-71.3	-17.7	0	0	0	112.1	Q740 K741 I742 M746 N747 T748	Q740-N744 VanDerWaalsContact O-CB 3.31Å; Q740-N744 WeakPolarHBondContact O-CB 3.31Å; Q740-N744 PolarHBondContact O-N 3.01Å; Q740-N744 PolarHBondContact O-ND2 2.83Å; Q740-N744 PolarHBondContact O-OD1 3.11Å; K741-N744 PolarHBondContact O-N 3.39Å; I742-N744 VanDerWaalsContact C-N 3.32Å; I742-N744 PolarHBondContact O-N 3.38Å; N744-M746 VanDerWaalsContact C-N 3.31Å; N744-M746 PolarHBondContact O-N 2.94Å; N744-N747 PolarHBondContact O-N 2.93Å; N744-T748 PolarHBondContact O-N 3.38Å; N744-T748 PolarHBondContact O-OG1 3.03Å
745	T	69.1	Low	72.9	Confident	42 Å²	42	46 Å²	46	26%	0.258	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-43.9	175.6	-54.3	0	0	0	0	110.3	I642 K741 I742 T748 C749	I642-T745 HydrophobicContact CD1-CG2 3.86Å; K741-T745 PolarHBondContact O-N 3.06Å; K741-T745 PolarHBondContact O-OG1 3.34Å; I742-T745 PolarHBondContact O-N 3.4Å; T745-T748 PolarHBondContact O-N 2.8Å; T745-C749 PolarHBondContact O-N 3.3Å; T745-C749 PolarHBondContact O-SG 3.42Å
746	M	73.6	Confident	72.5	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-42.1	177.3	-167.3	-175	-175.8	0	0	112.2	V693 L696 Q697 I742 E743 N744 T748 C749 R750	V693-M746 HydrophobicContact CG1-CE 3.39Å; V693-M746 HydrophobicContact CG1-CG 4.16Å; V693-M746 WeakPolarHBondContact O-CE 3.24Å; L696-M746 HydrophobicContact CB-CG 4.44Å; L696-M746 HydrophobicContact CD1-CB 4.5Å; Q697-M746 HydrophobicContact CB-CE 3.54Å; Q697-M746 HydrophobicContact CB-SD 4.5Å; Q697-M746 HydrophobicContact CG-CE 4.19Å; Q697-M746 PolarHBondContact OE1-SD 3.08Å; Q697-M746 VanDerWaalsContact OE1-SD 3.37Å; I742-M746 WeakPolarHBondContact O-CB 3.23Å; I742-M746 PolarHBondContact O-N 2.85Å; E743-M746 WeakPolarHBondContact O-CB 3.33Å; E743-M746 PolarHBondContact O-N 3.45Å; N744-M746 VanDerWaalsContact C-N 3.31Å; N744-M746 PolarHBondContact O-N 2.94Å; M746-T748 VanDerWaalsContact C-N 3.33Å; M746-C749 PolarHBondContact O-N 2.92Å; M746-R750 VanDerWaalsContact CE-CZ 3.47Å; M746-R750 WeakPolarHBondContact O-CG 3.26Å; M746-R750 PolarHBondContact O-N 3.31Å; M746-R750 VanDerWaalsContact SD-CZ 3.57Å; M746-R750 PolarHBondContact SD-NH1 2.76Å; M746-R750 PolarHBondContact SD-NH2 2.99Å
747	N	73.9	Confident	72	Confident	73 Å²	73	45.7 Å²	45.7	39%	0.39	23%	0.226	S	C	.	.	H	α-helix	trans	-63.3	-39.8	174.8	-71.2	-19.9	0	0	0	111.6	E743 N744 R750 Q751	E743-N747 WeakPolarHBondContact O-CB 3.27Å; E743-N747 PolarHBondContact O-N 3.14Å; E743-N747 PolarHBondContact O-ND2 3.32Å; N744-N747 PolarHBondContact O-N 2.93Å; N747-R750 WeakPolarHBondContact O-CB 3.2Å; N747-R750 PolarHBondContact O-N 3.42Å; N747-R750 PolarHBondContact OD1-NH1 2.87Å; N747-Q751 WeakPolarHBondContact O-CG 3.5Å; N747-Q751 PolarHBondContact O-N 2.92Å
748	T	67.6	Low	71.5	Confident	18 Å²	18	43.2 Å²	43.2	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-41	176.1	-45.6	0	0	0	0	111.3	V596 V600 N744 T745 M746 Q751 L752	V596-T748 HydrophobicContact CG1-CG2 4.28Å; V600-T748 HydrophobicContact CG2-CG2 3.27Å; N744-T748 PolarHBondContact O-N 3.38Å; N744-T748 PolarHBondContact O-OG1 3.03Å; T745-T748 PolarHBondContact O-N 2.8Å; M746-T748 VanDerWaalsContact C-N 3.33Å; T748-Q751 PolarHBondContact O-N 3.34Å; T748-L752 PolarHBondContact O-N 2.83Å
749	C	70.5	Confident	71.1	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-62	-41.6	172.6	-66.8	0	0	0	0	112.2	F646 V693 T745 M746 L752 N753	F646-C749 HydrophobicContact CZ-CB 4.43Å; V693-C749 HydrophobicContact CG2-CB 3.85Å; T745-C749 PolarHBondContact O-N 3.3Å; T745-C749 PolarHBondContact O-SG 3.42Å; M746-C749 PolarHBondContact O-N 2.92Å; C749-L752 PolarHBondContact O-N 3.24Å; C749-N753 PolarHBondContact O-N 2.92Å
750	R	73.4	Confident	70.6	Confident	96 Å²	96	41.3 Å²	41.3	36%	0.362	20%	0.203	S	C	.	.	H	α-helix	trans	-61.5	-44.7	175.2	-72.3	174.3	-179.5	122.3	-7.6	111.4	V693 M746 N747 L752 N753 L754	V693-R750 HydrophobicContact CG1-CG 4.03Å; V693-R750 HydrophobicContact CG2-CG 4.31Å; M746-R750 VanDerWaalsContact CE-CZ 3.47Å; M746-R750 WeakPolarHBondContact O-CG 3.26Å; M746-R750 PolarHBondContact O-N 3.31Å; M746-R750 VanDerWaalsContact SD-CZ 3.57Å; M746-R750 PolarHBondContact SD-NH1 2.76Å; M746-R750 PolarHBondContact SD-NH2 2.99Å; N747-R750 WeakPolarHBondContact O-CB 3.2Å; N747-R750 PolarHBondContact O-N 3.42Å; N747-R750 PolarHBondContact OD1-NH1 2.87Å; R750-L752 PolarHBondContact O-N 3.15Å; R750-N753 WeakPolarHBondContact O-CB 3.38Å; R750-N753 PolarHBondContact O-N 2.81Å; R750-L754 WeakPolarHBondContact O-CG 3.29Å; R750-L754 PolarHBondContact O-N 3.21Å
751	Q	67.6	Low	70	Confident	50 Å²	50	38.5 Å²	38.5	23%	0.234	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-43.7	175.9	-75.3	177.9	-19.9	0	0	111.4	L504 E507 N747 T748 N753 L754 Y755	L504-Q751 HydrophobicContact CD2-CB 4.28Å; L504-Q751 HydrophobicContact CD2-CG 4.1Å; E507-Q751 PolarHBondContact OE2-NE2 3.01Å; N747-Q751 WeakPolarHBondContact O-CG 3.5Å; N747-Q751 PolarHBondContact O-N 2.92Å; T748-Q751 PolarHBondContact O-N 3.34Å; Q751-N753 VanDerWaalsContact C-N 3.32Å; Q751-N753 PolarHBondContact O-N 3.13Å; Q751-L754 WeakPolarHBondContact O-CB 3.44Å; Q751-L754 PolarHBondContact O-N 2.83Å; Q751-L754 VanDerWaalsContact O-N 3.11Å; Q751-Y755 HydrophobicContact CB-CE2 4.25Å; Q751-Y755 WeakPolarHBondContact O-CD2 3.45Å; Q751-Y755 PolarHBondContact O-N 3.4Å
752	L	68.3	Low	69.5	Low	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-42.3	174.6	-176.8	67.3	0	0	0	112.3	V596 L597 F646 L689 T748 C749 R750 L754 Y755 L756	V596-L752 HydrophobicContact CB-CD1 4.5Å; V596-L752 HydrophobicContact CG1-CB 4.12Å; V596-L752 HydrophobicContact CG1-CD1 4.09Å; L597-L752 HydrophobicContact CD2-CD1 4Å; L597-L752 HydrophobicContact CD2-CD2 3.44Å; L597-L752 VanDerWaalsContact CD2-CD2 3.44Å; L597-L752 HydrophobicContact CD2-CG 4.4Å; L597-L752 HydrophobicContact CG-CD1 3.91Å; L597-L752 HydrophobicContact CG-CD2 4.26Å; F646-L752 HydrophobicContact CD1-CD2 3.75Å; F646-L752 HydrophobicContact CE1-CD2 3.12Å; F646-L752 HydrophobicContact CE1-CG 4.39Å; F646-L752 HydrophobicContact CZ-CD2 3.7Å; L689-L752 HydrophobicContact CD1-CD2 3.54Å; L689-L752 HydrophobicContact CD1-CG 3.94Å; L689-L752 HydrophobicContact CD2-CD2 3.99Å; L689-L752 HydrophobicContact CG-CD2 4.44Å; T748-L752 PolarHBondContact O-N 2.83Å; C749-L752 PolarHBondContact O-N 3.24Å; R750-L752 PolarHBondContact O-N 3.15Å; L752-L754 VanDerWaalsContact C-N 3.28Å; L752-L754 PolarHBondContact O-N 3.43Å; L752-Y755 PolarHBondContact O-N 2.95Å; L752-L756 WeakPolarHBondContact O-CB 3.2Å; L752-L756 PolarHBondContact O-N 3.29Å
753	N	71.6	Confident	69.1	Low	24 Å²	24	33.6 Å²	33.6	13%	0.128	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-41.4	174.3	-87	-9.2	0	0	0	111.9	L689 C749 R750 Q751 L756 N757	L689-N753 WeakPolarHBondContact CB-OD1 3.31Å; L689-N753 WeakPolarHBondContact CD1-OD1 3.25Å; C749-N753 PolarHBondContact O-N 2.92Å; R750-N753 WeakPolarHBondContact O-CB 3.38Å; R750-N753 PolarHBondContact O-N 2.81Å; Q751-N753 VanDerWaalsContact C-N 3.32Å; Q751-N753 PolarHBondContact O-N 3.13Å; N753-L756 PolarHBondContact O-N 3.45Å; N753-N757 VanDerWaalsContact O-CB 3.3Å; N753-N757 WeakPolarHBondContact O-CB 3.24Å; N753-N757 PolarHBondContact O-N 3.22Å; N753-N757 PolarHBondContact O-ND2 3.32Å
754	L	69.4	Low	68.6	Low	93 Å²	93	32.1 Å²	32.1	49%	0.487	17%	0.17	S	C	.	.	H	α-helix	trans	-61.9	-47.6	175.4	-66.2	171.4	0	0	0	111.3	L504 R750 Q751 L752 L756 N757 A758	L504-L754 HydrophobicContact CD1-CB 4.3Å; L504-L754 HydrophobicContact CD2-CD1 4.49Å; R750-L754 WeakPolarHBondContact O-CG 3.29Å; R750-L754 PolarHBondContact O-N 3.21Å; Q751-L754 WeakPolarHBondContact O-CB 3.44Å; Q751-L754 PolarHBondContact O-N 2.83Å; Q751-L754 VanDerWaalsContact O-N 3.11Å; L752-L754 VanDerWaalsContact C-N 3.28Å; L752-L754 PolarHBondContact O-N 3.43Å; L754-L756 PolarHBondContact O-N 2.65Å; L754-N757 PolarHBondContact O-N 2.92Å; L754-A758 WeakPolarHBondContact O-CB 3.31Å; L754-A758 PolarHBondContact O-N 3.47Å
755	Y	65.7	Low	67.8	Low	6 Å²	6	29.7 Å²	29.7	2%	0.024	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-44.8	176.6	-69.9	-65.3	0	0	0	112.6	L501 L504 L592 V596 Q751 L752 A758 V759	L501-Y755 HydrophobicContact CD2-CD1 4.46Å; L501-Y755 HydrophobicContact CD2-CE1 4.37Å; L504-Y755 HydrophobicContact CB-CE1 3.84Å; L504-Y755 WeakPolarHBondContact CB-OH 2.74Å; L504-Y755 HydrophobicContact CD1-CD1 3.77Å; L504-Y755 HydrophobicContact CD1-CE1 3.53Å; L504-Y755 HydrophobicContact CD1-CE2 4.44Å; L504-Y755 HydrophobicContact CD1-CG 4.35Å; L504-Y755 HydrophobicContact CD2-CE1 4.22Å; L504-Y755 HydrophobicContact CD2-CE2 3.87Å; L504-Y755 HydrophobicContact CG-CE1 4.06Å; L592-Y755 HydrophobicContact CB-CD1 4.23Å; L592-Y755 HydrophobicContact CB-CE1 3.89Å; L592-Y755 HydrophobicContact CD1-CE1 3.89Å; L592-Y755 HydrophobicContact CG-CE1 4.43Å; V596-Y755 HydrophobicContact CG2-CD2 4.08Å; V596-Y755 HydrophobicContact CG2-CE2 3.64Å; Q751-Y755 HydrophobicContact CB-CE2 4.25Å; Q751-Y755 WeakPolarHBondContact O-CD2 3.45Å; Q751-Y755 PolarHBondContact O-N 3.4Å; L752-Y755 PolarHBondContact O-N 2.95Å; Y755-A758 PolarHBondContact O-N 2.95Å; Y755-V759 WeakPolarHBondContact O-CG2 3.11Å; Y755-V759 PolarHBondContact O-N 2.89Å
756	L	69.5	Low	66.9	Low	6 Å²	6	31.5 Å²	31.5	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-42.5	-179	-177.8	61	0	0	0	111.4	L682 L685 D686 L689 L752 N753 L754 A758 V759 I760	L682-L756 HydrophobicContact CB-CD1 4.13Å; L682-L756 HydrophobicContact CD2-CD1 3.54Å; L682-L756 HydrophobicContact CG-CD1 4.38Å; L685-L756 HydrophobicContact CB-CD2 4.04Å; L685-L756 HydrophobicContact CD2-CD1 4.19Å; L685-L756 HydrophobicContact CD2-CD2 3.91Å; L685-L756 HydrophobicContact CG-CD2 3.77Å; D686-L756 HydrophobicContact CB-CD2 3.71Å; D686-L756 HydrophobicContact CB-CG 4.32Å; L689-L756 HydrophobicContact CD1-CD2 3.81Å; L752-L756 WeakPolarHBondContact O-CB 3.2Å; L752-L756 PolarHBondContact O-N 3.29Å; N753-L756 PolarHBondContact O-N 3.45Å; L754-L756 PolarHBondContact O-N 2.65Å; L756-A758 VanDerWaalsContact C-N 3.34Å; L756-A758 PolarHBondContact O-N 2.98Å; L756-V759 PolarHBondContact O-N 3.38Å; L756-I760 HydrophobicContact CD1-CD1 4.32Å; L756-I760 HydrophobicContact CG-CD1 4.02Å; L756-I760 VanDerWaalsContact O-CG1 3.3Å; L756-I760 WeakPolarHBondContact O-CG1 3.37Å; L756-I760 PolarHBondContact O-N 3.49Å
757	N	71.2	Confident	65.8	Low	64 Å²	64	35 Å²	35	34%	0.342	18%	0.182	S	C	.	.	H	α-helix	trans	-65.5	-37.1	176	-81	-61.8	0	0	0	112.2	D686 N753 L754 I760 S761	D686-N757 PolarHBondContact OD1-ND2 2.83Å; D686-N757 PolarHBondContact OD1-OD1 2.96Å; N753-N757 VanDerWaalsContact O-CB 3.3Å; N753-N757 WeakPolarHBondContact O-CB 3.24Å; N753-N757 PolarHBondContact O-N 3.22Å; N753-N757 PolarHBondContact O-ND2 3.32Å; L754-N757 PolarHBondContact O-N 2.92Å; N757-I760 PolarHBondContact O-N 3.37Å; N757-S761 VanDerWaalsContact O-CB 3.31Å; N757-S761 WeakPolarHBondContact O-CB 3.38Å; N757-S761 PolarHBondContact O-N 3.35Å; N757-S761 PolarHBondContact O-OG 2.8Å
758	A	64.3	Low	64.1	Low	7 Å²	7	36.6 Å²	36.6	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-43.6	172.1	0	0	0	0	0	112.1	V497 L589 L754 Y755 L756 S761 M762	V497-A758 HydrophobicContact CG1-CB 4.08Å; V497-A758 HydrophobicContact CG2-CB 4.3Å; L589-A758 HydrophobicContact CD2-CB 3.66Å; L754-A758 WeakPolarHBondContact O-CB 3.31Å; L754-A758 PolarHBondContact O-N 3.47Å; Y755-A758 PolarHBondContact O-N 2.95Å; L756-A758 VanDerWaalsContact C-N 3.34Å; L756-A758 PolarHBondContact O-N 2.98Å; A758-S761 PolarHBondContact O-N 3.46Å; A758-M762 WeakPolarHBondContact O-CB 3.33Å; A758-M762 VanDerWaalsContact O-CG 3.3Å; A758-M762 WeakPolarHBondContact O-CG 3.41Å; A758-M762 PolarHBondContact O-N 3.35Å
759	V	67.1	Low	62.6	Low	4 Å²	4	38 Å²	38	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-48.7	173.9	173.4	0	0	0	0	111.1	L589 Y590 L682 Y755 L756 S761 M762 E763	L589-V759 HydrophobicContact CB-CG2 3.72Å; L589-V759 HydrophobicContact CD1-CG2 4.44Å; L589-V759 HydrophobicContact CD2-CG2 4.31Å; L589-V759 HydrophobicContact CG-CG2 4.4Å; Y590-V759 HydrophobicContact CD1-CG1 4.48Å; Y590-V759 HydrophobicContact CE1-CG1 3.62Å; Y590-V759 WeakPolarHBondContact OH-CG1 3.39Å; L682-V759 HydrophobicContact CD1-CG1 3.84Å; Y755-V759 WeakPolarHBondContact O-CG2 3.11Å; Y755-V759 PolarHBondContact O-N 2.89Å; L756-V759 PolarHBondContact O-N 3.38Å; V759-S761 VanDerWaalsContact C-N 3.34Å; V759-S761 PolarHBondContact O-N 2.91Å; V759-M762 PolarHBondContact O-N 3.26Å; V759-E763 HydrophobicContact CG1-CG 4.4Å; V759-E763 WeakPolarHBondContact O-CB 3.49Å; V759-E763 WeakPolarHBondContact O-CG 3.39Å; V759-E763 PolarHBondContact O-N 2.85Å
760	I	69.4	Low	61	Low	15 Å²	15	41.6 Å²	41.6	8%	0.077	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-46.2	179.9	-69.1	167.2	0	0	0	110.2	L679 L682 R683 D686 L756 N757 M762 E763 T764	L679-I760 HydrophobicContact CD2-CG2 4.47Å; L682-I760 HydrophobicContact CB-CD1 4.14Å; L682-I760 HydrophobicContact CB-CG1 3.84Å; L682-I760 HydrophobicContact CD1-CG1 4.49Å; R683-I760 HydrophobicContact CG-CD1 4.37Å; D686-I760 HydrophobicContact CB-CD1 3.94Å; L756-I760 HydrophobicContact CD1-CD1 4.32Å; L756-I760 HydrophobicContact CG-CD1 4.02Å; L756-I760 VanDerWaalsContact O-CG1 3.3Å; L756-I760 WeakPolarHBondContact O-CG1 3.37Å; L756-I760 PolarHBondContact O-N 3.49Å; N757-I760 PolarHBondContact O-N 3.37Å; I760-M762 PolarHBondContact O-N 3.28Å; I760-E763 PolarHBondContact O-N 3.22Å; I760-T764 HydrophobicContact CG2-CG2 4.36Å; I760-T764 WeakPolarHBondContact O-CG2 3.41Å; I760-T764 PolarHBondContact O-N 3.25Å; I760-T764 PolarHBondContact O-OG1 2.94Å
761	S	65.8	Low	59.1	Low	36 Å²	36	39.6 Å²	39.6	25%	0.252	23%	0.23	S	C	.	.	H	α-helix	trans	-59.5	-45.9	178.7	-58.6	0	0	0	0	111.4	N757 A758 V759 E763 T764 L765	N757-S761 VanDerWaalsContact O-CB 3.31Å; N757-S761 WeakPolarHBondContact O-CB 3.38Å; N757-S761 PolarHBondContact O-N 3.35Å; N757-S761 PolarHBondContact O-OG 2.8Å; A758-S761 PolarHBondContact O-N 3.46Å; V759-S761 VanDerWaalsContact C-N 3.34Å; V759-S761 PolarHBondContact O-N 2.91Å; S761-E763 VanDerWaalsContact C-N 3.33Å; S761-E763 PolarHBondContact O-N 2.93Å; S761-T764 WeakPolarHBondContact CA-OG1 3.32Å; S761-T764 PolarHBondContact O-N 3.25Å; S761-T764 PolarHBondContact O-OG1 2.81Å; S761-L765 PolarHBondContact O-N 2.81Å
762	M	61.1	Low	57.4	Low	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-34.6	176.1	-77.9	-67.6	-69.4	0	0	113.8	L494 V497 F582 L585 L589 A758 V759 I760 L765	L494-M762 HydrophobicContact CD1-CE 4.21Å; L494-M762 HydrophobicContact CD1-SD 3.59Å; L494-M762 VanDerWaalsContact CD1-SD 3.59Å; V497-M762 HydrophobicContact CG1-CG 4.02Å; V497-M762 HydrophobicContact CG1-SD 4.36Å; F582-M762 HydrophobicContact CB-CE 4.09Å; F582-M762 HydrophobicContact CD1-CE 3.31Å; F582-M762 HydrophobicContact CD1-SD 4.2Å; F582-M762 HydrophobicContact CE1-CE 3.93Å; F582-M762 HydrophobicContact CE1-SD 4.24Å; F582-M762 HydrophobicContact CG-CE 3.89Å; L585-M762 HydrophobicContact CB-CE 3.76Å; L585-M762 HydrophobicContact CD1-CE 4.02Å; L589-M762 HydrophobicContact CD1-CB 4.44Å; L589-M762 HydrophobicContact CD1-CG 3.81Å; A758-M762 WeakPolarHBondContact O-CB 3.33Å; A758-M762 VanDerWaalsContact O-CG 3.3Å; A758-M762 WeakPolarHBondContact O-CG 3.41Å; A758-M762 PolarHBondContact O-N 3.35Å; V759-M762 PolarHBondContact O-N 3.26Å; I760-M762 PolarHBondContact O-N 3.28Å; M762-L765 HydrophobicContact SD-CD1 4.07Å
763	E	63.9	Low	55.7	Low	2 Å²	2	46.6 Å²	46.6	1%	0.009	27%	0.273	C	S	.	.	H	α-helix	trans	-75.4	-28.9	176	-75.5	-52.5	140.1	0	0	111.7	R586 Y590 H675 L679 V759 I760 S761 R767	R586-E763 WeakPolarHBondContact CD-OE1 3.16Å; R586-E763 IonicContact CZ-OE1 2.76Å; R586-E763 IonicContact CZ-OE2 2.89Å; R586-E763 IonicContact NE-OE1 3Å; R586-E763 PolarHBondContact NE-OE1 2.87Å; R586-E763 IonicContact NH1-OE1 3.69Å; R586-E763 IonicContact NH2-OE1 3.45Å; R586-E763 IonicContact NH2-OE2 2.83Å; Y590-E763 PolarHBondContact OH-OE1 2.73Å; H675-E763 PolarHBondContact CE1-O 2.83Å; H675-E763 IonicContact CE1-OE2 3.79Å; H675-E763 PolarHBondContact CE1-OE2 3.45Å; H675-E763 IonicContact ND1-OE2 2.67Å; H675-E763 PolarHBondContact ND1-OE2 3.41Å; H675-E763 PolarHBondContact NE2-O 3.38Å; L679-E763 HydrophobicContact CD2-CB 3.6Å; L679-E763 HydrophobicContact CG-CB 4.33Å; V759-E763 HydrophobicContact CG1-CG 4.4Å; V759-E763 WeakPolarHBondContact O-CB 3.49Å; V759-E763 WeakPolarHBondContact O-CG 3.39Å; V759-E763 PolarHBondContact O-N 2.85Å; I760-E763 PolarHBondContact O-N 3.22Å; S761-E763 VanDerWaalsContact C-N 3.33Å; S761-E763 PolarHBondContact O-N 2.93Å; E763-R767 IonicContact OE2-NH2 3.34Å; E763-R767 PolarHBondContact OE2-NH2 2.81Å
764	T	65.6	Low	54	Low	59 Å²	59	50.2 Å²	50.2	36%	0.362	30%	0.3	S	S	.	.	H	α-helix	trans	-81.3	-7.3	179.2	54.4	0	0	0	0	116.1	L679 I760 S761	L679-T764 HydrophobicContact CD1-CG2 4.43Å; L679-T764 HydrophobicContact CD2-CG2 4.2Å; I760-T764 HydrophobicContact CG2-CG2 4.36Å; I760-T764 WeakPolarHBondContact O-CG2 3.41Å; I760-T764 PolarHBondContact O-N 3.25Å; I760-T764 PolarHBondContact O-OG1 2.94Å; S761-T764 WeakPolarHBondContact CA-OG1 3.32Å; S761-T764 PolarHBondContact O-N 3.25Å; S761-T764 PolarHBondContact O-OG1 2.81Å
765	L	55	Low	52.5	Low	19 Å²	19	48.4 Å²	48.4	10%	0.099	30%	0.304	C	S	.	.	S	Bend	trans	-62.2	131	179.4	-84.4	154.3	0	0	0	111.5	Q490 M493 F582 S761 M762	Q490-L765 HydrophobicContact CB-CD2 3.97Å; Q490-L765 HydrophobicContact CG-CD2 3.8Å; M493-L765 HydrophobicContact SD-CD2 4.31Å; M493-L765 HydrophobicContact SD-CG 4.25Å; F582-L765 HydrophobicContact CE1-CB 4.23Å; F582-L765 HydrophobicContact CE1-CD1 3.47Å; F582-L765 VanDerWaalsContact CE1-CD1 3.47Å; F582-L765 HydrophobicContact CE1-CG 4.39Å; F582-L765 HydrophobicContact CZ-CD1 4.06Å; S761-L765 PolarHBondContact O-N 2.81Å; M762-L765 HydrophobicContact SD-CD1 4.07Å
766	P	50.3	Low	51.4	Low	80 Å²	80	52.1 Å²	52.1	52%	0.519	32%	0.324	S	S	.	.			trans	-59	134.5	-178	-24.8	33.4	0	0	0	114
767	R	50.9	Low	50.4	Low	76 Å²	76	55 Å²	55	29%	0.287	35%	0.349	S	S	.	.			trans	-105	128.3	179.2	-58.2	-179.3	-172.9	-177.1	1.1	110.8	H675 E763 A769 D770	H675-R767 PolarHBondContact ND1-NH2 2.98Å; E763-R767 IonicContact OE2-NH2 3.34Å; E763-R767 PolarHBondContact OE2-NH2 2.81Å; R767-A769 PolarHBondContact O-N 3.35Å; R767-D770 PolarHBondContact O-N 2.89Å
768	E	38.2	Very low	49.4	Very low	107 Å²	107	57.5 Å²	57.5	50%	0.5	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-71.8	-13.7	171.5	-76.3	162.3	151.3	0	0	112.7	K578 D770	K578-E768 IonicContact NZ-OE2 2.74Å; K578-E768 PolarHBondContact NZ-OE2 3.45Å; E768-D770 PolarHBondContact O-N 3.33Å
769	A	36.7	Very low	48.6	Very low	48 Å²	48	60 Å²	60	40%	0.397	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-69.5	-6.5	173.7	0	0	0	0	0	114.4	R767 G771 T772	R767-A769 PolarHBondContact O-N 3.35Å; A769-G771 PolarHBondContact O-N 2.97Å; A769-T772 PolarHBondContact O-OG1 3.42Å
770	D	35.3	Very low	47.5	Very low	77 Å²	77	62 Å²	62	41%	0.412	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-67.1	-20	176.5	-88.2	21.3	0	0	0	112.5	R672 R767 E768	R672-D770 IonicContact CZ-OD2 3.25Å; R672-D770 IonicContact NE-OD2 3.64Å; R672-D770 IonicContact NH2-OD2 3.68Å; R672-D770 PolarHBondContact NH2-OD2 3.39Å; R767-D770 PolarHBondContact O-N 2.89Å; E768-D770 PolarHBondContact O-N 3.33Å
771	G	34.4	Very low	46.7	Very low	54 Å²	54	67 Å²	67	56%	0.557	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-39	177.7	0	0	0	0	0	114.3	A769 S774	A769-G771 PolarHBondContact O-N 2.97Å; G771-S774 PolarHBondContact O-OG 3.06Å; G771-S774 VanDerWaalsContact O-OG 3.11Å
772	T	32.7	Very low	46.2	Very low	118 Å²	118	66.1 Å²	66.1	72%	0.724	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-77	-21.6	-174.8	30.3	0	0	0	0	113.9	A769	A769-T772 PolarHBondContact O-OG1 3.42Å
773	L	32.2	Very low	45.4	Very low	83 Å²	83	69 Å²	69	44%	0.435	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-84.2	-9.6	-177.5	-85.7	149.1	0	0	0	114.8	G775 N776	L773-G775 PolarHBondContact O-N 2.88Å; L773-G775 VanDerWaalsContact O-N 3.15Å; L773-N776 PolarHBondContact O-N 3.37Å
774	S	34.8	Very low	44.6	Very low	99 Å²	99	71.4 Å²	71.4	69%	0.692	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-59.2	-25	175.6	63.6	0	0	0	0	113.3	G771	G771-S774 PolarHBondContact O-OG 3.06Å; G771-S774 VanDerWaalsContact O-OG 3.11Å
775	G	38	Very low	44.4	Very low	56 Å²	56	71.1 Å²	71.1	58%	0.577	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-76.6	-16.8	178.8	0	0	0	0	0	115.9	L773	L773-G775 PolarHBondContact O-N 2.88Å; L773-G775 VanDerWaalsContact O-N 3.15Å
776	N	43.9	Very low	44.6	Very low	83 Å²	83	73.6 Å²	73.6	44%	0.444	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-100.8	11.4	-171.9	-75	-19.4	0	0	0	114.6	L773 E778 T779 V780	L773-N776 PolarHBondContact O-N 3.37Å; N776-E778 VanDerWaalsContact C-N 3.29Å; N776-E778 PolarHBondContact O-N 3.35Å; N776-E778 VanDerWaalsContact O-N 3.15Å; N776-T779 PolarHBondContact O-N 3.5Å; N776-V780 HydrophobicContact CB-CG2 4.38Å; N776-V780 WeakPolarHBondContact O-CG2 3.2Å; N776-V780 PolarHBondContact O-N 3.44Å
777	A	46.6	Very low	44.7	Very low	68 Å²	68	74.6 Å²	74.6	56%	0.562	43%	0.431	S	S	*	.	H	α-helix	trans	-55.6	-37	-169.8	0	0	0	0	0	114.4	R781	A777-R781 VanDerWaalsContact O-CB 3.29Å; A777-R781 WeakPolarHBondContact O-CB 3.48Å; A777-R781 PolarHBondContact O-N 3.38Å
778	E	51.9	Low	45.1	Very low	115 Å²	115	76.8 Å²	76.8	54%	0.537	44%	0.444	S	S	.	.	H	α-helix	trans	-75.5	-40	-177.7	-174.9	151.6	-148.6	0	0	113.3	N776 R781 L782	N776-E778 VanDerWaalsContact C-N 3.29Å; N776-E778 PolarHBondContact O-N 3.35Å; N776-E778 VanDerWaalsContact O-N 3.15Å; E778-R781 PolarHBondContact O-N 3.16Å; E778-R781 IonicContact OE1-NH2 2.62Å; E778-R781 PolarHBondContact OE1-NH2 2.83Å; E778-L782 WeakPolarHBondContact O-CG 3Å; E778-L782 PolarHBondContact O-N 2.97Å
779	T	45.8	Very low	46.7	Very low	61 Å²	61	73.7 Å²	73.7	37%	0.374	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-44.1	174	-53.6	0	0	0	0	110.5	N776 R781 L782 V783	N776-T779 PolarHBondContact O-N 3.5Å; T779-R781 VanDerWaalsContact C-N 3.34Å; T779-R781 PolarHBondContact O-N 2.88Å; T779-L782 PolarHBondContact O-N 3.19Å; T779-V783 WeakPolarHBondContact O-CG2 3.47Å; T779-V783 PolarHBondContact O-N 2.71Å
780	V	45.2	Very low	47.9	Very low	46 Å²	46	72.6 Å²	72.6	28%	0.279	42%	0.42	S	S	.	.	H	α-helix	trans	-59	-45.6	175.3	173.1	0	0	0	0	110.5	N776 L782 V783 L784	N776-V780 HydrophobicContact CB-CG2 4.38Å; N776-V780 WeakPolarHBondContact O-CG2 3.2Å; N776-V780 PolarHBondContact O-N 3.44Å; V780-L782 VanDerWaalsContact C-N 3.33Å; V780-L782 PolarHBondContact O-N 2.95Å; V780-V783 PolarHBondContact O-N 3.08Å; V780-L784 HydrophobicContact CG1-CD1 3.88Å; V780-L784 HydrophobicContact CG1-CG 4.26Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 2.66Å
781	R	52.7	Low	49.1	Very low	119 Å²	119	72.2 Å²	72.2	45%	0.449	42%	0.423	S	S	.	.	H	α-helix	trans	-58.8	-41.2	175.9	-175.4	-174.5	68.4	100.2	-4.3	112.7	A777 E778 T779 N785	A777-R781 VanDerWaalsContact O-CB 3.29Å; A777-R781 WeakPolarHBondContact O-CB 3.48Å; A777-R781 PolarHBondContact O-N 3.38Å; E778-R781 PolarHBondContact O-N 3.16Å; E778-R781 IonicContact OE1-NH2 2.62Å; E778-R781 PolarHBondContact OE1-NH2 2.83Å; T779-R781 VanDerWaalsContact C-N 3.34Å; T779-R781 PolarHBondContact O-N 2.88Å; R781-N785 WeakPolarHBondContact O-CB 3.35Å; R781-N785 VanDerWaalsContact O-CG 3.31Å; R781-N785 PolarHBondContact O-N 3Å
782	L	54.4	Low	50.9	Low	17 Å²	17	72.8 Å²	72.8	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-66.7	-39.2	177.2	-72.6	171.5	0	0	0	112	L153 L157 E778 T779 V780 Y786	L153-L782 HydrophobicContact CD1-CD2 4.09Å; L153-L782 WeakPolarHBondContact CD2-O 3.28Å; L157-L782 HydrophobicContact CD2-CB 3.94Å; E778-L782 WeakPolarHBondContact O-CG 3Å; E778-L782 PolarHBondContact O-N 2.97Å; T779-L782 PolarHBondContact O-N 3.19Å; V780-L782 VanDerWaalsContact C-N 3.33Å; V780-L782 PolarHBondContact O-N 2.95Å; L782-Y786 PolarHBondContact O-N 3Å; L782-Y786 VanDerWaalsContact O-N 3.15Å
783	V	45.8	Very low	52.9	Low	61 Å²	61	68.1 Å²	68.1	37%	0.37	39%	0.387	S	S	.	.	H	α-helix	trans	-67.9	-44	176.5	173.6	0	0	0	0	111.3	L157 T779 V780 N785 Y786 I787	L157-V783 HydrophobicContact CD2-CG2 3.98Å; T779-V783 WeakPolarHBondContact O-CG2 3.47Å; T779-V783 PolarHBondContact O-N 2.71Å; V780-V783 PolarHBondContact O-N 3.08Å; V783-N785 PolarHBondContact O-N 3.4Å; V783-Y786 WeakPolarHBondContact O-CA 3.39Å; V783-Y786 WeakPolarHBondContact O-CB 3.34Å; V783-Y786 PolarHBondContact O-N 3.27Å; V783-I787 HydrophobicContact CG1-CD1 3.96Å; V783-I787 WeakPolarHBondContact O-CG1 3.47Å; V783-I787 PolarHBondContact O-N 2.88Å
784	L	46.4	Very low	54.7	Low	53 Å²	53	69.4 Å²	69.4	28%	0.277	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-47	176.9	-71.1	173.4	0	0	0	111.7	F673 V780 Y786 I787 E788	F673-L784 HydrophobicContact CD1-CD2 4.49Å; F673-L784 HydrophobicContact CG-CD2 4.36Å; V780-L784 HydrophobicContact CG1-CD1 3.88Å; V780-L784 HydrophobicContact CG1-CG 4.26Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 2.66Å; L784-Y786 PolarHBondContact O-N 2.91Å; L784-I787 PolarHBondContact O-N 2.86Å; L784-I787 VanDerWaalsContact O-N 3.14Å; L784-E788 PolarHBondContact O-N 3.31Å
785	N	60.9	Low	56.6	Low	54 Å²	54	70.4 Å²	70.4	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-58	-33.2	174.5	-78	-0.7	0	0	0	112.1	L153 R781 V783 I789	L153-N785 HydrophobicContact CD1-CB 4.3Å; L153-N785 VanDerWaalsContact CD2-C 3.45Å; L153-N785 HydrophobicContact CD2-CB 3.8Å; R781-N785 WeakPolarHBondContact O-CB 3.35Å; R781-N785 VanDerWaalsContact O-CG 3.31Å; R781-N785 PolarHBondContact O-N 3Å; V783-N785 PolarHBondContact O-N 3.4Å; N785-I789 WeakPolarHBondContact O-CB 3.31Å; N785-I789 VanDerWaalsContact O-CG1 3.25Å; N785-I789 WeakPolarHBondContact O-CG1 3.24Å; N785-I789 PolarHBondContact O-N 3.11Å
786	Y	59.8	Low	58.5	Low	71 Å²	71	68.9 Å²	68.9	28%	0.278	36%	0.364	S	S	.	.	H	α-helix	trans	-70.7	-43.6	178.1	-176.7	-103	0	0	0	111.5	L153 L154 L157 L782 V783 L784 I789 S790	L153-Y786 VanDerWaalsContact CD2-CB 3.45Å; L153-Y786 HydrophobicContact CD2-CD2 4.12Å; L153-Y786 HydrophobicContact CD2-CG 4.29Å; L154-Y786 HydrophobicContact CB-CE2 3.98Å; L154-Y786 HydrophobicContact CD1-CE2 4.1Å; L157-Y786 HydrophobicContact CD1-CD2 4.39Å; L157-Y786 HydrophobicContact CD1-CG 4.1Å; L782-Y786 PolarHBondContact O-N 3Å; L782-Y786 VanDerWaalsContact O-N 3.15Å; V783-Y786 WeakPolarHBondContact O-CA 3.39Å; V783-Y786 WeakPolarHBondContact O-CB 3.34Å; V783-Y786 PolarHBondContact O-N 3.27Å; L784-Y786 PolarHBondContact O-N 2.91Å; Y786-I789 PolarHBondContact O-N 2.98Å; Y786-S790 WeakPolarHBondContact CE1-OG 3.29Å; Y786-S790 VanDerWaalsContact O-CB 3.22Å; Y786-S790 WeakPolarHBondContact O-CB 3.22Å; Y786-S790 PolarHBondContact O-N 3.23Å; Y786-S790 PolarHBondContact O-OG 3.17Å
787	I	51.4	Low	60	Low	100 Å²	100	69.5 Å²	69.5	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-46.7	178.4	-67	167.4	0	0	0	110.3	V783 L784 S790 S791	V783-I787 HydrophobicContact CG1-CD1 3.96Å; V783-I787 WeakPolarHBondContact O-CG1 3.47Å; V783-I787 PolarHBondContact O-N 2.88Å; L784-I787 PolarHBondContact O-N 2.86Å; L784-I787 VanDerWaalsContact O-N 3.14Å; I787-S790 PolarHBondContact O-N 2.91Å; I787-S791 PolarHBondContact O-N 3.47Å
788	E	60	Low	61.3	Low	122 Å²	122	70.3 Å²	70.3	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-59.5	-52.3	176.6	-73.2	-178.8	-179	0	0	111.4	L784 S790 S791 V792	L784-E788 PolarHBondContact O-N 3.31Å; E788-S790 VanDerWaalsContact C-N 3.27Å; E788-S790 PolarHBondContact O-N 3.07Å; E788-S791 PolarHBondContact O-N 3.47Å; E788-S791 VanDerWaalsContact O-N 3.16Å; E788-S791 PolarHBondContact O-OG 2.91Å; E788-V792 WeakPolarHBondContact O-CG2 3.26Å; E788-V792 PolarHBondContact O-N 3.42Å; E788-V792 VanDerWaalsContact O-N 3.12Å
789	I	72.1	Confident	62.6	Low	42 Å²	42	68.8 Å²	68.8	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-60.5	-38.2	177.7	-69.9	171.8	0	0	0	111.4	I146 K149 L153 N785 Y786 V792 L793	I146-I789 HydrophobicContact CG2-CG2 4.1Å; K149-I789 HydrophobicContact CB-CD1 4.35Å; L153-I789 HydrophobicContact CD2-CD1 4.38Å; N785-I789 WeakPolarHBondContact O-CB 3.31Å; N785-I789 VanDerWaalsContact O-CG1 3.25Å; N785-I789 WeakPolarHBondContact O-CG1 3.24Å; N785-I789 PolarHBondContact O-N 3.11Å; Y786-I789 PolarHBondContact O-N 2.98Å; I789-V792 PolarHBondContact O-N 3.47Å; I789-L793 VanDerWaalsContact O-CB 3.24Å; I789-L793 WeakPolarHBondContact O-CB 3.33Å; I789-L793 PolarHBondContact O-N 3Å
790	S	60.8	Low	64.3	Low	25 Å²	25	66.4 Å²	66.4	18%	0.175	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-39	177.4	-63.1	0	0	0	0	112.3	Y786 I787 E788 L793 N794	Y786-S790 WeakPolarHBondContact CE1-OG 3.29Å; Y786-S790 VanDerWaalsContact O-CB 3.22Å; Y786-S790 WeakPolarHBondContact O-CB 3.22Å; Y786-S790 PolarHBondContact O-N 3.23Å; Y786-S790 PolarHBondContact O-OG 3.17Å; I787-S790 PolarHBondContact O-N 2.91Å; E788-S790 VanDerWaalsContact C-N 3.27Å; E788-S790 PolarHBondContact O-N 3.07Å; S790-L793 WeakPolarHBondContact O-CB 3.3Å; S790-L793 PolarHBondContact O-N 2.88Å; S790-N794 WeakPolarHBondContact O-CB 3.28Å; S790-N794 PolarHBondContact O-N 3.33Å
791	S	61.2	Low	65.9	Low	69 Å²	69	66.7 Å²	66.7	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-65	-42.6	175.9	71.6	0	0	0	0	112.4	I787 E788 L793 N794 F795	I787-S791 PolarHBondContact O-N 3.47Å; E788-S791 PolarHBondContact O-N 3.47Å; E788-S791 VanDerWaalsContact O-N 3.16Å; E788-S791 PolarHBondContact O-OG 2.91Å; S791-L793 VanDerWaalsContact C-N 3.35Å; S791-N794 PolarHBondContact O-N 2.74Å; S791-F795 PolarHBondContact O-N 3.14Å
792	V	72.4	Confident	66.8	Low	67 Å²	67	67.8 Å²	67.8	41%	0.406	35%	0.353	S	S	.	.	H	α-helix	trans	-68.6	-38.4	176.2	-174.8	0	0	0	0	110.3	I146 E788 I789 N794 F795 E796	I146-V792 HydrophobicContact CD1-CG1 3.59Å; E788-V792 WeakPolarHBondContact O-CG2 3.26Å; E788-V792 PolarHBondContact O-N 3.42Å; E788-V792 VanDerWaalsContact O-N 3.12Å; I789-V792 PolarHBondContact O-N 3.47Å; V792-N794 PolarHBondContact O-N 3.04Å; V792-F795 PolarHBondContact O-N 3.07Å; V792-E796 PolarHBondContact O-N 2.86Å
793	L	74.9	Confident	67.7	Low	20 Å²	20	68.2 Å²	68.2	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-59.9	-45	174.6	-175.3	64.6	0	0	0	111.4	Y143 I146 D147 I789 S790 S791 F795 E796 Y797	Y143-L793 HydrophobicContact CD2-CD1 3.79Å; Y143-L793 HydrophobicContact CE2-CD1 3.45Å; Y143-L793 VanDerWaalsContact CE2-CD1 3.45Å; Y143-L793 HydrophobicContact CE2-CG 4.16Å; I146-L793 HydrophobicContact CB-CD1 4.22Å; I146-L793 HydrophobicContact CG2-CB 3.96Å; I146-L793 HydrophobicContact CG2-CD1 4.05Å; D147-L793 HydrophobicContact CB-CD1 3.85Å; I789-L793 VanDerWaalsContact O-CB 3.24Å; I789-L793 WeakPolarHBondContact O-CB 3.33Å; I789-L793 PolarHBondContact O-N 3Å; S790-L793 WeakPolarHBondContact O-CB 3.3Å; S790-L793 PolarHBondContact O-N 2.88Å; S791-L793 VanDerWaalsContact C-N 3.35Å; L793-F795 VanDerWaalsContact C-N 3.33Å; L793-F795 PolarHBondContact O-N 2.75Å; L793-E796 PolarHBondContact O-N 2.95Å; L793-Y797 VanDerWaalsContact O-CB 3.29Å; L793-Y797 WeakPolarHBondContact O-CB 3.41Å; L793-Y797 PolarHBondContact O-N 3.49Å
794	N	68.9	Low	69.3	Low	109 Å²	109	65.8 Å²	65.8	58%	0.583	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-38.8	175.5	-79.1	-17.1	0	0	0	112.2	S790 S791 V792 Y797 S798	S790-N794 WeakPolarHBondContact O-CB 3.28Å; S790-N794 PolarHBondContact O-N 3.33Å; S791-N794 PolarHBondContact O-N 2.74Å; V792-N794 PolarHBondContact O-N 3.04Å; N794-Y797 PolarHBondContact O-N 2.9Å; N794-S798 PolarHBondContact O-N 3.29Å
795	F	76	Confident	70.6	Confident	120 Å²	120	64.3 Å²	64.3	53%	0.526	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-46.6	175.4	179.1	-106.6	0	0	0	112.1	S791 V792 L793 Y797 S798	S791-F795 PolarHBondContact O-N 3.14Å; V792-F795 PolarHBondContact O-N 3.07Å; L793-F795 VanDerWaalsContact C-N 3.33Å; L793-F795 PolarHBondContact O-N 2.75Å; F795-Y797 VanDerWaalsContact C-N 3.34Å; F795-Y797 PolarHBondContact O-N 3.4Å; F795-S798 WeakPolarHBondContact O-CB 3.34Å; F795-S798 PolarHBondContact O-N 2.95Å; F795-S798 PolarHBondContact O-OG 2.96Å
796	E	77.5	Confident	71.1	Confident	24 Å²	24	65.4 Å²	65.4	11%	0.112	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-35.2	175.8	-66.9	-52.7	146.9	0	0	112.5	Y143 I146 V792 L793 S798 K799	Y143-E796 HydrophobicContact CD2-CB 4.31Å; I146-E796 HydrophobicContact CD1-CG 3.59Å; V792-E796 PolarHBondContact O-N 2.86Å; L793-E796 PolarHBondContact O-N 2.95Å; E796-S798 VanDerWaalsContact C-N 3.29Å; E796-S798 PolarHBondContact O-N 3.39Å; E796-K799 PolarHBondContact O-N 3.48Å; E796-K799 IonicContact OE1-NZ 3.99Å; E796-K799 PolarHBondContact OE1-NZ 3.2Å; E796-K799 WeakPolarHBondContact OE2-CD 3.28Å; E796-K799 WeakPolarHBondContact OE2-CE 3.47Å; E796-K799 IonicContact OE2-NZ 2.66Å; E796-K799 PolarHBondContact OE2-NZ 3.19Å
797	Y	74.6	Confident	71.6	Confident	96 Å²	96	62 Å²	62	38%	0.376	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-39.6	172	-174.7	-91	0	0	0	111.7	Y143 L793 N794 F795 K799 L800 L805	Y143-Y797 AromaticContact CE2-CD2 3.84Å; Y143-Y797 HydrophobicContact CE2-CD2 3.84Å; Y143-Y797 HydrophobicContact CE2-CG 4.4Å; L793-Y797 VanDerWaalsContact O-CB 3.29Å; L793-Y797 WeakPolarHBondContact O-CB 3.41Å; L793-Y797 PolarHBondContact O-N 3.49Å; N794-Y797 PolarHBondContact O-N 2.9Å; F795-Y797 VanDerWaalsContact C-N 3.34Å; F795-Y797 PolarHBondContact O-N 3.4Å; Y797-K799 PolarHBondContact O-N 3.48Å; Y797-K799 VanDerWaalsContact O-N 3.14Å; Y797-L800 PolarHBondContact O-N 2.86Å; Y797-L805 HydrophobicContact CD2-CD1 3.84Å; Y797-L805 HydrophobicContact CE2-CD1 3.23Å; Y797-L805 HydrophobicContact CE2-CG 4.5Å
798	S	74.8	Confident	72.3	Confident	85 Å²	85	58.4 Å²	58.4	59%	0.594	31%	0.305	S	S	*	.	H	α-helix	trans	-63.3	-19.8	-179.9	78	0	0	0	0	114.2	N794 F795 E796 L800	N794-S798 PolarHBondContact O-N 3.29Å; F795-S798 WeakPolarHBondContact O-CB 3.34Å; F795-S798 PolarHBondContact O-N 2.95Å; F795-S798 PolarHBondContact O-OG 2.96Å; E796-S798 VanDerWaalsContact C-N 3.29Å; E796-S798 PolarHBondContact O-N 3.39Å; S798-L800 VanDerWaalsContact C-N 3.33Å
799	K	79.7	Confident	72.6	Confident	84 Å²	84	58.3 Å²	58.3	37%	0.365	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-5.5	177	-57.9	-179.8	-165.1	159.7	0	113.5	R139 E796 Y797	R139-K799 PolarHBondContact NH1-O 2.86Å; E796-K799 PolarHBondContact O-N 3.48Å; E796-K799 IonicContact OE1-NZ 3.99Å; E796-K799 PolarHBondContact OE1-NZ 3.2Å; E796-K799 WeakPolarHBondContact OE2-CD 3.28Å; E796-K799 WeakPolarHBondContact OE2-CE 3.47Å; E796-K799 IonicContact OE2-NZ 2.66Å; E796-K799 PolarHBondContact OE2-NZ 3.19Å; Y797-K799 PolarHBondContact O-N 3.48Å; Y797-K799 VanDerWaalsContact O-N 3.14Å
800	L	81	Confident	72.3	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.052	31%	0.31	C	S	.	.	S	Bend	trans	-114.2	128.2	-177.3	-63.8	166	0	0	0	108.8	L136 R139 F140 Y143 Y797 S798 E804 L805	L136-L800 HydrophobicContact CD1-CD2 3.81Å; R139-L800 HydrophobicContact CB-CD2 3.92Å; F140-L800 HydrophobicContact CD2-CD1 4.31Å; Y143-L800 HydrophobicContact CD1-CD1 4.17Å; Y143-L800 HydrophobicContact CD2-CD1 4.26Å; Y143-L800 HydrophobicContact CG-CD1 3.77Å; Y797-L800 PolarHBondContact O-N 2.86Å; S798-L800 VanDerWaalsContact C-N 3.33Å; L800-E804 WeakPolarHBondContact CA-OE2 3.33Å; L800-L805 HydrophobicContact CB-CD1 4.41Å; L800-L805 HydrophobicContact CB-CD2 4.11Å; L800-L805 HydrophobicContact CB-CG 3.92Å; L800-L805 HydrophobicContact CD1-CD2 3.67Å; L800-L805 HydrophobicContact CD1-CG 4.41Å; L800-L805 HydrophobicContact CG-CD2 4.49Å
801	S	78.3	Confident	72.4	Confident	52 Å²	52	58.9 Å²	58.9	36%	0.364	31%	0.311	S	S	.	.			trans	-70.6	155.7	170.3	84.6	0	0	0	0	110.6	L803 E804 L805	S801-L803 PolarHBondContact O-N 3.48Å; S801-L803 PolarHBondContact OG-N 3.46Å; S801-E804 PolarHBondContact N-OE2 3.43Å; S801-E804 WeakPolarHBondContact O-CB 3.37Å; S801-E804 PolarHBondContact O-N 3.12Å; S801-E804 VanDerWaalsContact O-N 3.1Å; S801-E804 WeakPolarHBondContact OG-CB 3.32Å; S801-E804 VanDerWaalsContact OG-CG 3.29Å; S801-E804 WeakPolarHBondContact OG-CG 3.46Å; S801-E804 PolarHBondContact OG-N 3.33Å; S801-L805 PolarHBondContact O-N 2.9Å
802	Q	71.3	Confident	72.1	Confident	142 Å²	142	59.2 Å²	59.2	66%	0.664	31%	0.311	S	S	*	.	H	α-helix	trans	-55.2	-35	174.4	-72.4	-172.3	-10.3	0	0	112.1	K806	Q802-K806 PolarHBondContact O-N 2.88Å
803	L	72.9	Confident	71.2	Confident	26 Å²	26	64.1 Å²	64.1	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-71.1	-42.5	178.8	-164.1	163.1	0	0	0	111	D117 R118 Y121 S801 K806 L807	D117-L803 HydrophobicContact CB-CD1 3.48Å; D117-L803 VanDerWaalsContact CB-CD1 3.48Å; R118-L803 HydrophobicContact CB-CD2 4.27Å; Y121-L803 HydrophobicContact CD1-CD2 3.83Å; Y121-L803 HydrophobicContact CD2-CD2 4.48Å; Y121-L803 HydrophobicContact CE1-CD2 4.45Å; Y121-L803 HydrophobicContact CG-CD2 3.83Å; S801-L803 PolarHBondContact O-N 3.48Å; S801-L803 PolarHBondContact OG-N 3.46Å; L803-K806 PolarHBondContact O-N 3.34Å; L803-L807 HydrophobicContact CD2-CD1 3.27Å; L803-L807 HydrophobicContact CD2-CG 3.93Å; L803-L807 VanDerWaalsContact O-CB 3.3Å; L803-L807 WeakPolarHBondContact O-CB 3.24Å; L803-L807 PolarHBondContact O-N 2.8Å
804	E	80.5	Confident	70	Confident	11 Å²	11	65.6 Å²	65.6	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-42.5	174.3	-79.8	-179.8	154.8	0	0	113.1	Y121 L136 R139 L800 S801 K806 L807 S808	Y121-E804 PolarHBondContact OH-OE1 3.22Å; Y121-E804 VanDerWaalsContact OH-OE1 3.08Å; L136-E804 HydrophobicContact CD1-CB 3.61Å; L136-E804 HydrophobicContact CD1-CG 3.92Å; L136-E804 HydrophobicContact CD2-CB 4.21Å; L136-E804 HydrophobicContact CD2-CG 4.24Å; R139-E804 IonicContact CZ-OE1 2.91Å; R139-E804 IonicContact CZ-OE2 3.53Å; R139-E804 IonicContact NH1-OE1 3.73Å; R139-E804 PolarHBondContact NH1-OE1 3.47Å; R139-E804 IonicContact NH1-OE2 3.81Å; R139-E804 PolarHBondContact NH1-OE2 2.93Å; R139-E804 IonicContact NH2-OE1 2.92Å; R139-E804 PolarHBondContact NH2-OE1 3.49Å; R139-E804 IonicContact NH2-OE2 2.67Å; L800-E804 WeakPolarHBondContact CA-OE2 3.33Å; S801-E804 PolarHBondContact N-OE2 3.43Å; S801-E804 WeakPolarHBondContact O-CB 3.37Å; S801-E804 PolarHBondContact O-N 3.12Å; S801-E804 VanDerWaalsContact O-N 3.1Å; S801-E804 WeakPolarHBondContact OG-CB 3.32Å; S801-E804 VanDerWaalsContact OG-CG 3.29Å; S801-E804 WeakPolarHBondContact OG-CG 3.46Å; S801-E804 PolarHBondContact OG-N 3.33Å; E804-K806 PolarHBondContact O-N 3.41Å; E804-L807 PolarHBondContact O-N 3.04Å; E804-S808 PolarHBondContact O-N 2.9Å
805	L	74.4	Confident	68.9	Low	21 Å²	21	65.8 Å²	65.8	11%	0.11	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-45.3	175.7	-75.7	163.1	0	0	0	111.8	F140 Y143 Y797 L800 S801	F140-L805 HydrophobicContact CD2-CD2 4.19Å; F140-L805 HydrophobicContact CE2-CD2 3.93Å; Y143-L805 HydrophobicContact CD1-CD2 4.22Å; Y143-L805 HydrophobicContact CE1-CD2 3.98Å; Y797-L805 HydrophobicContact CD2-CD1 3.84Å; Y797-L805 HydrophobicContact CE2-CD1 3.23Å; Y797-L805 HydrophobicContact CE2-CG 4.5Å; L800-L805 HydrophobicContact CB-CD1 4.41Å; L800-L805 HydrophobicContact CB-CD2 4.11Å; L800-L805 HydrophobicContact CB-CG 3.92Å; L800-L805 HydrophobicContact CD1-CD2 3.67Å; L800-L805 HydrophobicContact CD1-CG 4.41Å; L800-L805 HydrophobicContact CG-CD2 4.49Å; S801-L805 PolarHBondContact O-N 2.9Å
806	K	70.6	Confident	67.7	Low	77 Å²	77	62.7 Å²	62.7	34%	0.335	35%	0.345	S	S	.	.	H	α-helix	trans	-72	-40.2	177.8	-71.1	-159	-169.3	176.4	0	112.4	E111 L114 Q802 L803 E804 S808 N809	E111-K806 IonicContact OE1-NZ 3.81Å; E111-K806 IonicContact OE2-NZ 3.66Å; E111-K806 PolarHBondContact OE2-NZ 3.22Å; L114-K806 HydrophobicContact CD1-CD 3.46Å; L114-K806 VanDerWaalsContact CD1-CD 3.46Å; L114-K806 HydrophobicContact CD1-CG 4.2Å; L114-K806 HydrophobicContact CD2-CB 4.02Å; L114-K806 HydrophobicContact CD2-CD 3.53Å; L114-K806 HydrophobicContact CD2-CG 4.35Å; L114-K806 HydrophobicContact CG-CD 4.07Å; Q802-K806 PolarHBondContact O-N 2.88Å; L803-K806 PolarHBondContact O-N 3.34Å; E804-K806 PolarHBondContact O-N 3.41Å; K806-S808 VanDerWaalsContact C-N 3.27Å; K806-S808 PolarHBondContact O-N 3.48Å; K806-N809 PolarHBondContact O-N 3.24Å
807	L	71	Confident	66.4	Low	1 Å²	1	71.8 Å²	71.8	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-54.9	-44	173.6	-97.6	169.8	0	0	0	111.4	R118 Y121 L122 L136 L803 E804 N809 V810 L811	R118-L807 HydrophobicContact CG-CD2 3.78Å; R118-L807 HydrophobicContact CG-CG 4.09Å; Y121-L807 HydrophobicContact CD1-CD1 3.41Å; Y121-L807 VanDerWaalsContact CD1-CD1 3.41Å; Y121-L807 HydrophobicContact CE1-CD1 3.51Å; Y121-L807 HydrophobicContact CG-CD1 4.48Å; L122-L807 HydrophobicContact CD2-CD2 4.36Å; L136-L807 HydrophobicContact CD2-CB 4.16Å; L803-L807 HydrophobicContact CD2-CD1 3.27Å; L803-L807 HydrophobicContact CD2-CG 3.93Å; L803-L807 VanDerWaalsContact O-CB 3.3Å; L803-L807 WeakPolarHBondContact O-CB 3.24Å; L803-L807 PolarHBondContact O-N 2.8Å; E804-L807 PolarHBondContact O-N 3.04Å; L807-N809 PolarHBondContact O-N 3.37Å; L807-V810 PolarHBondContact O-N 3.43Å; L807-L811 HydrophobicContact CB-CD1 3.78Å; L807-L811 HydrophobicContact CD2-CD1 4.09Å; L807-L811 HydrophobicContact CD2-CG 4.19Å; L807-L811 HydrophobicContact CG-CD1 4.47Å; L807-L811 WeakPolarHBondContact O-CB 3.38Å; L807-L811 WeakPolarHBondContact O-CD1 3.27Å; L807-L811 VanDerWaalsContact O-CG 3.22Å; L807-L811 WeakPolarHBondContact O-CG 3.47Å; L807-L811 PolarHBondContact O-N 2.62Å
808	S	66.5	Low	65.4	Low	24 Å²	24	73.8 Å²	73.8	17%	0.168	40%	0.402	C	S	.	.	H	α-helix	trans	-65.1	-21.7	-176.8	-167.9	0	0	0	0	114.3	F140 E804 K806 V810	F140-S808 WeakPolarHBondContact CD1-OG 3.37Å; F140-S808 VanDerWaalsContact CE1-OG 3.26Å; F140-S808 WeakPolarHBondContact CE1-OG 3.36Å; F140-S808 WeakPolarHBondContact CG-OG 3.47Å; E804-S808 PolarHBondContact O-N 2.9Å; K806-S808 VanDerWaalsContact C-N 3.27Å; K806-S808 PolarHBondContact O-N 3.48Å; S808-V810 VanDerWaalsContact C-N 3.32Å
809	N	66.3	Low	64.6	Low	119 Å²	119	71.9 Å²	71.9	64%	0.636	39%	0.388	S	S	*	.	H	α-helix	trans	-77.3	-20.2	173.4	-70.5	-25.6	0	0	0	112.5	K806 L807	K806-N809 PolarHBondContact O-N 3.24Å; L807-N809 PolarHBondContact O-N 3.37Å
810	V	64.2	Low	63.7	Low	45 Å²	45	70.8 Å²	70.8	27%	0.273	39%	0.39	S	S	.	.	H	α-helix	trans	-107.7	-27.2	-173.5	-173.4	0	0	0	0	112.5	L807 S808 P812	L807-V810 PolarHBondContact O-N 3.43Å; S808-V810 VanDerWaalsContact C-N 3.32Å; V810-P812 WeakPolarHBondContact O-CD 3.43Å
811	L	62.7	Low	63.2	Low	35 Å²	35	78.3 Å²	78.3	18%	0.183	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-64.9	119.2	-178.8	-79.8	158	0	0	0	111.6	L136 L807 W823 L827	L136-L811 HydrophobicContact CD2-CD1 3.74Å; L807-L811 HydrophobicContact CB-CD1 3.78Å; L807-L811 HydrophobicContact CD2-CD1 4.09Å; L807-L811 HydrophobicContact CD2-CG 4.19Å; L807-L811 HydrophobicContact CG-CD1 4.47Å; L807-L811 WeakPolarHBondContact O-CB 3.38Å; L807-L811 WeakPolarHBondContact O-CD1 3.27Å; L807-L811 VanDerWaalsContact O-CG 3.22Å; L807-L811 WeakPolarHBondContact O-CG 3.47Å; L807-L811 PolarHBondContact O-N 2.62Å; L811-W823 HydrophobicContact CD2-CH2 3.37Å; L811-W823 HydrophobicContact CD2-CZ2 3.18Å; L811-L827 HydrophobicContact CD2-CD1 3.44Å; L811-L827 VanDerWaalsContact CD2-CD1 3.44Å; L811-L827 HydrophobicContact CD2-CD2 4.34Å
812	P	56	Low	63.1	Low	75 Å²	75	81.8 Å²	81.8	49%	0.487	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-62	142.1	163.4	-13.9	27.9	0	0	0	109.6	V810 C814	V810-P812 WeakPolarHBondContact O-CD 3.43Å; P812-C814 PolarHBondContact O-N 3.22Å; P812-C814 VanDerWaalsContact O-N 3.09Å
813	F	53.6	Low	63.4	Low	170 Å²	170	77.3 Å²	77.3	75%	0.746	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-52.9	116.3	178.1	-145.7	-86	0	0	0	109.9	S815	F813-S815 PolarHBondContact O-N 2.91Å
814	C	50.4	Low	63.8	Low	51 Å²	51	76.2 Å²	76.2	35%	0.345	40%	0.404	S	S	.	.			trans	-73.9	93.2	173.4	-170.7	0	0	0	0	108.1	P812 A816 W823	P812-C814 PolarHBondContact O-N 3.22Å; P812-C814 VanDerWaalsContact O-N 3.09Å; C814-A816 VanDerWaalsContact C-N 3.26Å; C814-W823 HydrophobicContact CB-CZ2 4.44Å
815	S	45.7	Very low	64	Low	114 Å²	114	78.7 Å²	78.7	80%	0.797	42%	0.419	S	S	*	.			trans	-80.2	-7.1	177.1	63.2	0	0	0	0	113.3	F813	F813-S815 PolarHBondContact O-N 2.91Å
816	A	49.4	Very low	64.5	Low	55 Å²	55	81.5 Å²	81.5	46%	0.455	44%	0.441	S	S	.	.	S	Bend	trans	-84.1	131.6	-179.2	0	0	0	0	0	111.1	C814 D818	C814-A816 VanDerWaalsContact C-N 3.26Å; A816-D818 WeakPolarHBondContact CB-O 3.3Å; A816-D818 PolarHBondContact O-N 2.81Å
817	K	51.4	Low	65.1	Low	214 Å²	214	78.2 Å²	78.2	93%	0.93	43%	0.427	S	S	*	.	S	Bend	trans	-59.7	-19.5	170.9	-73.7	-177	175.2	-179.3	0	113
818	D	52.8	Low	65.8	Low	138 Å²	138	80.1 Å²	80.1	74%	0.738	44%	0.436	S	S	*	.	S	Bend	trans	-125.7	104.7	169	-77.4	-46.2	0	0	0	108.6	A816 S820	A816-D818 WeakPolarHBondContact CB-O 3.3Å; A816-D818 PolarHBondContact O-N 2.81Å; D818-S820 PolarHBondContact O-N 2.81Å
819	P	57.3	Low	66.8	Low	46 Å²	46	81.7 Å²	81.7	30%	0.299	45%	0.451	S	S	.	.			trans	-61.3	107.5	170.4	20.7	-27.2	0	0	0	108.6	F134	F134-P819 HydrophobicContact CD1-CB 3.93Å; F134-P819 HydrophobicContact CD1-CG 3.37Å; F134-P819 HydrophobicContact CE1-CB 3.74Å; F134-P819 HydrophobicContact CE1-CG 3.43Å; F134-P819 VanDerWaalsContact CE1-CG 3.43Å; F134-P819 HydrophobicContact CG-CG 4.33Å; F134-P819 HydrophobicContact CZ-CG 4.44Å
820	S	62.6	Low	67.8	Low	60 Å²	60	80.7 Å²	80.7	42%	0.42	44%	0.441	S	S	.	.			trans	-64.7	145	179.6	65.9	0	0	0	0	110	D818 D822 W823	D818-S820 PolarHBondContact O-N 2.81Å; S820-D822 PolarHBondContact O-N 2.86Å; S820-W823 WeakPolarHBondContact O-CB 3.21Å; S820-W823 PolarHBondContact O-N 2.99Å
821	R	69.6	Low	69	Low	169 Å²	169	78.6 Å²	78.6	64%	0.638	43%	0.428	S	S	*	.	H	α-helix	trans	-54.7	-24.1	172.5	-72.7	177	173.8	162.5	-1	112.2	L824 V825	R821-L824 PolarHBondContact O-N 3.33Å; R821-V825 WeakPolarHBondContact O-CG2 3.42Å; R821-V825 PolarHBondContact O-N 3.2Å
822	D	76.5	Confident	70.4	Confident	124 Å²	124	81 Å²	81	66%	0.663	44%	0.441	S	S	*	.	H	α-helix	trans	-67.1	-32.8	177.1	-55.8	-31.1	0	0	0	112.9	S820 V825 S826	S820-D822 PolarHBondContact O-N 2.86Å; D822-V825 PolarHBondContact O-N 3.2Å; D822-S826 PolarHBondContact O-N 3.08Å
823	W	78.2	Confident	72.1	Confident	48 Å²	48	83 Å²	83	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-65.7	-43.9	176.4	170.2	82.6	0	0	0	111.7	L811 C814 S820 V825 S826 L827	L811-W823 HydrophobicContact CD2-CH2 3.37Å; L811-W823 HydrophobicContact CD2-CZ2 3.18Å; C814-W823 HydrophobicContact CB-CZ2 4.44Å; S820-W823 WeakPolarHBondContact O-CB 3.21Å; S820-W823 PolarHBondContact O-N 2.99Å; W823-V825 VanDerWaalsContact C-N 3.33Å; W823-V825 PolarHBondContact O-N 3.07Å; W823-S826 PolarHBondContact O-N 3.16Å; W823-L827 HydrophobicContact CD2-CD1 3.68Å; W823-L827 HydrophobicContact CE3-CD1 3.97Å; W823-L827 HydrophobicContact CG-CD1 4.39Å; W823-L827 HydrophobicContact CH2-CD1 3.72Å; W823-L827 HydrophobicContact CZ2-CD1 3.44Å; W823-L827 VanDerWaalsContact CZ2-CD1 3.44Å; W823-L827 HydrophobicContact CZ3-CD1 3.97Å; W823-L827 WeakPolarHBondContact O-CG 3.24Å; W823-L827 PolarHBondContact O-N 3Å
824	L	81.4	Confident	73.9	Confident	4 Å²	4	76.9 Å²	76.9	2%	0.021	42%	0.418	C	S	.	.	H	α-helix	trans	-61	-43	173.3	-72.4	175.4	0	0	0	111	L122 A125 K126 I133 F134 R821 S826 L827 M828	L122-L824 HydrophobicContact CD2-CD2 3.93Å; A125-L824 HydrophobicContact CB-CD1 4.14Å; A125-L824 HydrophobicContact CB-CD2 4.21Å; K126-L824 HydrophobicContact CB-CD1 4.24Å; I133-L824 HydrophobicContact CD1-CD2 4.23Å; F134-L824 HydrophobicContact CZ-CD1 4.31Å; R821-L824 PolarHBondContact O-N 3.33Å; L824-S826 PolarHBondContact O-N 3.15Å; L824-L827 PolarHBondContact O-N 3.08Å; L824-M828 VanDerWaalsContact O-CG 3.27Å; L824-M828 WeakPolarHBondContact O-CG 3.09Å; L824-M828 PolarHBondContact O-N 3.38Å
825	V	83.8	Confident	75.9	Confident	62 Å²	62	75.5 Å²	75.5	38%	0.376	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177.6	173.1	0	0	0	0	111.5	R821 D822 W823 L827 M828 A829	R821-V825 WeakPolarHBondContact O-CG2 3.42Å; R821-V825 PolarHBondContact O-N 3.2Å; D822-V825 PolarHBondContact O-N 3.2Å; W823-V825 VanDerWaalsContact C-N 3.33Å; W823-V825 PolarHBondContact O-N 3.07Å; V825-L827 VanDerWaalsContact C-N 3.32Å; V825-L827 PolarHBondContact O-N 3.08Å; V825-M828 PolarHBondContact O-N 3.43Å; V825-A829 PolarHBondContact O-N 2.87Å
826	S	84	Confident	78.1	Confident	81 Å²	81	75.5 Å²	75.5	57%	0.566	39%	0.394	S	S	*	.	H	α-helix	trans	-63.9	-36.9	176	-176.5	0	0	0	0	112.5	D822 W823 L824 K830	D822-S826 PolarHBondContact O-N 3.08Å; W823-S826 PolarHBondContact O-N 3.16Å; L824-S826 PolarHBondContact O-N 3.15Å; S826-K830 PolarHBondContact O-N 3.32Å
827	L	83.1	Confident	80.2	Confident	7 Å²	7	77 Å²	77	4%	0.037	39%	0.392	C	S	.	.	H	α-helix	trans	-69.5	-39.4	175.9	-75	170.7	0	0	0	112.6	L122 L811 W823 L824 V825 K830 T831	L122-L827 HydrophobicContact CD1-CB 4.08Å; L811-L827 HydrophobicContact CD2-CD1 3.44Å; L811-L827 VanDerWaalsContact CD2-CD1 3.44Å; L811-L827 HydrophobicContact CD2-CD2 4.34Å; W823-L827 HydrophobicContact CD2-CD1 3.68Å; W823-L827 HydrophobicContact CE3-CD1 3.97Å; W823-L827 HydrophobicContact CG-CD1 4.39Å; W823-L827 HydrophobicContact CH2-CD1 3.72Å; W823-L827 HydrophobicContact CZ2-CD1 3.44Å; W823-L827 VanDerWaalsContact CZ2-CD1 3.44Å; W823-L827 HydrophobicContact CZ3-CD1 3.97Å; W823-L827 WeakPolarHBondContact O-CG 3.24Å; W823-L827 PolarHBondContact O-N 3Å; L824-L827 PolarHBondContact O-N 3.08Å; V825-L827 VanDerWaalsContact C-N 3.32Å; V825-L827 PolarHBondContact O-N 3.08Å; L827-K830 PolarHBondContact O-N 2.8Å; L827-T831 WeakPolarHBondContact O-CB 3.44Å; L827-T831 PolarHBondContact O-N 2.76Å; L827-T831 PolarHBondContact O-OG1 3.4Å
828	M	86.3	Confident	82.2	Confident	41 Å²	41	68.2 Å²	68.2	20%	0.202	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-48.6	173.6	-69.8	172.7	74.7	0	0	110.1	L122 A123 L824 V825 K830 T831 D832	L122-M828 HydrophobicContact CB-CG 3.63Å; L122-M828 HydrophobicContact CB-SD 4.34Å; L122-M828 HydrophobicContact CD1-CG 4.04Å; L122-M828 HydrophobicContact CG-CG 4.47Å; A123-M828 HydrophobicContact CB-CE 3.96Å; L824-M828 VanDerWaalsContact O-CG 3.27Å; L824-M828 WeakPolarHBondContact O-CG 3.09Å; L824-M828 PolarHBondContact O-N 3.38Å; V825-M828 PolarHBondContact O-N 3.43Å; M828-K830 VanDerWaalsContact C-N 3.3Å; M828-K830 PolarHBondContact O-N 2.92Å; M828-T831 CarbonylContact O-C 3.54Å; M828-T831 WeakPolarHBondContact O-CA 3.42Å; M828-T831 WeakPolarHBondContact O-CB 3.28Å; M828-T831 PolarHBondContact O-N 3.47Å; M828-D832 PolarHBondContact O-N 3.27Å
829	A	88.1	Confident	84	Confident	58 Å²	58	62.9 Å²	62.9	48%	0.479	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-39	177	0	0	0	0	0	112.9	V825 D832 Q833	V825-A829 PolarHBondContact O-N 2.87Å; A829-D832 PolarHBondContact O-N 3.4Å; A829-Q833 PolarHBondContact O-N 3.05Å; A829-Q833 VanDerWaalsContact O-N 3.08Å
830	K	87.6	Confident	85.7	Confident	98 Å²	98	64.7 Å²	64.7	43%	0.426	33%	0.332	S	S	.	.	H	α-helix	trans	-66.9	-39	173.9	-174.5	178.1	177.1	-175.8	0	112.2	S826 L827 M828 D832 Q833 E834	S826-K830 PolarHBondContact O-N 3.32Å; L827-K830 PolarHBondContact O-N 2.8Å; M828-K830 VanDerWaalsContact C-N 3.3Å; M828-K830 PolarHBondContact O-N 2.92Å; K830-D832 VanDerWaalsContact C-N 3.35Å; K830-Q833 PolarHBondContact O-N 2.89Å; K830-E834 VanDerWaalsContact CE-OE1 3.32Å; K830-E834 WeakPolarHBondContact CE-OE1 3.24Å; K830-E834 WeakPolarHBondContact O-CG 3.35Å; K830-E834 PolarHBondContact O-N 3.21Å
831	T	88.8	Confident	87.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-39.8	175.9	-50.3	0	0	0	0	110.7	L115 R118 N119 L827 M828 Q833 E834 I835	L115-T831 HydrophobicContact CB-CG2 4.38Å; L115-T831 HydrophobicContact CD2-CG2 4.19Å; L115-T831 WeakPolarHBondContact O-CG2 3.43Å; R118-T831 HydrophobicContact CB-CG2 4.28Å; R118-T831 HydrophobicContact CG-CG2 3.99Å; R118-T831 PolarHBondContact NE-OG1 3Å; R118-T831 PolarHBondContact NH2-OG1 2.84Å; N119-T831 VanDerWaalsContact OD1-CB 3.28Å; N119-T831 WeakPolarHBondContact OD1-CB 3.41Å; N119-T831 WeakPolarHBondContact OD1-CG2 3.35Å; L827-T831 WeakPolarHBondContact O-CB 3.44Å; L827-T831 PolarHBondContact O-N 2.76Å; L827-T831 PolarHBondContact O-OG1 3.4Å; M828-T831 CarbonylContact O-C 3.54Å; M828-T831 WeakPolarHBondContact O-CA 3.42Å; M828-T831 WeakPolarHBondContact O-CB 3.28Å; M828-T831 PolarHBondContact O-N 3.47Å; T831-Q833 VanDerWaalsContact C-N 3.34Å; T831-Q833 PolarHBondContact O-N 3.48Å; T831-E834 PolarHBondContact O-N 3.15Å; T831-I835 HydrophobicContact CG2-CD1 4.39Å; T831-I835 VanDerWaalsContact O-CG1 3.29Å; T831-I835 WeakPolarHBondContact O-CG1 3.45Å; T831-I835 PolarHBondContact O-N 3.45Å
832	D	91.3	Very high	88.1	Confident	86 Å²	86	61.2 Å²	61.2	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-61	-42.3	173.7	-69.3	-34.5	0	0	0	111.8	N119 M828 A829 K830 I835 E836	N119-D832 PolarHBondContact ND2-OD1 3.37Å; M828-D832 PolarHBondContact O-N 3.27Å; A829-D832 PolarHBondContact O-N 3.4Å; K830-D832 VanDerWaalsContact C-N 3.35Å; D832-I835 WeakPolarHBondContact O-CB 3.43Å; D832-I835 PolarHBondContact O-N 3.41Å; D832-E836 PolarHBondContact O-N 3.4Å
833	Q	92.3	Very high	88.6	Confident	117 Å²	117	59.4 Å²	59.4	55%	0.547	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-44.6	173.8	-174.3	-172.9	-17	0	0	111.8	A829 K830 T831 I835 E836 E837	A829-Q833 PolarHBondContact O-N 3.05Å; A829-Q833 VanDerWaalsContact O-N 3.08Å; K830-Q833 PolarHBondContact O-N 2.89Å; T831-Q833 VanDerWaalsContact C-N 3.34Å; T831-Q833 PolarHBondContact O-N 3.48Å; Q833-I835 VanDerWaalsContact C-N 3.29Å; Q833-I835 PolarHBondContact O-N 2.99Å; Q833-E836 PolarHBondContact O-N 3.37Å; Q833-E837 PolarHBondContact NE2-OE1 2.69Å; Q833-E837 WeakPolarHBondContact O-CG 3.25Å; Q833-E837 PolarHBondContact O-N 3.22Å
834	E	90.9	Very high	89.1	Confident	42 Å²	42	62.1 Å²	62.1	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-38.1	175.9	-72.7	166.9	-170.8	0	0	111.3	L115 R118 K830 T831 M838	L115-E834 HydrophobicContact CD1-CB 4.02Å; L115-E834 HydrophobicContact CD2-CB 4.13Å; L115-E834 WeakPolarHBondContact CD2-OE2 3.17Å; R118-E834 IonicContact CZ-OE2 2.87Å; R118-E834 IonicContact NH1-OE1 2.75Å; R118-E834 IonicContact NH1-OE2 3.27Å; R118-E834 PolarHBondContact NH1-OE2 3.19Å; R118-E834 IonicContact NH2-OE2 3.21Å; K830-E834 VanDerWaalsContact CE-OE1 3.32Å; K830-E834 WeakPolarHBondContact CE-OE1 3.24Å; K830-E834 WeakPolarHBondContact O-CG 3.35Å; K830-E834 PolarHBondContact O-N 3.21Å; T831-E834 PolarHBondContact O-N 3.15Å; E834-M838 WeakPolarHBondContact O-CB 3.15Å; E834-M838 WeakPolarHBondContact O-CG 3.29Å; E834-M838 PolarHBondContact O-N 3.28Å
835	I	92.6	Very high	89.5	Confident	21 Å²	21	62.5 Å²	62.5	11%	0.108	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-45	174.6	-71.6	169.3	0	0	0	110.9	L112 L115 R116 N119 T831 D832 Q833 M838 N839	L112-I835 HydrophobicContact CD2-CG2 4.18Å; L115-I835 HydrophobicContact CB-CD1 4.17Å; L115-I835 HydrophobicContact CB-CG1 3.54Å; L115-I835 HydrophobicContact CD1-CG1 4.2Å; L115-I835 HydrophobicContact CG-CG1 4.48Å; R116-I835 HydrophobicContact CG-CD1 4.35Å; N119-I835 VanDerWaalsContact ND2-CD1 3.25Å; N119-I835 WeakPolarHBondContact ND2-CD1 3.48Å; T831-I835 HydrophobicContact CG2-CD1 4.39Å; T831-I835 VanDerWaalsContact O-CG1 3.29Å; T831-I835 WeakPolarHBondContact O-CG1 3.45Å; T831-I835 PolarHBondContact O-N 3.45Å; D832-I835 WeakPolarHBondContact O-CB 3.43Å; D832-I835 PolarHBondContact O-N 3.41Å; Q833-I835 VanDerWaalsContact C-N 3.29Å; Q833-I835 PolarHBondContact O-N 2.99Å; I835-M838 PolarHBondContact O-N 3.46Å; I835-N839 WeakPolarHBondContact O-CB 3.45Å; I835-N839 PolarHBondContact O-N 2.98Å; I835-N839 PolarHBondContact O-ND2 3.25Å
836	E	93	Very high	89.5	Confident	114 Å²	114	63 Å²	63	53%	0.533	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-45.5	179	-171.8	58.6	-157.5	0	0	111.5	D832 Q833 M838 N839 I840	D832-E836 PolarHBondContact O-N 3.4Å; Q833-E836 PolarHBondContact O-N 3.37Å; E836-M838 VanDerWaalsContact C-N 3.31Å; E836-M838 PolarHBondContact O-N 2.89Å; E836-N839 PolarHBondContact O-N 2.66Å; E836-I840 WeakPolarHBondContact O-CG1 3.25Å; E836-I840 PolarHBondContact O-N 3.42Å
837	E	92.9	Very high	89.6	Confident	88 Å²	88	64 Å²	64	41%	0.411	32%	0.319	S	S	.	.	H	α-helix	trans	-60.6	-39.8	175.1	-71	176.7	-164.9	0	0	112.2	Q833 I840 K841	Q833-E837 PolarHBondContact NE2-OE1 2.69Å; Q833-E837 WeakPolarHBondContact O-CG 3.25Å; Q833-E837 PolarHBondContact O-N 3.22Å; E837-I840 PolarHBondContact O-N 3.03Å; E837-K841 WeakPolarHBondContact O-CG 3.3Å; E837-K841 PolarHBondContact O-N 3.39Å; E837-K841 VanDerWaalsContact O-N 3.07Å
838	M	92.1	Very high	89.8	Confident	28 Å²	28	71.2 Å²	71.2	14%	0.138	35%	0.345	C	S	.	.	H	α-helix	trans	-72.3	-33.5	176.7	-71.3	-59.8	-59.7	0	0	112.8	I108 E111 L112 L115 E834 I835 E836 K841 R842	I108-M838 HydrophobicContact CB-CE 4.12Å; I108-M838 HydrophobicContact CG1-CE 3.96Å; I108-M838 HydrophobicContact CG2-CE 3.83Å; E111-M838 HydrophobicContact CB-CE 3.84Å; E111-M838 HydrophobicContact CG-CE 4Å; L112-M838 HydrophobicContact CD2-CB 3.51Å; L112-M838 HydrophobicContact CG-CB 3.86Å; L115-M838 HydrophobicContact CD1-CB 4.3Å; L115-M838 HydrophobicContact CD1-CG 3.73Å; E834-M838 WeakPolarHBondContact O-CB 3.15Å; E834-M838 WeakPolarHBondContact O-CG 3.29Å; E834-M838 PolarHBondContact O-N 3.28Å; I835-M838 PolarHBondContact O-N 3.46Å; E836-M838 VanDerWaalsContact C-N 3.31Å; E836-M838 PolarHBondContact O-N 2.89Å; M838-K841 PolarHBondContact O-N 3.21Å; M838-K841 HydrophobicContact SD-CD 3.92Å; M838-R842 WeakPolarHBondContact O-CB 3.32Å; M838-R842 PolarHBondContact O-N 3Å
839	N	91.6	Very high	89.8	Confident	27 Å²	27	71.5 Å²	71.5	14%	0.144	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-43.9	171.5	-78.6	-41.1	0	0	0	110.7	I835 E836 K841 R842 D843	I835-N839 WeakPolarHBondContact O-CB 3.45Å; I835-N839 PolarHBondContact O-N 2.98Å; I835-N839 PolarHBondContact O-ND2 3.25Å; E836-N839 PolarHBondContact O-N 2.66Å; N839-K841 VanDerWaalsContact C-N 3.35Å; N839-K841 PolarHBondContact O-N 3.08Å; N839-R842 WeakPolarHBondContact O-CB 3.46Å; N839-R842 PolarHBondContact O-N 3.04Å; N839-R842 PolarHBondContact OD1-NH1 3.03Å; N839-D843 VanDerWaalsContact O-CG 3.24Å; N839-D843 PolarHBondContact O-N 2.96Å
840	I	92.7	Very high	89.5	Confident	84 Å²	84	70.6 Å²	70.6	43%	0.431	34%	0.336	S	S	.	.	H	α-helix	trans	-59.9	-45.4	175.2	-66	166	0	0	0	110.7	E836 E837 R842 D843 Q844	E836-I840 WeakPolarHBondContact O-CG1 3.25Å; E836-I840 PolarHBondContact O-N 3.42Å; E837-I840 PolarHBondContact O-N 3.03Å; I840-R842 VanDerWaalsContact C-N 3.35Å; I840-R842 PolarHBondContact O-N 3.2Å; I840-D843 PolarHBondContact O-N 3.41Å; I840-Q844 WeakPolarHBondContact O-CG 3.36Å; I840-Q844 PolarHBondContact O-N 2.89Å
841	K	92.7	Very high	89.5	Confident	104 Å²	104	71.1 Å²	71.1	45%	0.452	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-39.8	175.5	-73.6	176.2	-174.9	169.4	0	112.2	I108 E837 M838 N839 Q844 S845	I108-K841 HydrophobicContact CD1-CB 4.24Å; E837-K841 WeakPolarHBondContact O-CG 3.3Å; E837-K841 PolarHBondContact O-N 3.39Å; E837-K841 VanDerWaalsContact O-N 3.07Å; M838-K841 PolarHBondContact O-N 3.21Å; M838-K841 HydrophobicContact SD-CD 3.92Å; N839-K841 VanDerWaalsContact C-N 3.35Å; N839-K841 PolarHBondContact O-N 3.08Å; K841-Q844 PolarHBondContact O-N 3.07Å; K841-S845 PolarHBondContact O-N 3.33Å; K841-S845 PolarHBondContact O-OG 3.47Å
842	R	89.6	Confident	89.5	Confident	52 Å²	52	71.6 Å²	71.6	20%	0.196	34%	0.344	C	S	.	.	H	α-helix	trans	-58.7	-50.1	175.7	-171.6	-163.5	60.6	-139.8	-8.5	110.1	I108 L112 M838 N839 I840 Q844 S845 I846	I108-R842 HydrophobicContact CG2-CB 3.51Å; I108-R842 HydrophobicContact CG2-CG 4Å; L112-R842 HydrophobicContact CD1-CB 4.13Å; L112-R842 HydrophobicContact CD1-CG 4.37Å; M838-R842 WeakPolarHBondContact O-CB 3.32Å; M838-R842 PolarHBondContact O-N 3Å; N839-R842 WeakPolarHBondContact O-CB 3.46Å; N839-R842 PolarHBondContact O-N 3.04Å; N839-R842 PolarHBondContact OD1-NH1 3.03Å; I840-R842 VanDerWaalsContact C-N 3.35Å; I840-R842 PolarHBondContact O-N 3.2Å; R842-Q844 VanDerWaalsContact C-N 3.29Å; R842-Q844 PolarHBondContact O-N 2.95Å; R842-S845 CarbonylContact O-C 3.54Å; R842-S845 PolarHBondContact O-N 2.96Å; R842-S845 VanDerWaalsContact O-N 3.08Å; R842-I846 HydrophobicContact CG-CD1 3.89Å; R842-I846 HydrophobicContact CG-CG1 4.41Å; R842-I846 VanDerWaalsContact O-CG1 3.31Å; R842-I846 WeakPolarHBondContact O-CG1 3.41Å; R842-I846 PolarHBondContact O-N 2.96Å
843	D	86.9	Confident	89.1	Confident	86 Å²	86	69.3 Å²	69.3	46%	0.46	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-35.9	-176.8	-63.6	-12.4	0	0	0	111.3	N839 I840 L847	N839-D843 VanDerWaalsContact O-CG 3.24Å; N839-D843 PolarHBondContact O-N 2.96Å; I840-D843 PolarHBondContact O-N 3.41Å; D843-L847 PolarHBondContact O-N 3.42Å; D843-L847 VanDerWaalsContact O-N 3.09Å
844	Q	90.1	Very high	88.7	Confident	105 Å²	105	70.2 Å²	70.2	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-41.4	170.5	-70.5	175.8	4.1	0	0	113	I840 K841 R842 L847 R848	I840-Q844 WeakPolarHBondContact O-CG 3.36Å; I840-Q844 PolarHBondContact O-N 2.89Å; K841-Q844 PolarHBondContact O-N 3.07Å; R842-Q844 VanDerWaalsContact C-N 3.29Å; R842-Q844 PolarHBondContact O-N 2.95Å; Q844-L847 WeakPolarHBondContact O-CB 3.37Å; Q844-L847 PolarHBondContact O-N 3.45Å; Q844-R848 WeakPolarHBondContact O-CG 3.22Å; Q844-R848 PolarHBondContact O-N 2.89Å
845	S	89	Confident	88.5	Confident	11 Å²	11	70.1 Å²	70.1	8%	0.077	34%	0.337	C	S	.	.	H	α-helix	trans	-68.5	-36	176.8	-69.4	0	0	0	0	112.3	I108 K841 R842 L847 R848 F849	I108-S845 WeakPolarHBondContact CD1-OG 3.29Å; K841-S845 PolarHBondContact O-N 3.33Å; K841-S845 PolarHBondContact O-OG 3.47Å; R842-S845 CarbonylContact O-C 3.54Å; R842-S845 PolarHBondContact O-N 2.96Å; R842-S845 VanDerWaalsContact O-N 3.08Å; S845-L847 VanDerWaalsContact C-N 3.32Å; S845-L847 PolarHBondContact O-N 2.98Å; S845-R848 PolarHBondContact O-N 2.83Å; S845-F849 WeakPolarHBondContact O-CB 2.99Å; S845-F849 PolarHBondContact O-N 2.82Å
846	I	84.7	Confident	88.2	Confident	73 Å²	73	69.1 Å²	69.1	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-43	171.4	-70	167.2	0	0	0	110.5	I105 R842 F849 S850	I105-I846 HydrophobicContact CD1-CG1 4Å; I105-I846 HydrophobicContact CG1-CG1 4.29Å; R842-I846 HydrophobicContact CG-CD1 3.89Å; R842-I846 HydrophobicContact CG-CG1 4.41Å; R842-I846 VanDerWaalsContact O-CG1 3.31Å; R842-I846 WeakPolarHBondContact O-CG1 3.41Å; R842-I846 PolarHBondContact O-N 2.96Å; I846-F849 PolarHBondContact O-N 3.37Å; I846-S850 PolarHBondContact O-N 3.49Å
847	L	85.4	Confident	87.7	Confident	101 Å²	101	65.4 Å²	65.4	53%	0.529	32%	0.316	S	S	.	.	H	α-helix	trans	-61.6	-48.1	175.4	-174.6	66.2	0	0	0	111.4	D843 Q844 S845 F849 S850 E851	D843-L847 PolarHBondContact O-N 3.42Å; D843-L847 VanDerWaalsContact O-N 3.09Å; Q844-L847 WeakPolarHBondContact O-CB 3.37Å; Q844-L847 PolarHBondContact O-N 3.45Å; S845-L847 VanDerWaalsContact C-N 3.32Å; S845-L847 PolarHBondContact O-N 2.98Å; L847-F849 VanDerWaalsContact C-N 3.32Å; L847-F849 PolarHBondContact O-N 3.35Å; L847-S850 WeakPolarHBondContact O-CB 3.1Å; L847-S850 PolarHBondContact O-N 3.34Å; L847-S850 VanDerWaalsContact O-N 3.12Å; L847-S850 PolarHBondContact O-OG 2.87Å; L847-E851 WeakPolarHBondContact O-CG 3.43Å; L847-E851 PolarHBondContact O-N 2.91Å
848	R	87.5	Confident	87.5	Confident	159 Å²	159	65.9 Å²	65.9	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-60.2	-39.7	176.9	-71.1	176.9	-179.5	173.1	1.8	112.8	Q844 S845 E851 A852	Q844-R848 WeakPolarHBondContact O-CG 3.22Å; Q844-R848 PolarHBondContact O-N 2.89Å; S845-R848 PolarHBondContact O-N 2.83Å; R848-E851 PolarHBondContact O-N 3.36Å; R848-A852 WeakPolarHBondContact O-CB 3.49Å; R848-A852 PolarHBondContact O-N 3.49Å
849	F	85.5	Confident	87.3	Confident	48 Å²	48	69.1 Å²	69.1	21%	0.211	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-43.7	174.6	176.5	-105.8	0	0	0	111.2	V98 A101 E102 I105 S845 I846 L847 E851 A852 I853	V98-F849 HydrophobicContact CG1-CD2 4.16Å; V98-F849 HydrophobicContact CG1-CE2 3.62Å; V98-F849 HydrophobicContact CG1-CZ 4.45Å; A101-F849 HydrophobicContact CB-CB 3.92Å; A101-F849 HydrophobicContact CB-CD2 4.14Å; E102-F849 HydrophobicContact CB-CD2 4.01Å; E102-F849 HydrophobicContact CB-CE2 3.69Å; E102-F849 HydrophobicContact CG-CE2 4.15Å; I105-F849 HydrophobicContact CD1-CB 3.5Å; I105-F849 HydrophobicContact CD1-CD1 4.16Å; I105-F849 HydrophobicContact CD1-CD2 4.38Å; I105-F849 HydrophobicContact CD1-CG 3.78Å; S845-F849 WeakPolarHBondContact O-CB 2.99Å; S845-F849 PolarHBondContact O-N 2.82Å; I846-F849 PolarHBondContact O-N 3.37Å; L847-F849 VanDerWaalsContact C-N 3.32Å; L847-F849 PolarHBondContact O-N 3.35Å; F849-E851 VanDerWaalsContact C-N 3.32Å; F849-E851 PolarHBondContact O-N 3.28Å; F849-A852 PolarHBondContact O-N 3.06Å; F849-I853 HydrophobicContact CD1-CD1 3.76Å; F849-I853 HydrophobicContact CD2-CD1 4.49Å; F849-I853 HydrophobicContact CE1-CD1 3.28Å; F849-I853 HydrophobicContact CE1-CG1 4.38Å; F849-I853 HydrophobicContact CE2-CD1 4.07Å; F849-I853 HydrophobicContact CE2-CG1 4.42Å; F849-I853 HydrophobicContact CG-CD1 4.35Å; F849-I853 HydrophobicContact CZ-CD1 3.47Å; F849-I853 VanDerWaalsContact CZ-CD1 3.47Å; F849-I853 HydrophobicContact CZ-CG1 4.27Å; F849-I853 WeakPolarHBondContact O-CG1 3.23Å; F849-I853 PolarHBondContact O-N 2.99Å
850	S	81.9	Confident	87	Confident	38 Å²	38	68 Å²	68	27%	0.266	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-36.3	176	82.7	0	0	0	0	113	I846 L847 K854	I846-S850 PolarHBondContact O-N 3.49Å; L847-S850 WeakPolarHBondContact O-CB 3.1Å; L847-S850 PolarHBondContact O-N 3.34Å; L847-S850 VanDerWaalsContact O-N 3.12Å; L847-S850 PolarHBondContact O-OG 2.87Å; S850-K854 WeakPolarHBondContact O-CG 3.49Å; S850-K854 PolarHBondContact O-N 3.06Å
851	E	88.8	Confident	86.6	Confident	110 Å²	110	68 Å²	68	51%	0.514	33%	0.331	S	S	.	.	H	α-helix	trans	-70.7	-41.4	175.1	-70.7	173.6	173.3	0	0	111.7	L847 R848 F849 K854 S855	L847-E851 WeakPolarHBondContact O-CG 3.43Å; L847-E851 PolarHBondContact O-N 2.91Å; R848-E851 PolarHBondContact O-N 3.36Å; F849-E851 VanDerWaalsContact C-N 3.32Å; F849-E851 PolarHBondContact O-N 3.28Å; E851-K854 PolarHBondContact O-N 2.89Å; E851-S855 PolarHBondContact O-N 3.34Å
852	A	87.3	Confident	86.4	Confident	10 Å²	10	65.5 Å²	65.5	8%	0.083	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-42.7	176	0	0	0	0	0	111.4	K97 V98 R848 F849 S855 A856	K97-A852 HydrophobicContact CB-CB 4.32Å; V98-A852 HydrophobicContact CB-CB 4.39Å; V98-A852 HydrophobicContact CG2-CB 3.7Å; V98-A852 WeakPolarHBondContact CG2-O 3.1Å; R848-A852 WeakPolarHBondContact O-CB 3.49Å; R848-A852 PolarHBondContact O-N 3.49Å; F849-A852 PolarHBondContact O-N 3.06Å; A852-S855 PolarHBondContact O-N 3.12Å; A852-S855 PolarHBondContact O-OG 3.22Å; A852-A856 PolarHBondContact O-N 3.04Å
853	I	82.7	Confident	86.1	Confident	37 Å²	37	63 Å²	63	19%	0.19	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-49.4	175.4	-72.1	168.4	0	0	0	110.4	V98 F849 S855 A856 D857	V98-I853 HydrophobicContact CG1-CG1 4.03Å; V98-I853 HydrophobicContact CG2-CG1 4.14Å; F849-I853 HydrophobicContact CD1-CD1 3.76Å; F849-I853 HydrophobicContact CD2-CD1 4.49Å; F849-I853 HydrophobicContact CE1-CD1 3.28Å; F849-I853 HydrophobicContact CE1-CG1 4.38Å; F849-I853 HydrophobicContact CE2-CD1 4.07Å; F849-I853 HydrophobicContact CE2-CG1 4.42Å; F849-I853 HydrophobicContact CG-CD1 4.35Å; F849-I853 HydrophobicContact CZ-CD1 3.47Å; F849-I853 VanDerWaalsContact CZ-CD1 3.47Å; F849-I853 HydrophobicContact CZ-CG1 4.27Å; F849-I853 WeakPolarHBondContact O-CG1 3.23Å; F849-I853 PolarHBondContact O-N 2.99Å; I853-S855 PolarHBondContact O-N 3.44Å; I853-A856 PolarHBondContact O-N 2.91Å; I853-D857 PolarHBondContact O-N 3.04Å
854	K	84.9	Confident	85.9	Confident	137 Å²	137	62.7 Å²	62.7	60%	0.596	31%	0.309	S	S	*	.	H	α-helix	trans	-57.4	-39.7	177.2	-71.9	170.6	-175.3	172.6	0	111.8	S850 E851 V858	S850-K854 WeakPolarHBondContact O-CG 3.49Å; S850-K854 PolarHBondContact O-N 3.06Å; E851-K854 PolarHBondContact O-N 2.89Å; K854-V858 WeakPolarHBondContact O-CG2 3.01Å; K854-V858 PolarHBondContact O-N 3.12Å
855	S	87	Confident	85.7	Confident	39 Å²	39	59.9 Å²	59.9	27%	0.273	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-40.9	176.1	78.9	0	0	0	0	112	E851 A852 I853 V858 Y859	E851-S855 PolarHBondContact O-N 3.34Å; A852-S855 PolarHBondContact O-N 3.12Å; A852-S855 PolarHBondContact O-OG 3.22Å; I853-S855 PolarHBondContact O-N 3.44Å; S855-V858 PolarHBondContact O-N 2.81Å; S855-Y859 WeakPolarHBondContact O-CD2 3.31Å; S855-Y859 PolarHBondContact O-N 3.23Å
856	A	85.9	Confident	85.5	Confident	1 Å²	1	61 Å²	61	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-37.4	178	0	0	0	0	0	112.4	Y91 S94 V95 V98 A852 I853 V858 Y859 L860	Y91-A856 WeakPolarHBondContact CD2-O 3.45Å; Y91-A856 HydrophobicContact CE2-CB 4.35Å; Y91-A856 WeakPolarHBondContact CE2-O 3.16Å; S94-A856 VanDerWaalsContact OG-CA 3.24Å; S94-A856 WeakPolarHBondContact OG-CA 3.43Å; S94-A856 WeakPolarHBondContact OG-CB 3.47Å; V95-A856 HydrophobicContact CG2-CB 4.17Å; V98-A856 HydrophobicContact CG2-CB 4.05Å; A852-A856 PolarHBondContact O-N 3.04Å; I853-A856 PolarHBondContact O-N 2.91Å; A856-V858 VanDerWaalsContact C-N 3.34Å; A856-V858 PolarHBondContact O-N 2.93Å; A856-Y859 PolarHBondContact O-N 3.34Å; A856-L860 WeakPolarHBondContact O-CB 3.29Å; A856-L860 PolarHBondContact O-N 3.45Å
857	D	82.1	Confident	85.2	Confident	35 Å²	35	57.9 Å²	57.9	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-43.3	173.9	-78	-23.3	0	0	0	112.1	I853 Y859 L860 D861	I853-D857 PolarHBondContact O-N 3.04Å; D857-Y859 VanDerWaalsContact C-N 3.34Å; D857-Y859 PolarHBondContact O-N 3.22Å; D857-L860 WeakPolarHBondContact O-CB 3.38Å; D857-L860 PolarHBondContact O-N 3.12Å; D857-D861 PolarHBondContact O-N 3.35Å
858	V	88.6	Confident	85	Confident	99 Å²	99	56.1 Å²	56.1	60%	0.6	29%	0.288	S	S	*	.	H	α-helix	trans	-61.3	-43.4	178	172.5	0	0	0	0	111.2	K854 S855 A856 D861 S862	K854-V858 WeakPolarHBondContact O-CG2 3.01Å; K854-V858 PolarHBondContact O-N 3.12Å; S855-V858 PolarHBondContact O-N 2.81Å; A856-V858 VanDerWaalsContact C-N 3.34Å; A856-V858 PolarHBondContact O-N 2.93Å; V858-D861 PolarHBondContact O-N 3.22Å; V858-S862 PolarHBondContact O-N 3.3Å
859	Y	88.7	Confident	84.6	Confident	96 Å²	96	51.1 Å²	51.1	38%	0.376	27%	0.274	S	S	.	.	H	α-helix	trans	-73	-32.4	177.6	-67.5	-65.3	0	0	0	112.8	A90 S855 A856 D857 D861 S862 V863	A90-Y859 HydrophobicContact CB-CD1 3.44Å; A90-Y859 VanDerWaalsContact CB-CD1 3.44Å; A90-Y859 HydrophobicContact CB-CE1 3.53Å; A90-Y859 HydrophobicContact CB-CG 4.1Å; S855-Y859 WeakPolarHBondContact O-CD2 3.31Å; S855-Y859 PolarHBondContact O-N 3.23Å; A856-Y859 PolarHBondContact O-N 3.34Å; D857-Y859 VanDerWaalsContact C-N 3.34Å; D857-Y859 PolarHBondContact O-N 3.22Å; Y859-D861 VanDerWaalsContact C-N 3.32Å; Y859-D861 PolarHBondContact O-N 3.4Å; Y859-S862 VanDerWaalsContact O-CB 3.32Å; Y859-S862 WeakPolarHBondContact O-CB 3.48Å; Y859-S862 PolarHBondContact O-N 3.03Å; Y859-V863 WeakPolarHBondContact O-CG2 3.41Å; Y859-V863 PolarHBondContact O-N 3.35Å
860	L	84.3	Confident	84.1	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-40.9	173	-176.4	63.9	0	0	0	111.7	Y91 A856 D857 S862 V863 R864 G917	Y91-L860 HydrophobicContact CD2-CB 3.96Å; Y91-L860 HydrophobicContact CD2-CD1 4.48Å; Y91-L860 HydrophobicContact CE1-CD1 4.15Å; Y91-L860 HydrophobicContact CE2-CB 3.64Å; Y91-L860 HydrophobicContact CE2-CD1 3.91Å; Y91-L860 HydrophobicContact CE2-CG 4.28Å; A856-L860 WeakPolarHBondContact O-CB 3.29Å; A856-L860 PolarHBondContact O-N 3.45Å; D857-L860 WeakPolarHBondContact O-CB 3.38Å; D857-L860 PolarHBondContact O-N 3.12Å; L860-S862 VanDerWaalsContact C-N 3.31Å; L860-V863 PolarHBondContact O-N 3.41Å; L860-R864 WeakPolarHBondContact O-CB 3.49Å; L860-R864 PolarHBondContact O-N 3.06Å; L860-G917 VanDerWaalsContact CD2-CA 3.5Å
861	D	85.8	Confident	83.7	Confident	83 Å²	83	51.3 Å²	51.3	44%	0.444	27%	0.27	S	S	.	.	H	α-helix	trans	-65.6	-35.7	175	-75.3	-22.3	0	0	0	111.3	D857 V858 Y859 R864 A865	D857-D861 PolarHBondContact O-N 3.35Å; V858-D861 PolarHBondContact O-N 3.22Å; Y859-D861 VanDerWaalsContact C-N 3.32Å; Y859-D861 PolarHBondContact O-N 3.4Å; D861-R864 PolarHBondContact O-N 2.95Å; D861-R864 IonicContact OD1-CZ 2.66Å; D861-R864 IonicContact OD1-NH1 3.68Å; D861-R864 PolarHBondContact OD1-NH1 2.91Å; D861-R864 IonicContact OD1-NH2 3.22Å; D861-R864 PolarHBondContact OD1-NH2 3.09Å; D861-R864 VanDerWaalsContact OD1-NH2 3.14Å; D861-A865 PolarHBondContact O-N 3.36Å
862	S	86.9	Confident	83.2	Confident	51 Å²	51	51.7 Å²	51.7	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-45.7	171.2	-167.7	0	0	0	0	112.2	V858 Y859 L860 R864 A865 E866	V858-S862 PolarHBondContact O-N 3.3Å; Y859-S862 VanDerWaalsContact O-CB 3.32Å; Y859-S862 WeakPolarHBondContact O-CB 3.48Å; Y859-S862 PolarHBondContact O-N 3.03Å; L860-S862 VanDerWaalsContact C-N 3.31Å; S862-R864 VanDerWaalsContact C-N 3.3Å; S862-R864 PolarHBondContact O-N 3.19Å; S862-A865 WeakPolarHBondContact O-CB 3.34Å; S862-A865 PolarHBondContact O-N 3.45Å; S862-E866 PolarHBondContact O-N 3.14Å
863	V	84.1	Confident	82.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-41.7	175.5	169	0	0	0	0	110.7	A87 L88 Y91 Y859 L860 A865 E866 F867	A87-V863 HydrophobicContact CB-CG2 3.94Å; A87-V863 WeakPolarHBondContact O-CG2 3.22Å; L88-V863 HydrophobicContact CD2-CG1 3.76Å; L88-V863 HydrophobicContact CD2-CG2 3.99Å; L88-V863 HydrophobicContact CG-CG2 4.32Å; Y91-V863 HydrophobicContact CG-CG2 4.38Å; Y859-V863 WeakPolarHBondContact O-CG2 3.41Å; Y859-V863 PolarHBondContact O-N 3.35Å; L860-V863 PolarHBondContact O-N 3.41Å; V863-A865 VanDerWaalsContact C-N 3.34Å; V863-A865 PolarHBondContact O-N 3.47Å; V863-E866 PolarHBondContact O-N 3.43Å; V863-F867 HydrophobicContact CG1-CD2 3.53Å; V863-F867 HydrophobicContact CG1-CE2 3.46Å; V863-F867 VanDerWaalsContact CG1-CE2 3.46Å; V863-F867 VanDerWaalsContact O-CD2 3.26Å; V863-F867 WeakPolarHBondContact O-CD2 3.24Å; V863-F867 PolarHBondContact O-N 3.33Å
864	R	82.8	Confident	81.9	Confident	79 Å²	79	51.4 Å²	51.4	30%	0.298	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-39.9	176.3	-169	-173.7	-57.6	131.9	14.7	112.1	L860 D861 S862 S868 V914	L860-R864 WeakPolarHBondContact O-CB 3.49Å; L860-R864 PolarHBondContact O-N 3.06Å; D861-R864 PolarHBondContact O-N 2.95Å; D861-R864 IonicContact OD1-CZ 2.66Å; D861-R864 IonicContact OD1-NH1 3.68Å; D861-R864 PolarHBondContact OD1-NH1 2.91Å; D861-R864 IonicContact OD1-NH2 3.22Å; D861-R864 PolarHBondContact OD1-NH2 3.09Å; D861-R864 VanDerWaalsContact OD1-NH2 3.14Å; S862-R864 VanDerWaalsContact C-N 3.3Å; S862-R864 PolarHBondContact O-N 3.19Å; R864-S868 WeakPolarHBondContact O-CB 3.32Å; R864-S868 PolarHBondContact O-N 3.34Å; R864-S868 PolarHBondContact O-OG 3.22Å; R864-V914 HydrophobicContact CB-CG2 4.34Å; R864-V914 HydrophobicContact CG-CG1 4.44Å; R864-V914 HydrophobicContact CG-CG2 4.49Å
865	A	86.2	Confident	81.3	Confident	47 Å²	47	47.8 Å²	47.8	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-63	-47.2	176.5	0	0	0	0	0	111.1	D861 S862 V863 F867 S868 N869	D861-A865 PolarHBondContact O-N 3.36Å; S862-A865 WeakPolarHBondContact O-CB 3.34Å; S862-A865 PolarHBondContact O-N 3.45Å; V863-A865 VanDerWaalsContact C-N 3.34Å; V863-A865 PolarHBondContact O-N 3.47Å; A865-F867 PolarHBondContact O-N 2.67Å; A865-S868 WeakPolarHBondContact O-CB 3.39Å; A865-S868 PolarHBondContact O-N 2.91Å; A865-N869 PolarHBondContact O-N 3.1Å; A865-N869 VanDerWaalsContact O-N 3.07Å; A865-N869 PolarHBondContact O-ND2 3.3Å
866	E	84	Confident	80.6	Confident	33 Å²	33	50.4 Å²	50.4	15%	0.154	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-38.8	178	-66	-57.1	156	0	0	112.5	L84 A87 S862 V863 S868 N869 F870	L84-E866 HydrophobicContact CB-CB 4.39Å; L84-E866 HydrophobicContact CD1-CB 3.81Å; A87-E866 HydrophobicContact CB-CG 4.19Å; S862-E866 PolarHBondContact O-N 3.14Å; V863-E866 PolarHBondContact O-N 3.43Å; E866-S868 PolarHBondContact O-N 3.23Å; E866-N869 WeakPolarHBondContact O-CB 3.37Å; E866-N869 PolarHBondContact O-N 3.46Å; E866-F870 PolarHBondContact O-N 3.19Å
867	F	78.7	Confident	79.8	Confident	8 Å²	8	51.4 Å²	51.4	4%	0.035	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-34.1	173.6	-82.9	-58.6	0	0	0	113.5	L84 L88 V863 A865 N869 F870 F871 A910	L84-F867 HydrophobicContact CD1-CD1 4.19Å; L84-F867 HydrophobicContact CD1-CD2 4.07Å; L84-F867 HydrophobicContact CD1-CE1 4Å; L84-F867 HydrophobicContact CD1-CE2 3.91Å; L84-F867 HydrophobicContact CD1-CG 4.22Å; L84-F867 HydrophobicContact CD1-CZ 3.86Å; L84-F867 HydrophobicContact CD2-CD1 4.33Å; L84-F867 HydrophobicContact CD2-CE1 3.79Å; L84-F867 HydrophobicContact CD2-CZ 4.17Å; L88-F867 HydrophobicContact CD2-CE2 4.39Å; V863-F867 HydrophobicContact CG1-CD2 3.53Å; V863-F867 HydrophobicContact CG1-CE2 3.46Å; V863-F867 VanDerWaalsContact CG1-CE2 3.46Å; V863-F867 VanDerWaalsContact O-CD2 3.26Å; V863-F867 WeakPolarHBondContact O-CD2 3.24Å; V863-F867 PolarHBondContact O-N 3.33Å; A865-F867 PolarHBondContact O-N 2.67Å; F867-N869 VanDerWaalsContact C-N 3.33Å; F867-F870 WeakPolarHBondContact O-CB 3.49Å; F867-F870 PolarHBondContact O-N 3.35Å; F867-F871 HydrophobicContact CB-CE2 4.23Å; F867-F871 WeakPolarHBondContact O-CD2 3.46Å; F867-F871 WeakPolarHBondContact O-CG 3.47Å; F867-F871 PolarHBondContact O-N 3.31Å; F867-A910 HydrophobicContact CB-CB 4.33Å; F867-A910 HydrophobicContact CD1-CB 3.29Å; F867-A910 HydrophobicContact CD2-CB 3.59Å; F867-A910 HydrophobicContact CE1-CB 3.26Å; F867-A910 HydrophobicContact CE2-CB 3.53Å; F867-A910 HydrophobicContact CG-CB 3.48Å; F867-A910 VanDerWaalsContact CG-CB 3.48Å; F867-A910 HydrophobicContact CZ-CB 3.37Å
868	S	81	Confident	79.1	Confident	65 Å²	65	50.5 Å²	50.5	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-44	174.6	-57.2	0	0	0	0	110.5	R864 A865 E866 F870 F871 E872	R864-S868 WeakPolarHBondContact O-CB 3.32Å; R864-S868 PolarHBondContact O-N 3.34Å; R864-S868 PolarHBondContact O-OG 3.22Å; A865-S868 WeakPolarHBondContact O-CB 3.39Å; A865-S868 PolarHBondContact O-N 2.91Å; E866-S868 PolarHBondContact O-N 3.23Å; S868-F870 VanDerWaalsContact C-N 3.33Å; S868-F870 PolarHBondContact O-N 2.82Å; S868-F871 PolarHBondContact O-N 3.01Å; S868-E872 PolarHBondContact O-N 3.45Å; S868-E872 VanDerWaalsContact O-N 3.14Å
869	N	79.5	Confident	78.2	Confident	54 Å²	54	48.5 Å²	48.5	29%	0.289	26%	0.264	S	S	.	.	H	α-helix	trans	-61.5	-40.5	174	-62.8	-22.5	0	0	0	111.9	Y80 A865 E866 F867 E872 H873	Y80-N869 HydrophobicContact CE1-CB 4.26Å; A865-N869 PolarHBondContact O-N 3.1Å; A865-N869 VanDerWaalsContact O-N 3.07Å; A865-N869 PolarHBondContact O-ND2 3.3Å; E866-N869 WeakPolarHBondContact O-CB 3.37Å; E866-N869 PolarHBondContact O-N 3.46Å; F867-N869 VanDerWaalsContact C-N 3.33Å; N869-E872 PolarHBondContact O-N 2.92Å; N869-H873 PolarHBondContact O-N 3.13Å; N869-H873 PolarHBondContact O-ND1 2.99Å
870	F	74.6	Confident	77.3	Confident	14 Å²	14	45.5 Å²	45.5	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-44.4	175.6	171.6	-82.2	0	0	0	112.2	W77 E866 F867 S868 E872 H873 T874 H906	W77-F870 AromaticContact CH2-CD2 3.58Å; W77-F870 HydrophobicContact CH2-CD2 3.58Å; W77-F870 AromaticContact CH2-CE2 2.93Å; W77-F870 HydrophobicContact CH2-CE2 2.93Å; W77-F870 AromaticContact CH2-CZ 3.55Å; W77-F870 HydrophobicContact CH2-CZ 3.55Å; W77-F870 HydrophobicContact CZ2-CD2 4.01Å; W77-F870 AromaticContact CZ2-CE2 3.36Å; W77-F870 HydrophobicContact CZ2-CE2 3.36Å; W77-F870 HydrophobicContact CZ2-CZ 4.26Å; W77-F870 AromaticContact CZ3-CD2 3.96Å; W77-F870 HydrophobicContact CZ3-CD2 3.96Å; W77-F870 AromaticContact CZ3-CE2 3.72Å; W77-F870 HydrophobicContact CZ3-CE2 3.72Å; W77-F870 HydrophobicContact CZ3-CZ 4.34Å; E866-F870 PolarHBondContact O-N 3.19Å; F867-F870 WeakPolarHBondContact O-CB 3.49Å; F867-F870 PolarHBondContact O-N 3.35Å; S868-F870 VanDerWaalsContact C-N 3.33Å; S868-F870 PolarHBondContact O-N 2.82Å; F870-E872 VanDerWaalsContact C-N 3.33Å; F870-H873 PolarHBondContact O-N 3.34Å; F870-T874 VanDerWaalsContact O-CB 3.26Å; F870-T874 WeakPolarHBondContact O-CB 3.34Å; F870-T874 PolarHBondContact O-N 3.41Å; F870-T874 PolarHBondContact O-OG1 2.91Å; F870-H906 HydrophobicContact CE1-CB 4.4Å; F870-H906 HydrophobicContact CZ-CB 3.9Å
871	F	73.4	Confident	76.5	Confident	76 Å²	76	46.2 Å²	46.2	33%	0.333	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-38.3	179	-67.8	-46.8	0	0	0	112.3	F867 S868 A875 A907 A910	F867-F871 HydrophobicContact CB-CE2 4.23Å; F867-F871 WeakPolarHBondContact O-CD2 3.46Å; F867-F871 WeakPolarHBondContact O-CG 3.47Å; F867-F871 PolarHBondContact O-N 3.31Å; S868-F871 PolarHBondContact O-N 3.01Å; F871-A875 VanDerWaalsContact O-CB 3.25Å; F871-A875 WeakPolarHBondContact O-CB 3.31Å; F871-A875 PolarHBondContact O-N 3.4Å; F871-A907 HydrophobicContact CD1-CB 4.25Å; F871-A907 VanDerWaalsContact CE1-CA 3.46Å; F871-A907 HydrophobicContact CE1-CB 3.17Å; F871-A907 HydrophobicContact CZ-CB 3.61Å; F871-A910 HydrophobicContact CZ-CB 4.28Å
872	E	78.2	Confident	75.5	Confident	117 Å²	117	48 Å²	48	55%	0.547	26%	0.263	S	S	.	.	H	α-helix	trans	-61.7	-51.1	175.1	-166.5	169.7	-164.9	0	0	110.8	S868 N869 F870 T874 A875 E876	S868-E872 PolarHBondContact O-N 3.45Å; S868-E872 VanDerWaalsContact O-N 3.14Å; N869-E872 PolarHBondContact O-N 2.92Å; F870-E872 VanDerWaalsContact C-N 3.33Å; E872-T874 PolarHBondContact O-N 3.39Å; E872-A875 PolarHBondContact O-N 3.38Å; E872-E876 WeakPolarHBondContact O-CG 3.09Å; E872-E876 PolarHBondContact O-N 3.37Å
873	H	72.8	Confident	74.4	Confident	28 Å²	28	50 Å²	50	13%	0.13	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-40.5	178.6	-75.5	69	0	0	0	112.8	Y80 N869 F870 A875 E876 I877	Y80-H873 AromaticContact CE2-CD2 3.41Å; Y80-H873 VanDerWaalsContact CE2-CD2 3.41Å; Y80-H873 WeakPolarHBondContact CE2-CD2 3.44Å; Y80-H873 AromaticContact CE2-CE1 3.52Å; Y80-H873 AromaticContact CE2-CG 3.88Å; Y80-H873 AromaticContact CE2-ND1 3.91Å; Y80-H873 AromaticContact CE2-NE2 3.12Å; Y80-H873 WeakPolarHBondContact CE2-NE2 3.37Å; Y80-H873 AromaticContact CZ-CE1 3.28Å; Y80-H873 AromaticContact CZ-ND1 3.89Å; Y80-H873 AromaticContact CZ-NE2 3.3Å; Y80-H873 VanDerWaalsContact CZ-NE2 3.3Å; Y80-H873 PolarHBondContact OH-CE1 3.23Å; Y80-H873 PolarHBondContact OH-NE2 3.4Å; N869-H873 PolarHBondContact O-N 3.13Å; N869-H873 PolarHBondContact O-ND1 2.99Å; F870-H873 PolarHBondContact O-N 3.34Å; H873-A875 VanDerWaalsContact C-N 3.33Å; H873-A875 PolarHBondContact O-N 3.03Å; H873-E876 PolarHBondContact O-N 3.16Å; H873-I877 WeakPolarHBondContact O-CG1 3.37Å; H873-I877 PolarHBondContact O-N 3.44Å
874	T	70.5	Confident	73.3	Confident	14 Å²	14	52.2 Å²	52.2	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-39.8	176.9	-61.3	0	0	0	0	111.4	F870 E872 S878 C903	F870-T874 VanDerWaalsContact O-CB 3.26Å; F870-T874 WeakPolarHBondContact O-CB 3.34Å; F870-T874 PolarHBondContact O-N 3.41Å; F870-T874 PolarHBondContact O-OG1 2.91Å; E872-T874 PolarHBondContact O-N 3.39Å; T874-S878 WeakPolarHBondContact O-CB 3.42Å; T874-S878 PolarHBondContact O-N 2.86Å; T874-S878 PolarHBondContact O-OG 3.31Å; T874-C903 HydrophobicContact CG2-CB 3.64Å
875	A	71.8	Confident	72	Confident	60 Å²	60	49.5 Å²	49.5	50%	0.496	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-43.2	177	0	0	0	0	0	111.3	F871 E872 H873 S878 S879	F871-A875 VanDerWaalsContact O-CB 3.25Å; F871-A875 WeakPolarHBondContact O-CB 3.31Å; F871-A875 PolarHBondContact O-N 3.4Å; E872-A875 PolarHBondContact O-N 3.38Å; H873-A875 VanDerWaalsContact C-N 3.33Å; H873-A875 PolarHBondContact O-N 3.03Å; A875-S878 PolarHBondContact O-N 2.94Å; A875-S879 WeakPolarHBondContact O-CB 2.81Å; A875-S879 PolarHBondContact O-N 3.5Å
876	E	71.7	Confident	70.6	Confident	94 Å²	94	55.7 Å²	55.7	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-53.7	174	-72.7	-179.1	-174.5	0	0	111.5	E872 H873 S878 S879 V880	E872-E876 WeakPolarHBondContact O-CG 3.09Å; E872-E876 PolarHBondContact O-N 3.37Å; H873-E876 PolarHBondContact O-N 3.16Å; E876-S878 PolarHBondContact O-N 2.91Å; E876-S879 WeakPolarHBondContact O-CB 3.15Å; E876-S879 PolarHBondContact O-N 2.84Å; E876-S879 VanDerWaalsContact O-N 3.11Å; E876-S879 PolarHBondContact O-OG 3.47Å; E876-V880 PolarHBondContact O-N 2.98Å; E876-V880 VanDerWaalsContact O-N 3.1Å
877	I	69.7	Low	69.1	Low	22 Å²	22	58.2 Å²	58.2	11%	0.113	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-45.9	178.6	-66.8	167.8	0	0	0	110.5	A73 H873 S879 V880 V881 F899	A73-I877 HydrophobicContact CB-CD1 4.05Å; A73-I877 HydrophobicContact CB-CG1 4.31Å; H873-I877 WeakPolarHBondContact O-CG1 3.37Å; H873-I877 PolarHBondContact O-N 3.44Å; I877-S879 PolarHBondContact O-N 2.97Å; I877-V880 PolarHBondContact O-N 3.42Å; I877-V880 VanDerWaalsContact O-N 3.14Å; I877-V881 HydrophobicContact CG2-CG2 4.04Å; I877-V881 VanDerWaalsContact O-CG2 3.32Å; I877-V881 WeakPolarHBondContact O-CG2 3.18Å; I877-V881 PolarHBondContact O-N 2.7Å; I877-F899 HydrophobicContact CG2-CE1 4.26Å
878	S	68.3	Low	67.6	Low	17 Å²	17	62.2 Å²	62.2	12%	0.119	33%	0.326	C	S	.	.	H	α-helix	trans	-58.8	-35.8	177.8	-66.4	0	0	0	0	112.3	T874 A875 E876 K882	T874-S878 WeakPolarHBondContact O-CB 3.42Å; T874-S878 PolarHBondContact O-N 2.86Å; T874-S878 PolarHBondContact O-OG 3.31Å; A875-S878 PolarHBondContact O-N 2.94Å; E876-S878 PolarHBondContact O-N 2.91Å; S878-K882 VanDerWaalsContact O-CB 3.29Å; S878-K882 WeakPolarHBondContact O-CB 3.17Å; S878-K882 VanDerWaalsContact O-CG 3.23Å; S878-K882 WeakPolarHBondContact O-CG 3.43Å; S878-K882 PolarHBondContact O-N 3.44Å
879	S	70	Confident	65.7	Low	57 Å²	57	67 Å²	67	40%	0.399	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-44.4	176.4	80.1	0	0	0	0	111.7	A875 E876 I877 K882 N883	A875-S879 WeakPolarHBondContact O-CB 2.81Å; A875-S879 PolarHBondContact O-N 3.5Å; E876-S879 WeakPolarHBondContact O-CB 3.15Å; E876-S879 PolarHBondContact O-N 2.84Å; E876-S879 VanDerWaalsContact O-N 3.11Å; E876-S879 PolarHBondContact O-OG 3.47Å; I877-S879 PolarHBondContact O-N 2.97Å; S879-K882 PolarHBondContact O-N 3.46Å; S879-N883 VanDerWaalsContact O-CG 3.23Å; S879-N883 PolarHBondContact O-N 3.16Å; S879-N883 PolarHBondContact O-ND2 3.12Å
880	V	69.5	Low	64.1	Low	33 Å²	33	69.8 Å²	69.8	20%	0.2	36%	0.361	C	S	.	.	H	α-helix	trans	-65.3	-45.1	179.2	172.9	0	0	0	0	110.8	Y69 E876 I877 N883 F884	Y69-V880 HydrophobicContact CD1-CG1 3.76Å; Y69-V880 HydrophobicContact CE1-CB 3.87Å; Y69-V880 HydrophobicContact CE1-CG1 3.57Å; Y69-V880 HydrophobicContact CE1-CG2 4.08Å; Y69-V880 HydrophobicContact CE2-CG2 4.34Å; Y69-V880 HydrophobicContact CG-CG1 4.38Å; E876-V880 PolarHBondContact O-N 2.98Å; E876-V880 VanDerWaalsContact O-N 3.1Å; I877-V880 PolarHBondContact O-N 3.42Å; I877-V880 VanDerWaalsContact O-N 3.14Å; V880-N883 PolarHBondContact O-N 3.12Å; V880-F884 PolarHBondContact O-N 2.98Å
881	V	66.8	Low	62.7	Low	18 Å²	18	77.8 Å²	77.8	11%	0.109	40%	0.399	C	S	.	.	H	α-helix	trans	-71.5	-36.5	-179.2	-167.9	0	0	0	0	111.8	F66 I877 N883 F884 A885 L896	F66-V881 HydrophobicContact CE2-CG1 4.39Å; F66-V881 HydrophobicContact CE2-CG2 4.03Å; F66-V881 HydrophobicContact CZ-CG1 4.04Å; F66-V881 HydrophobicContact CZ-CG2 4.03Å; I877-V881 HydrophobicContact CG2-CG2 4.04Å; I877-V881 VanDerWaalsContact O-CG2 3.32Å; I877-V881 WeakPolarHBondContact O-CG2 3.18Å; I877-V881 PolarHBondContact O-N 2.7Å; V881-N883 VanDerWaalsContact C-N 3.3Å; V881-N883 PolarHBondContact O-N 3.37Å; V881-F884 PolarHBondContact O-N 3.44Å; V881-F884 VanDerWaalsContact O-N 3.17Å; V881-A885 VanDerWaalsContact O-CB 3.31Å; V881-A885 WeakPolarHBondContact O-CB 3.08Å; V881-A885 PolarHBondContact O-N 2.91Å; V881-L896 HydrophobicContact CB-CD1 3.62Å; V881-L896 HydrophobicContact CB-CD2 4.14Å; V881-L896 HydrophobicContact CB-CG 4.48Å; V881-L896 HydrophobicContact CG1-CB 4.47Å; V881-L896 HydrophobicContact CG1-CD1 3.3Å; V881-L896 HydrophobicContact CG1-CD2 3.59Å; V881-L896 HydrophobicContact CG1-CG 3.91Å; V881-L896 HydrophobicContact CG2-CD1 4.14Å
882	K	64.4	Low	61.5	Low	120 Å²	120	80.5 Å²	80.5	52%	0.522	42%	0.416	S	S	.	.	H	α-helix	trans	-61.3	-39	171.8	-79.8	176.5	-177.8	177.1	0	112.1	S878 S879 F884 A885 K886	S878-K882 VanDerWaalsContact O-CB 3.29Å; S878-K882 WeakPolarHBondContact O-CB 3.17Å; S878-K882 VanDerWaalsContact O-CG 3.23Å; S878-K882 WeakPolarHBondContact O-CG 3.43Å; S878-K882 PolarHBondContact O-N 3.44Å; S879-K882 PolarHBondContact O-N 3.46Å; K882-F884 VanDerWaalsContact C-N 3.31Å; K882-A885 PolarHBondContact O-N 3.48Å; K882-K886 WeakPolarHBondContact O-CG 2.98Å; K882-K886 PolarHBondContact O-N 3.15Å
883	N	64.1	Low	60.1	Low	95 Å²	95	80.4 Å²	80.4	51%	0.508	41%	0.414	S	S	.	.	H	α-helix	trans	-64.7	-37	175.4	-72	-16.3	0	0	0	111.6	S879 V880 V881	S879-N883 VanDerWaalsContact O-CG 3.23Å; S879-N883 PolarHBondContact O-N 3.16Å; S879-N883 PolarHBondContact O-ND2 3.12Å; V880-N883 PolarHBondContact O-N 3.12Å; V881-N883 VanDerWaalsContact C-N 3.3Å; V881-N883 PolarHBondContact O-N 3.37Å
884	F	60.8	Low	59.4	Low	46 Å²	46	81 Å²	81	20%	0.202	43%	0.427	C	S	.	.	H	α-helix	trans	-69	-44.1	173.1	-110.4	-87	0	0	0	113	K62 F66 V880 V881 K882 K886 L887	K62-F884 HydrophobicContact CB-CE1 4.03Å; K62-F884 HydrophobicContact CB-CZ 3.96Å; K62-F884 VanDerWaalsContact O-CZ 3.22Å; K62-F884 WeakPolarHBondContact O-CZ 3.4Å; F66-F884 HydrophobicContact CB-CD1 4.21Å; F66-F884 HydrophobicContact CB-CD2 4.32Å; F66-F884 HydrophobicContact CB-CE1 3.71Å; F66-F884 HydrophobicContact CB-CE2 3.83Å; F66-F884 HydrophobicContact CB-CG 4.5Å; F66-F884 HydrophobicContact CB-CZ 3.53Å; F66-F884 HydrophobicContact CD2-CB 4.22Å; F66-F884 HydrophobicContact CD2-CD1 4.04Å; F66-F884 AromaticContact CD2-CD2 3.38Å; F66-F884 HydrophobicContact CD2-CD2 3.38Å; F66-F884 HydrophobicContact CD2-CE1 4.32Å; F66-F884 AromaticContact CD2-CE2 3.7Å; F66-F884 HydrophobicContact CD2-CE2 3.7Å; F66-F884 AromaticContact CD2-CG 3.58Å; F66-F884 HydrophobicContact CD2-CG 3.58Å; F66-F884 HydrophobicContact CD2-CZ 4.19Å; F66-F884 HydrophobicContact CE2-CB 4.1Å; F66-F884 HydrophobicContact CE2-CD2 4Å; F66-F884 AromaticContact CE2-CG 3.98Å; F66-F884 HydrophobicContact CE2-CG 3.98Å; F66-F884 HydrophobicContact CG-CD1 4.08Å; F66-F884 HydrophobicContact CG-CD2 4.13Å; F66-F884 HydrophobicContact CG-CE1 4.1Å; F66-F884 HydrophobicContact CG-CE2 4.14Å; F66-F884 HydrophobicContact CG-CG 4.11Å; F66-F884 HydrophobicContact CG-CZ 4.16Å; V880-F884 PolarHBondContact O-N 2.98Å; V881-F884 PolarHBondContact O-N 3.44Å; V881-F884 VanDerWaalsContact O-N 3.17Å; K882-F884 VanDerWaalsContact C-N 3.31Å; F884-K886 VanDerWaalsContact C-N 3.34Å; F884-K886 PolarHBondContact O-N 3.49Å; F884-L887 WeakPolarHBondContact O-CB 3.35Å; F884-L887 PolarHBondContact O-N 2.97Å; F884-L887 VanDerWaalsContact O-N 3.13Å
885	A	55.8	Low	58.7	Low	22 Å²	22	87.3 Å²	87.3	18%	0.182	45%	0.453	C	S	.	.	H	α-helix	trans	-69.6	-28.6	-176.6	0	0	0	0	0	113.2	V881 K882 L887 F893 L896	V881-A885 VanDerWaalsContact O-CB 3.31Å; V881-A885 WeakPolarHBondContact O-CB 3.08Å; V881-A885 PolarHBondContact O-N 2.91Å; K882-A885 PolarHBondContact O-N 3.48Å; A885-L887 PolarHBondContact O-N 3.31Å; A885-F893 HydrophobicContact CB-CD2 3.66Å; A885-F893 HydrophobicContact CB-CE2 3.75Å; A885-L896 HydrophobicContact CB-CD2 4.31Å
886	K	56.6	Low	57.8	Low	176 Å²	176	85.1 Å²	85.1	77%	0.765	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.7	171.4	-81.6	-178.4	179.7	-179.3	0	113.7	K882 F884	K882-K886 WeakPolarHBondContact O-CG 2.98Å; K882-K886 PolarHBondContact O-N 3.15Å; F884-K886 VanDerWaalsContact C-N 3.34Å; F884-K886 PolarHBondContact O-N 3.49Å
887	L	52.1	Low	57.1	Low	86 Å²	86	84.5 Å²	84.5	45%	0.45	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-23.6	-177	-71.9	166.5	0	0	0	112.8	K62 F884 A885	K62-L887 HydrophobicContact CD-CD1 4.46Å; F884-L887 WeakPolarHBondContact O-CB 3.35Å; F884-L887 PolarHBondContact O-N 2.97Å; F884-L887 VanDerWaalsContact O-N 3.13Å; A885-L887 PolarHBondContact O-N 3.31Å
888	E	47.7	Very low	56.6	Low	93 Å²	93	87.7 Å²	87.7	44%	0.435	45%	0.447	S	S	.	.			trans	-155.5	138.8	-177.6	-65.4	-171.8	174.4	0	0	114.7	F59 N890	F59-E888 VanDerWaalsContact CD2-OE1 3.23Å; F59-E888 WeakPolarHBondContact CD2-OE1 3.31Å; F59-E888 WeakPolarHBondContact CE2-OE1 3.45Å; F59-E888 WeakPolarHBondContact CE2-OE2 3.44Å; F59-E888 WeakPolarHBondContact CZ-OE2 3.41Å; E888-N890 PolarHBondContact O-N 2.84Å; E888-N890 VanDerWaalsContact O-N 3.12Å
889	D	41.3	Very low	56.2	Low	165 Å²	165	87 Å²	87	88%	0.882	44%	0.442	S	S	*	.			trans	-76.3	78.9	173.7	-75.8	-37.2	0	0	0	111.1
890	N	45.4	Very low	55.7	Low	113 Å²	113	86 Å²	86	60%	0.604	43%	0.433	S	S	*	.	S	Bend	trans	-148.4	151.3	172.6	-83.4	-46.8	0	0	0	112.5	E888 L892 F893	E888-N890 PolarHBondContact O-N 2.84Å; E888-N890 VanDerWaalsContact O-N 3.12Å; N890-L892 PolarHBondContact O-N 2.93Å; N890-F893 PolarHBondContact O-N 2.86Å
891	E	46.1	Very low	55.4	Low	182 Å²	182	91.1 Å²	91.1	85%	0.85	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.2	-20.3	-172.8	-63.3	173.8	153.9	0	0	119.6	F893 G894	E891-F893 PolarHBondContact O-N 3.49Å; E891-G894 PolarHBondContact O-N 3.23Å; E891-G894 VanDerWaalsContact O-N 3.15Å
892	L	48.2	Very low	55.1	Low	132 Å²	132	92 Å²	92	69%	0.691	45%	0.453	S	S	*	.	H	α-helix	trans	-54.9	-28.9	171.7	-85	148.3	0	0	0	113.3	N890 G894 K895 L896	N890-L892 PolarHBondContact O-N 2.93Å; L892-G894 VanDerWaalsContact C-N 3.26Å; L892-G894 PolarHBondContact O-N 3.13Å; L892-K895 PolarHBondContact O-N 3.41Å; L892-L896 PolarHBondContact O-N 3.2Å
893	F	49.6	Very low	54.9	Low	116 Å²	116	86.5 Å²	86.5	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-60.8	-34.7	177.7	-147.3	-81	0	0	0	112.6	A885 N890 E891 H897	A885-F893 HydrophobicContact CB-CD2 3.66Å; A885-F893 HydrophobicContact CB-CE2 3.75Å; N890-F893 PolarHBondContact O-N 2.86Å; E891-F893 PolarHBondContact O-N 3.49Å; F893-H897 PolarHBondContact O-N 3.35Å; F893-H897 VanDerWaalsContact O-N 3.07Å
894	G	57.5	Low	55	Low	39 Å²	39	87.8 Å²	87.8	40%	0.402	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-50.6	177.6	0	0	0	0	0	112	E891 L892 L896 H897 D898	E891-G894 PolarHBondContact O-N 3.23Å; E891-G894 VanDerWaalsContact O-N 3.15Å; L892-G894 VanDerWaalsContact C-N 3.26Å; L892-G894 PolarHBondContact O-N 3.13Å; G894-L896 VanDerWaalsContact C-N 3.28Å; G894-L896 PolarHBondContact O-N 2.9Å; G894-H897 WeakPolarHBondContact O-CB 3.49Å; G894-H897 PolarHBondContact O-N 3.5Å; G894-D898 PolarHBondContact O-N 3.4Å; G894-D898 VanDerWaalsContact O-N 3.1Å
895	K	55.7	Low	55.3	Low	147 Å²	147	89.3 Å²	89.3	64%	0.639	43%	0.434	S	S	*	.	H	α-helix	trans	-63.6	-32.4	178.5	-64.1	-171.9	178.1	-172.8	0	112.9	L892 F899	L892-K895 PolarHBondContact O-N 3.41Å; K895-F899 PolarHBondContact O-N 2.88Å; K895-F899 VanDerWaalsContact O-N 3.12Å
896	L	52.3	Low	55.6	Low	14 Å²	14	88.8 Å²	88.8	7%	0.073	43%	0.428	C	S	.	.	H	α-helix	trans	-66	-41.9	172	-178.3	62.2	0	0	0	111.8	V881 A885 L892 G894 D898 F899 V900	V881-L896 HydrophobicContact CB-CD1 3.62Å; V881-L896 HydrophobicContact CB-CD2 4.14Å; V881-L896 HydrophobicContact CB-CG 4.48Å; V881-L896 HydrophobicContact CG1-CB 4.47Å; V881-L896 HydrophobicContact CG1-CD1 3.3Å; V881-L896 HydrophobicContact CG1-CD2 3.59Å; V881-L896 HydrophobicContact CG1-CG 3.91Å; V881-L896 HydrophobicContact CG2-CD1 4.14Å; A885-L896 HydrophobicContact CB-CD2 4.31Å; L892-L896 PolarHBondContact O-N 3.2Å; G894-L896 VanDerWaalsContact C-N 3.28Å; G894-L896 PolarHBondContact O-N 2.9Å; L896-D898 VanDerWaalsContact C-N 3.26Å; L896-D898 PolarHBondContact O-N 2.77Å; L896-F899 PolarHBondContact O-N 3.22Å; L896-V900 HydrophobicContact CD1-CG2 4.4Å; L896-V900 HydrophobicContact CG-CG2 4.45Å; L896-V900 WeakPolarHBondContact O-CG2 3.49Å; L896-V900 PolarHBondContact O-N 3.47Å
897	H	56.6	Low	56	Low	81 Å²	81	81.4 Å²	81.4	38%	0.375	40%	0.399	S	S	.	.	H	α-helix	trans	-64.7	-35	180	-158.8	-69	0	0	0	111.5	F893 G894 R901	F893-H897 PolarHBondContact O-N 3.35Å; F893-H897 VanDerWaalsContact O-N 3.07Å; G894-H897 WeakPolarHBondContact O-CB 3.49Å; G894-H897 PolarHBondContact O-N 3.5Å; H897-R901 PolarHBondContact CE1-NE 3.29Å; H897-R901 PolarHBondContact ND1-NE 2.84Å; H897-R901 WeakPolarHBondContact O-CB 3.45Å; H897-R901 VanDerWaalsContact O-CG 3.29Å; H897-R901 WeakPolarHBondContact O-CG 3.35Å; H897-R901 PolarHBondContact O-N 3.37Å
898	D	60	Low	56.8	Low	89 Å²	89	82.7 Å²	82.7	48%	0.476	40%	0.403	S	S	.	.	H	α-helix	trans	-69	-42.3	174.2	-65.6	-27.6	0	0	0	111.9	G894 L896 V900 R901 L902	G894-D898 PolarHBondContact O-N 3.4Å; G894-D898 VanDerWaalsContact O-N 3.1Å; L896-D898 VanDerWaalsContact C-N 3.26Å; L896-D898 PolarHBondContact O-N 2.77Å; D898-V900 PolarHBondContact O-N 3.37Å; D898-R901 WeakPolarHBondContact O-CB 3.34Å; D898-R901 PolarHBondContact O-N 2.87Å; D898-R901 IonicContact OD1-NH1 3.42Å; D898-R901 PolarHBondContact OD1-NH1 2.65Å; D898-L902 WeakPolarHBondContact O-CB 3.42Å; D898-L902 PolarHBondContact O-N 3.44Å
899	F	59.5	Low	57.8	Low	4 Å²	4	79.9 Å²	79.9	2%	0.018	39%	0.392	C	S	.	.	H	α-helix	trans	-59.2	-45.2	172.2	178.1	-101	0	0	0	112.6	I877 K895 L896 L902 C903 W951 W954	I877-F899 HydrophobicContact CG2-CE1 4.26Å; K895-F899 PolarHBondContact O-N 2.88Å; K895-F899 VanDerWaalsContact O-N 3.12Å; L896-F899 PolarHBondContact O-N 3.22Å; F899-L902 PolarHBondContact O-N 3.06Å; F899-C903 VanDerWaalsContact CE1-SG 3.6Å; F899-C903 VanDerWaalsContact CZ-SG 3.53Å; F899-C903 PolarHBondContact O-N 2.88Å; F899-C903 PolarHBondContact O-SG 3.17Å; F899-W951 HydrophobicContact CE2-CZ2 4.15Å; F899-W954 HydrophobicContact CB-CD2 4.43Å; F899-W954 HydrophobicContact CB-CZ2 4.22Å; F899-W954 AromaticContact CD2-CD2 3.62Å; F899-W954 HydrophobicContact CD2-CD2 3.62Å; F899-W954 AromaticContact CD2-CE2 3.73Å; F899-W954 AromaticContact CD2-CE3 3.75Å; F899-W954 HydrophobicContact CD2-CE3 3.75Å; F899-W954 HydrophobicContact CD2-CG 4.16Å; F899-W954 HydrophobicContact CD2-CH2 4.09Å; F899-W954 AromaticContact CD2-CZ2 3.98Å; F899-W954 HydrophobicContact CD2-CZ2 3.98Å; F899-W954 AromaticContact CD2-CZ3 3.99Å; F899-W954 HydrophobicContact CD2-CZ3 3.99Å; F899-W954 HydrophobicContact CE2-CD2 4.27Å; F899-W954 AromaticContact CE2-CE3 3.91Å; F899-W954 HydrophobicContact CE2-CE3 3.91Å; F899-W954 HydrophobicContact CE2-CH2 4.17Å; F899-W954 AromaticContact CE2-CZ3 3.86Å; F899-W954 HydrophobicContact CE2-CZ3 3.86Å; F899-W954 HydrophobicContact CG-CD2 4.29Å; F899-W954 AromaticContact CG-CE2 3.93Å; F899-W954 HydrophobicContact CG-CH2 4.4Å; F899-W954 AromaticContact CG-CZ2 4Å; F899-W954 HydrophobicContact CG-CZ2 4Å
900	V	59.3	Low	59	Low	34 Å²	34	72.1 Å²	72.1	21%	0.206	35%	0.351	C	S	.	.	H	α-helix	trans	-66.3	-37.9	177.5	172.4	0	0	0	0	111.5	L896 D898 R904	L896-V900 HydrophobicContact CD1-CG2 4.4Å; L896-V900 HydrophobicContact CG-CG2 4.45Å; L896-V900 WeakPolarHBondContact O-CG2 3.49Å; L896-V900 PolarHBondContact O-N 3.47Å; D898-V900 PolarHBondContact O-N 3.37Å; V900-R904 WeakPolarHBondContact O-CB 3.43Å; V900-R904 PolarHBondContact O-N 3.33Å
901	R	63.4	Low	60.1	Low	141 Å²	141	69.7 Å²	69.7	53%	0.532	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-44.2	173.1	-82.6	174.6	176.4	161.2	-3	111.2	H897 D898 R904 F905	H897-R901 PolarHBondContact CE1-NE 3.29Å; H897-R901 PolarHBondContact ND1-NE 2.84Å; H897-R901 WeakPolarHBondContact O-CB 3.45Å; H897-R901 VanDerWaalsContact O-CG 3.29Å; H897-R901 WeakPolarHBondContact O-CG 3.35Å; H897-R901 PolarHBondContact O-N 3.37Å; D898-R901 WeakPolarHBondContact O-CB 3.34Å; D898-R901 PolarHBondContact O-N 2.87Å; D898-R901 IonicContact OD1-NH1 3.42Å; D898-R901 PolarHBondContact OD1-NH1 2.65Å; R901-R904 WeakPolarHBondContact O-CB 3.49Å; R901-R904 PolarHBondContact O-N 2.99Å; R901-F905 PolarHBondContact O-N 2.65Å
902	L	61.3	Low	61.4	Low	37 Å²	37	64.1 Å²	64.1	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-45.2	178.2	-178.1	69.9	0	0	0	111.6	D898 F899 R904 F905 H906 G950	D898-L902 WeakPolarHBondContact O-CB 3.42Å; D898-L902 PolarHBondContact O-N 3.44Å; F899-L902 PolarHBondContact O-N 3.06Å; L902-R904 PolarHBondContact O-N 3.49Å; L902-F905 WeakPolarHBondContact O-CB 3.36Å; L902-F905 PolarHBondContact O-N 3.43Å; L902-F905 VanDerWaalsContact O-N 3.1Å; L902-H906 WeakPolarHBondContact CG-NE2 3.46Å; L902-H906 PolarHBondContact O-CD2 3.02Å; L902-H906 PolarHBondContact O-N 3.26Å; L902-G950 WeakPolarHBondContact CD2-O 3.49Å
903	C	60.4	Low	62.5	Low	5 Å²	5	59.5 Å²	59.5	3%	0.034	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-37.4	174	-68.6	0	0	0	0	112.2	T874 F899 H906 A907	T874-C903 HydrophobicContact CG2-CB 3.64Å; F899-C903 VanDerWaalsContact CE1-SG 3.6Å; F899-C903 VanDerWaalsContact CZ-SG 3.53Å; F899-C903 PolarHBondContact O-N 2.88Å; F899-C903 PolarHBondContact O-SG 3.17Å; C903-H906 PolarHBondContact O-N 3.24Å; C903-A907 WeakPolarHBondContact O-CB 3.4Å; C903-A907 PolarHBondContact O-N 3.25Å
904	R	65.4	Low	63.4	Low	122 Å²	122	54.8 Å²	54.8	46%	0.46	28%	0.278	S	S	.	.	H	α-helix	trans	-66.1	-42.9	173.5	-173.5	-174.7	-58.2	126.5	5.8	111.8	V900 R901 L902 H906 A907 E908	V900-R904 WeakPolarHBondContact O-CB 3.43Å; V900-R904 PolarHBondContact O-N 3.33Å; R901-R904 WeakPolarHBondContact O-CB 3.49Å; R901-R904 PolarHBondContact O-N 2.99Å; L902-R904 PolarHBondContact O-N 3.49Å; R904-H906 VanDerWaalsContact C-N 3.34Å; R904-H906 PolarHBondContact O-N 3.2Å; R904-A907 WeakPolarHBondContact O-CA 3.3Å; R904-A907 WeakPolarHBondContact O-CB 3.4Å; R904-A907 PolarHBondContact O-N 2.86Å; R904-A907 VanDerWaalsContact O-N 3.1Å; R904-E908 WeakPolarHBondContact CG-OE1 3.41Å; R904-E908 WeakPolarHBondContact O-CG 3.45Å; R904-E908 PolarHBondContact O-N 3.15Å
905	F	67.5	Low	64	Low	78 Å²	78	58.9 Å²	58.9	34%	0.342	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-46.1	174.8	175.1	-99.9	0	0	0	111.2	R901 L902 A907 E908 T909 L946	R901-F905 PolarHBondContact O-N 2.65Å; L902-F905 WeakPolarHBondContact O-CB 3.36Å; L902-F905 PolarHBondContact O-N 3.43Å; L902-F905 VanDerWaalsContact O-N 3.1Å; F905-A907 VanDerWaalsContact C-N 3.28Å; F905-A907 PolarHBondContact O-N 3.29Å; F905-E908 PolarHBondContact O-N 3.39Å; F905-T909 PolarHBondContact O-N 3Å; F905-T909 PolarHBondContact O-OG1 3.47Å; F905-T909 VanDerWaalsContact O-OG1 3.12Å; F905-L946 HydrophobicContact CE1-CB 4.41Å
906	H	62.7	Low	64.5	Low	11 Å²	11	53.4 Å²	53.4	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-38.9	173.3	-64.9	-52.5	0	0	0	112	F870 L902 C903 R904 E908 T909 A910	F870-H906 HydrophobicContact CE1-CB 4.4Å; F870-H906 HydrophobicContact CZ-CB 3.9Å; L902-H906 WeakPolarHBondContact CG-NE2 3.46Å; L902-H906 PolarHBondContact O-CD2 3.02Å; L902-H906 PolarHBondContact O-N 3.26Å; C903-H906 PolarHBondContact O-N 3.24Å; R904-H906 VanDerWaalsContact C-N 3.34Å; R904-H906 PolarHBondContact O-N 3.2Å; H906-E908 VanDerWaalsContact C-N 3.35Å; H906-E908 PolarHBondContact O-N 3.07Å; H906-T909 PolarHBondContact O-N 2.69Å; H906-A910 VanDerWaalsContact O-CB 3.27Å; H906-A910 WeakPolarHBondContact O-CB 3.5Å; H906-A910 PolarHBondContact O-N 3.4Å
907	A	64.4	Low	65.1	Low	20 Å²	20	52.8 Å²	52.8	17%	0.165	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-45.3	174.8	0	0	0	0	0	112.7	F871 C903 R904 F905 A910 V911	F871-A907 HydrophobicContact CD1-CB 4.25Å; F871-A907 VanDerWaalsContact CE1-CA 3.46Å; F871-A907 HydrophobicContact CE1-CB 3.17Å; F871-A907 HydrophobicContact CZ-CB 3.61Å; C903-A907 WeakPolarHBondContact O-CB 3.4Å; C903-A907 PolarHBondContact O-N 3.25Å; R904-A907 WeakPolarHBondContact O-CA 3.3Å; R904-A907 WeakPolarHBondContact O-CB 3.4Å; R904-A907 PolarHBondContact O-N 2.86Å; R904-A907 VanDerWaalsContact O-N 3.1Å; F905-A907 VanDerWaalsContact C-N 3.28Å; F905-A907 PolarHBondContact O-N 3.29Å; A907-A910 WeakPolarHBondContact O-CB 3.47Å; A907-A910 PolarHBondContact O-N 3.04Å; A907-V911 WeakPolarHBondContact O-CB 3.46Å; A907-V911 VanDerWaalsContact O-CG2 3.24Å; A907-V911 WeakPolarHBondContact O-CG2 3.24Å; A907-V911 PolarHBondContact O-N 3.35Å
908	E	69.6	Low	65.6	Low	114 Å²	114	53.1 Å²	53.1	53%	0.533	26%	0.263	S	S	.	.	H	α-helix	trans	-67	-42.5	-179.6	-72.3	169.6	-173.8	0	0	110.8	R904 F905 H906 V911 S912	R904-E908 WeakPolarHBondContact CG-OE1 3.41Å; R904-E908 WeakPolarHBondContact O-CG 3.45Å; R904-E908 PolarHBondContact O-N 3.15Å; F905-E908 PolarHBondContact O-N 3.39Å; H906-E908 VanDerWaalsContact C-N 3.35Å; H906-E908 PolarHBondContact O-N 3.07Å; E908-V911 PolarHBondContact O-N 3.32Å; E908-S912 VanDerWaalsContact O-CB 3.3Å; E908-S912 WeakPolarHBondContact O-CB 3.44Å; E908-S912 PolarHBondContact O-N 3.08Å
909	T	67.1	Low	65.6	Low	33 Å²	33	53.6 Å²	53.6	20%	0.202	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-43.7	173.9	-59.2	0	0	0	0	111.4	F905 H906 S912 I913	F905-T909 PolarHBondContact O-N 3Å; F905-T909 PolarHBondContact O-OG1 3.47Å; F905-T909 VanDerWaalsContact O-OG1 3.12Å; H906-T909 PolarHBondContact O-N 2.69Å; T909-S912 WeakPolarHBondContact O-CB 3.49Å; T909-S912 PolarHBondContact O-N 3.21Å; T909-I913 HydrophobicContact CG2-CD1 4.12Å; T909-I913 WeakPolarHBondContact O-CG1 3.46Å; T909-I913 PolarHBondContact O-N 3.08Å
910	A	67.4	Low	65.4	Low	2 Å²	2	55.4 Å²	55.4	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-58.7	-51	175	0	0	0	0	0	112.4	F867 F871 H906 A907 S912 I913 V914	F867-A910 HydrophobicContact CB-CB 4.33Å; F867-A910 HydrophobicContact CD1-CB 3.29Å; F867-A910 HydrophobicContact CD2-CB 3.59Å; F867-A910 HydrophobicContact CE1-CB 3.26Å; F867-A910 HydrophobicContact CE2-CB 3.53Å; F867-A910 HydrophobicContact CG-CB 3.48Å; F867-A910 VanDerWaalsContact CG-CB 3.48Å; F867-A910 HydrophobicContact CZ-CB 3.37Å; F871-A910 HydrophobicContact CZ-CB 4.28Å; H906-A910 VanDerWaalsContact O-CB 3.27Å; H906-A910 WeakPolarHBondContact O-CB 3.5Å; H906-A910 PolarHBondContact O-N 3.4Å; A907-A910 WeakPolarHBondContact O-CB 3.47Å; A907-A910 PolarHBondContact O-N 3.04Å; A910-S912 PolarHBondContact O-N 3.47Å; A910-I913 PolarHBondContact O-N 3.3Å; A910-V914 WeakPolarHBondContact O-CG2 3.47Å; A910-V914 PolarHBondContact O-N 3.41Å
911	V	69.3	Low	65.2	Low	63 Å²	63	62.7 Å²	62.7	38%	0.382	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-36.7	177.6	169	0	0	0	0	110.4	A907 E908 K915	A907-V911 WeakPolarHBondContact O-CB 3.46Å; A907-V911 VanDerWaalsContact O-CG2 3.24Å; A907-V911 WeakPolarHBondContact O-CG2 3.24Å; A907-V911 PolarHBondContact O-N 3.35Å; E908-V911 PolarHBondContact O-N 3.32Å; V911-K915 HydrophobicContact CG1-CD 3.86Å; V911-K915 HydrophobicContact CG1-CG 4.24Å; V911-K915 VanDerWaalsContact O-CB 3.23Å; V911-K915 WeakPolarHBondContact O-CB 3.33Å; V911-K915 VanDerWaalsContact O-CG 3.25Å; V911-K915 WeakPolarHBondContact O-CG 3.21Å; V911-K915 PolarHBondContact O-N 3.45Å
912	S	73.5	Confident	64.5	Low	65 Å²	65	62 Å²	62	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-47.1	174.4	-173	0	0	0	0	111.9	E908 T909 A910 S916	E908-S912 VanDerWaalsContact O-CB 3.3Å; E908-S912 WeakPolarHBondContact O-CB 3.44Å; E908-S912 PolarHBondContact O-N 3.08Å; T909-S912 WeakPolarHBondContact O-CB 3.49Å; T909-S912 PolarHBondContact O-N 3.21Å; A910-S912 PolarHBondContact O-N 3.47Å; S912-S916 VanDerWaalsContact O-CB 3.26Å; S912-S916 WeakPolarHBondContact O-CB 3.48Å; S912-S916 PolarHBondContact O-N 3.47Å; S912-S916 PolarHBondContact O-OG 3.19Å
913	I	69.4	Low	63.7	Low	34 Å²	34	63.3 Å²	63.3	17%	0.174	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-47.8	176.1	-67.3	166.3	0	0	0	110.4	L88 Y91 T909 A910 S916 G917	L88-I913 HydrophobicContact CD2-CD1 4.24Å; Y91-I913 HydrophobicContact CD1-CG2 4.42Å; Y91-I913 HydrophobicContact CE1-CG2 4.01Å; T909-I913 HydrophobicContact CG2-CD1 4.12Å; T909-I913 WeakPolarHBondContact O-CG1 3.46Å; T909-I913 PolarHBondContact O-N 3.08Å; A910-I913 PolarHBondContact O-N 3.3Å; I913-S916 PolarHBondContact O-N 3.1Å; I913-G917 PolarHBondContact O-N 3.46Å
914	V	69.7	Low	63	Low	17 Å²	17	71.5 Å²	71.5	10%	0.103	36%	0.358	C	S	.	.	H	α-helix	trans	-65.4	-44.1	-179.2	173.5	0	0	0	0	111.8	R864 A910 G917 Q918	R864-V914 HydrophobicContact CB-CG2 4.34Å; R864-V914 HydrophobicContact CG-CG1 4.44Å; R864-V914 HydrophobicContact CG-CG2 4.49Å; A910-V914 WeakPolarHBondContact O-CG2 3.47Å; A910-V914 PolarHBondContact O-N 3.41Å; V914-G917 PolarHBondContact O-N 3.38Å; V914-Q918 HydrophobicContact CG1-CG 4.35Å; V914-Q918 WeakPolarHBondContact O-CB 3.39Å; V914-Q918 VanDerWaalsContact O-CG 3.32Å; V914-Q918 WeakPolarHBondContact O-CG 3.3Å; V914-Q918 PolarHBondContact O-N 2.82Å
915	K	70.5	Confident	62	Low	126 Å²	126	71.5 Å²	71.5	55%	0.548	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-47.1	175.1	-78.6	177.8	178.6	176.9	0	110.7	V911 G917 Q918 M919	V911-K915 HydrophobicContact CG1-CD 3.86Å; V911-K915 HydrophobicContact CG1-CG 4.24Å; V911-K915 VanDerWaalsContact O-CB 3.23Å; V911-K915 WeakPolarHBondContact O-CB 3.33Å; V911-K915 VanDerWaalsContact O-CG 3.25Å; V911-K915 WeakPolarHBondContact O-CG 3.21Å; V911-K915 PolarHBondContact O-N 3.45Å; K915-G917 VanDerWaalsContact C-N 3.31Å; K915-G917 PolarHBondContact O-N 3.45Å; K915-Q918 PolarHBondContact O-N 3.38Å; K915-M919 VanDerWaalsContact O-CG 3.22Å; K915-M919 WeakPolarHBondContact O-CG 3.36Å; K915-M919 PolarHBondContact O-N 3.47Å
916	S	65.1	Low	60.7	Low	32 Å²	32	75.9 Å²	75.9	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-42.8	178.9	-58	0	0	0	0	111.5	S912 I913 M919	S912-S916 VanDerWaalsContact O-CB 3.26Å; S912-S916 WeakPolarHBondContact O-CB 3.48Å; S912-S916 PolarHBondContact O-N 3.47Å; S912-S916 PolarHBondContact O-OG 3.19Å; I913-S916 PolarHBondContact O-N 3.1Å; S916-M919 PolarHBondContact O-N 3.18Å
917	G	66	Low	59.9	Low	0 Å²	0	78.1 Å²	78.1	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-66.9	-42.4	174.9	0	0	0	0	0	113.3	Y91 L860 I913 V914 K915 M919 L920	Y91-G917 WeakPolarHBondContact OH-CA 3.46Å; L860-G917 VanDerWaalsContact CD2-CA 3.5Å; I913-G917 PolarHBondContact O-N 3.46Å; V914-G917 PolarHBondContact O-N 3.38Å; K915-G917 VanDerWaalsContact C-N 3.31Å; K915-G917 PolarHBondContact O-N 3.45Å; G917-M919 PolarHBondContact O-N 2.9Å; G917-L920 WeakPolarHBondContact O-CB 3.35Å; G917-L920 PolarHBondContact O-N 3.45Å
918	Q	66.2	Low	59	Low	89 Å²	89	79.9 Å²	79.9	42%	0.416	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-30.8	176.3	-79.2	177.8	-8.1	0	0	112.5	V914 K915 L920 R921	V914-Q918 HydrophobicContact CG1-CG 4.35Å; V914-Q918 WeakPolarHBondContact O-CB 3.39Å; V914-Q918 VanDerWaalsContact O-CG 3.32Å; V914-Q918 WeakPolarHBondContact O-CG 3.3Å; V914-Q918 PolarHBondContact O-N 2.82Å; K915-Q918 PolarHBondContact O-N 3.38Å; Q918-L920 VanDerWaalsContact C-N 3.26Å; Q918-L920 PolarHBondContact O-N 3.11Å; Q918-R921 WeakPolarHBondContact O-CB 3.5Å; Q918-R921 PolarHBondContact O-N 3.43Å; Q918-R921 VanDerWaalsContact O-N 3.13Å
919	M	60.4	Low	57.9	Low	99 Å²	99	82.7 Å²	82.7	49%	0.488	43%	0.43	S	S	.	.	H	α-helix	trans	-68.5	-25.6	176.9	-65.9	177.9	159	0	0	112.2	K915 S916 G917 R921 N922 W927	K915-M919 VanDerWaalsContact O-CG 3.22Å; K915-M919 WeakPolarHBondContact O-CG 3.36Å; K915-M919 PolarHBondContact O-N 3.47Å; S916-M919 PolarHBondContact O-N 3.18Å; G917-M919 PolarHBondContact O-N 2.9Å; M919-R921 PolarHBondContact O-N 2.94Å; M919-N922 PolarHBondContact O-N 3.46Å; M919-W927 VanDerWaalsContact C-CZ3 3.49Å; M919-W927 HydrophobicContact CB-CH2 3.09Å; M919-W927 HydrophobicContact CB-CZ2 3.54Å; M919-W927 HydrophobicContact CB-CZ3 4.05Å; M919-W927 HydrophobicContact CG-CH2 4.27Å; M919-W927 WeakPolarHBondContact O-CH2 3.41Å; M919-W927 WeakPolarHBondContact O-CZ2 3.46Å; M919-W927 WeakPolarHBondContact O-CZ3 3.35Å; M919-W927 HydrophobicContact SD-CH2 4.44Å
920	L	55.4	Low	56.9	Low	41 Å²	41	87.4 Å²	87.4	22%	0.215	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-26.1	169.3	-67	164.4	0	0	0	112.3	G917 Q918 W927 V931	G917-L920 WeakPolarHBondContact O-CB 3.35Å; G917-L920 PolarHBondContact O-N 3.45Å; Q918-L920 VanDerWaalsContact C-N 3.26Å; Q918-L920 PolarHBondContact O-N 3.11Å; L920-W927 HydrophobicContact CD2-CZ3 4.39Å; L920-V931 HydrophobicContact CD2-CG2 4.49Å
921	R	54.6	Low	55.7	Low	188 Å²	188	87.8 Å²	87.8	71%	0.709	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.9	-174.2	-151	-178.8	-162.3	-165.9	5.4	114.7	Q918 M919	Q918-R921 WeakPolarHBondContact O-CB 3.5Å; Q918-R921 PolarHBondContact O-N 3.43Å; Q918-R921 VanDerWaalsContact O-N 3.13Å; M919-R921 PolarHBondContact O-N 2.94Å
922	N	49.5	Very low	54.8	Low	127 Å²	127	88.3 Å²	88.3	68%	0.679	45%	0.452	S	S	*	.	S	Bend	trans	-100	-16	-153.4	-79.1	-12.2	0	0	0	117.8	M919	M919-N922 PolarHBondContact O-N 3.46Å
923	S	44.1	Very low	53.9	Low	64 Å²	64	90.1 Å²	90.1	45%	0.448	46%	0.457	S	S	.	.			trans	-156.8	105.5	176.5	-71.2	0	0	0	0	113.8	S925 W927	S923-S925 VanDerWaalsContact C-N 3.28Å; S923-S925 PolarHBondContact O-N 3.42Å; S923-S925 VanDerWaalsContact O-N 3.15Å; S923-W927 VanDerWaalsContact O-CG 3.26Å; S923-W927 PolarHBondContact O-NE1 3.12Å
924	I	46.4	Very low	52.8	Low	177 Å²	177	91.2 Å²	91.2	91%	0.908	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.8	-173.5	-66.9	166	0	0	0	114.4
925	S	42.9	Very low	51.6	Low	121 Å²	121	91.6 Å²	91.6	85%	0.846	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	2.1	-167.5	79.4	0	0	0	0	117.2	S923	S923-S925 VanDerWaalsContact C-N 3.28Å; S923-S925 PolarHBondContact O-N 3.42Å; S923-S925 VanDerWaalsContact O-N 3.15Å
926	M	39.9	Very low	50.9	Low	170 Å²	170	93.5 Å²	93.5	84%	0.837	47%	0.472	S	S	*	.	S	Bend	trans	-120.8	8.5	-173.2	-137.7	179	-159.4	0	0	114
927	W	45.6	Very low	50.2	Low	58 Å²	58	98.7 Å²	98.7	22%	0.22	49%	0.491	C	S	.	.			trans	-106.7	-18.1	-148.4	-94.8	58.8	0	0	0	118.1	M919 L920 S923 K929 E930 V931	M919-W927 VanDerWaalsContact C-CZ3 3.49Å; M919-W927 HydrophobicContact CB-CH2 3.09Å; M919-W927 HydrophobicContact CB-CZ2 3.54Å; M919-W927 HydrophobicContact CB-CZ3 4.05Å; M919-W927 HydrophobicContact CG-CH2 4.27Å; M919-W927 WeakPolarHBondContact O-CH2 3.41Å; M919-W927 WeakPolarHBondContact O-CZ2 3.46Å; M919-W927 WeakPolarHBondContact O-CZ3 3.35Å; M919-W927 HydrophobicContact SD-CH2 4.44Å; L920-W927 HydrophobicContact CD2-CZ3 4.39Å; S923-W927 VanDerWaalsContact O-CG 3.26Å; S923-W927 PolarHBondContact O-NE1 3.12Å; W927-K929 VanDerWaalsContact C-N 3.31Å; W927-K929 PolarHBondContact O-N 2.91Å; W927-K929 VanDerWaalsContact O-N 3.15Å; W927-E930 PolarHBondContact O-N 2.97Å; W927-V931 HydrophobicContact CB-CG2 4.43Å; W927-V931 HydrophobicContact CD2-CG2 4.19Å; W927-V931 HydrophobicContact CE3-CG2 3.18Å; W927-V931 HydrophobicContact CZ3-CG2 3.43Å; W927-V931 VanDerWaalsContact CZ3-CG2 3.43Å; W927-V931 VanDerWaalsContact O-CG2 3.26Å; W927-V931 WeakPolarHBondContact O-CG2 3.45Å; W927-V931 PolarHBondContact O-N 2.97Å
928	S	45.6	Very low	49.2	Very low	58 Å²	58	101.6 Å²	101.6	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-62.6	-30.1	-168.2	62.5	0	0	0	0	115.2	N932	S928-N932 PolarHBondContact O-ND2 3.5Å
929	K	47.8	Very low	48.2	Very low	172 Å²	172	102.3 Å²	102.3	75%	0.748	51%	0.514	S	S	*	.	H	α-helix	trans	-82.6	-41.1	-177.9	-89.5	-178.9	175	176.1	0	114.5	W927	W927-K929 VanDerWaalsContact C-N 3.31Å; W927-K929 PolarHBondContact O-N 2.91Å; W927-K929 VanDerWaalsContact O-N 3.15Å
930	E	44.7	Very low	47.9	Very low	132 Å²	132	100.4 Å²	100.4	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-71.5	-37.7	-177	-141.7	82.2	-164.9	0	0	111	W927 N933 L934	W927-E930 PolarHBondContact O-N 2.97Å; E930-N933 PolarHBondContact O-N 2.92Å; E930-L934 PolarHBondContact O-N 3.33Å; E930-L934 VanDerWaalsContact O-N 3.17Å
931	V	43.6	Very low	47.5	Very low	11 Å²	11	103.5 Å²	103.5	7%	0.067	53%	0.526	C	S	.	.	H	α-helix	trans	-62.7	-44	177.8	171.1	0	0	0	0	111.9	L920 W927 N933 L934 L935	L920-V931 HydrophobicContact CD2-CG2 4.49Å; W927-V931 HydrophobicContact CB-CG2 4.43Å; W927-V931 HydrophobicContact CD2-CG2 4.19Å; W927-V931 HydrophobicContact CE3-CG2 3.18Å; W927-V931 HydrophobicContact CZ3-CG2 3.43Å; W927-V931 VanDerWaalsContact CZ3-CG2 3.43Å; W927-V931 VanDerWaalsContact O-CG2 3.26Å; W927-V931 WeakPolarHBondContact O-CG2 3.45Å; W927-V931 PolarHBondContact O-N 2.97Å; V931-N933 PolarHBondContact O-N 2.82Å; V931-L934 PolarHBondContact O-N 3.32Å; V931-L934 VanDerWaalsContact O-N 3.15Å; V931-L935 HydrophobicContact CG1-CD1 3.58Å; V931-L935 HydrophobicContact CG1-CG 4.08Å; V931-L935 WeakPolarHBondContact O-CB 3.49Å; V931-L935 WeakPolarHBondContact O-CG 3.39Å; V931-L935 PolarHBondContact O-N 3.27Å
932	N	49.6	Very low	47.2	Very low	74 Å²	74	99.7 Å²	99.7	40%	0.396	52%	0.52	S	S	.	.	H	α-helix	trans	-58.1	-36.6	177.4	-90.9	-49.7	0	0	0	112.5	S928 K936	S928-N932 PolarHBondContact O-ND2 3.5Å; N932-K936 PolarHBondContact O-N 3.4Å
933	N	54.6	Low	47	Very low	103 Å²	103	96.9 Å²	96.9	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-73.3	-37.7	177.5	-76.6	-20	0	0	0	112.5	E930 V931 K937	E930-N933 PolarHBondContact O-N 2.92Å; V931-N933 PolarHBondContact O-N 2.82Å; N933-K937 PolarHBondContact O-N 3.44Å
934	L	45.7	Very low	46.8	Very low	56 Å²	56	96.4 Å²	96.4	29%	0.293	50%	0.497	S	S	.	.	H	α-helix	trans	-75.9	-38.2	179.9	-77.6	164.2	0	0	0	112.5	E930 V931 K936 K937 A938	E930-L934 PolarHBondContact O-N 3.33Å; E930-L934 VanDerWaalsContact O-N 3.17Å; V931-L934 PolarHBondContact O-N 3.32Å; V931-L934 VanDerWaalsContact O-N 3.15Å; L934-K936 VanDerWaalsContact C-N 3.34Å; L934-K936 PolarHBondContact O-N 3.02Å; L934-K937 PolarHBondContact O-N 3.47Å; L934-K937 VanDerWaalsContact O-N 3.13Å; L934-A938 PolarHBondContact O-N 3.23Å
935	L	45.7	Very low	46.7	Very low	26 Å²	26	89.6 Å²	89.6	14%	0.136	47%	0.468	C	S	.	.	H	α-helix	trans	-64.4	-37.7	174.1	-74.7	174.3	0	0	0	112.2	V95 V931 K937 A938 R939	V95-L935 HydrophobicContact CG1-CD2 3.12Å; V95-L935 HydrophobicContact CG1-CG 4.42Å; V931-L935 HydrophobicContact CG1-CD1 3.58Å; V931-L935 HydrophobicContact CG1-CG 4.08Å; V931-L935 WeakPolarHBondContact O-CB 3.49Å; V931-L935 WeakPolarHBondContact O-CG 3.39Å; V931-L935 PolarHBondContact O-N 3.27Å; L935-K937 VanDerWaalsContact C-N 3.27Å; L935-K937 PolarHBondContact O-N 3.13Å; L935-A938 PolarHBondContact O-N 3.47Å; L935-R939 WeakPolarHBondContact O-CB 3.37Å; L935-R939 WeakPolarHBondContact O-CG 3.33Å; L935-R939 PolarHBondContact O-N 3.46Å
936	K	55.8	Low	46.7	Very low	165 Å²	165	87.6 Å²	87.6	72%	0.717	45%	0.447	S	S	*	.	H	α-helix	trans	-58.2	-40.1	171.3	-92.1	-176.7	173.8	179.2	0	112.3	N932 L934 D940	N932-K936 PolarHBondContact O-N 3.4Å; L934-K936 VanDerWaalsContact C-N 3.34Å; L934-K936 PolarHBondContact O-N 3.02Å; K936-D940 PolarHBondContact O-N 3.14Å
937	K	50	Low	46.5	Very low	141 Å²	141	80.4 Å²	80.4	61%	0.613	41%	0.411	S	S	*	.	H	α-helix	trans	-72.6	-38.6	178	-69.5	-179.7	178.6	-176.8	0	112.8	N933 L934 L935 D940 N943	N933-K937 PolarHBondContact O-N 3.44Å; L934-K937 PolarHBondContact O-N 3.47Å; L934-K937 VanDerWaalsContact O-N 3.13Å; L935-K937 VanDerWaalsContact C-N 3.27Å; L935-K937 PolarHBondContact O-N 3.13Å; K937-D940 VanDerWaalsContact O-CB 3.22Å; K937-D940 WeakPolarHBondContact O-CB 3.28Å; K937-D940 PolarHBondContact O-N 3.44Å; K937-N943 PolarHBondContact O-ND2 3.25Å
938	A	45	Very low	46.1	Very low	62 Å²	62	84.6 Å²	84.6	51%	0.512	43%	0.428	S	S	.	.	H	α-helix	trans	-74.5	-29.4	178.2	0	0	0	0	0	113.2	L934 L935	L934-A938 PolarHBondContact O-N 3.23Å; L935-A938 PolarHBondContact O-N 3.47Å
939	R	46.3	Very low	45.8	Very low	103 Å²	103	88 Å²	88	39%	0.389	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-5	172.8	-71.9	177	-177.8	173.6	5.6	113.3	M96 S99 L935 V941	M96-R939 PolarHBondContact SD-NE 3.2Å; M96-R939 PolarHBondContact SD-NH2 3.37Å; S99-R939 VanDerWaalsContact CB-NH2 3.28Å; S99-R939 PolarHBondContact OG-NH2 2.99Å; L935-R939 WeakPolarHBondContact O-CB 3.37Å; L935-R939 WeakPolarHBondContact O-CG 3.33Å; L935-R939 PolarHBondContact O-N 3.46Å; R939-V941 PolarHBondContact O-N 3.44Å; R939-V941 VanDerWaalsContact O-N 3.1Å
940	D	53	Low	45.5	Very low	60 Å²	60	80.7 Å²	80.7	32%	0.321	41%	0.411	S	S	.	.			trans	-64.9	114.6	179.5	-166.3	-11.1	0	0	0	109.1	K936 K937 D942 N943 L944	K936-D940 PolarHBondContact O-N 3.14Å; K937-D940 VanDerWaalsContact O-CB 3.22Å; K937-D940 WeakPolarHBondContact O-CB 3.28Å; K937-D940 PolarHBondContact O-N 3.44Å; D940-D942 PolarHBondContact O-N 3.24Å; D940-D942 WeakPolarHBondContact OD1-CB 3.27Å; D940-D942 PolarHBondContact OD1-N 3.23Å; D940-N943 HydrophobicContact CB-CB 4.19Å; D940-N943 WeakPolarHBondContact CB-ND2 3.36Å; D940-N943 PolarHBondContact O-N 2.88Å; D940-L944 PolarHBondContact O-N 2.97Å
941	V	46.5	Very low	44.9	Very low	105 Å²	105	75.6 Å²	75.6	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-59.3	-30.5	177.4	178.8	0	0	0	0	109.5	R939 N943 L944 A945	R939-V941 PolarHBondContact O-N 3.44Å; R939-V941 VanDerWaalsContact O-N 3.1Å; V941-N943 VanDerWaalsContact C-N 3.34Å; V941-N943 PolarHBondContact O-N 3Å; V941-L944 PolarHBondContact O-N 3.48Å; V941-A945 WeakPolarHBondContact O-CB 3.47Å; V941-A945 PolarHBondContact O-N 3.01Å
942	D	48.3	Very low	44.6	Very low	109 Å²	109	79.6 Å²	79.6	58%	0.583	41%	0.411	S	S	*	.	H	α-helix	trans	-65.7	-38	177.5	-62	-21.9	0	0	0	111.1	D940 A945 L946	D940-D942 PolarHBondContact O-N 3.24Å; D940-D942 WeakPolarHBondContact OD1-CB 3.27Å; D940-D942 PolarHBondContact OD1-N 3.23Å; D942-A945 PolarHBondContact O-N 2.9Å; D942-L946 VanDerWaalsContact O-CB 3.31Å; D942-L946 WeakPolarHBondContact O-CB 3.43Å; D942-L946 WeakPolarHBondContact O-CD1 3.48Å; D942-L946 VanDerWaalsContact O-CG 3.3Å; D942-L946 WeakPolarHBondContact O-CG 3.44Å; D942-L946 PolarHBondContact O-N 2.97Å
943	N	45.5	Very low	43.8	Very low	67 Å²	67	80.5 Å²	80.5	36%	0.358	43%	0.429	S	S	.	.	H	α-helix	trans	-71	-34.3	176.3	-71.2	-34.4	0	0	0	112.6	K937 D940 V941 M947	K937-N943 PolarHBondContact O-ND2 3.25Å; D940-N943 HydrophobicContact CB-CB 4.19Å; D940-N943 WeakPolarHBondContact CB-ND2 3.36Å; D940-N943 PolarHBondContact O-N 2.88Å; V941-N943 VanDerWaalsContact C-N 3.34Å; V941-N943 PolarHBondContact O-N 3Å; N943-M947 PolarHBondContact O-N 2.96Å
944	L	41	Very low	42.8	Very low	54 Å²	54	80.5 Å²	80.5	28%	0.283	42%	0.421	S	S	.	.	H	α-helix	trans	-75.3	-36.5	174.5	-73.3	166.5	0	0	0	112	W85 D940 V941 M947 Y948	W85-L944 HydrophobicContact CH2-CD2 4.44Å; W85-L944 HydrophobicContact CZ3-CD2 4.49Å; D940-L944 PolarHBondContact O-N 2.97Å; V941-L944 PolarHBondContact O-N 3.48Å; L944-M947 WeakPolarHBondContact O-CB 3.35Å; L944-M947 PolarHBondContact O-N 3.36Å; L944-Y948 PolarHBondContact O-N 2.79Å
945	A	42.6	Very low	42.2	Very low	35 Å²	35	83.6 Å²	83.6	29%	0.289	44%	0.442	S	S	.	.	H	α-helix	trans	-67.4	-40.8	175.6	0	0	0	0	0	111	V941 D942 M947 Y948 E949	V941-A945 WeakPolarHBondContact O-CB 3.47Å; V941-A945 PolarHBondContact O-N 3.01Å; D942-A945 PolarHBondContact O-N 2.9Å; A945-M947 PolarHBondContact O-N 3.29Å; A945-Y948 PolarHBondContact O-N 3.38Å; A945-E949 PolarHBondContact O-N 2.86Å
946	L	43.1	Very low	42	Very low	78 Å²	78	86.5 Å²	86.5	41%	0.408	46%	0.457	S	S	.	.	H	α-helix	trans	-56.5	-29.1	170.5	-86.1	159.7	0	0	0	113.1	F905 D942	F905-L946 HydrophobicContact CE1-CB 4.41Å; D942-L946 VanDerWaalsContact O-CB 3.31Å; D942-L946 WeakPolarHBondContact O-CB 3.43Å; D942-L946 WeakPolarHBondContact O-CD1 3.48Å; D942-L946 VanDerWaalsContact O-CG 3.3Å; D942-L946 WeakPolarHBondContact O-CG 3.44Å; D942-L946 PolarHBondContact O-N 2.97Å
947	M	37.4	Very low	41.3	Very low	20 Å²	20	82.3 Å²	82.3	10%	0.099	44%	0.443	C	S	.	.	H	α-helix	trans	-70	-35.4	172.2	-74.4	-174.2	50.7	0	0	112.9	L88 N943 L944 A945	L88-M947 HydrophobicContact CD1-CE 3.49Å; L88-M947 VanDerWaalsContact CD1-CE 3.49Å; L88-M947 HydrophobicContact CD1-SD 4.23Å; N943-M947 PolarHBondContact O-N 2.96Å; L944-M947 WeakPolarHBondContact O-CB 3.35Å; L944-M947 PolarHBondContact O-N 3.36Å; A945-M947 PolarHBondContact O-N 3.29Å
948	Y	36.8	Very low	40.8	Very low	146 Å²	146	79.1 Å²	79.1	57%	0.573	43%	0.434	S	S	*	.	H	α-helix	trans	-83.2	-42.4	-177.5	-151.1	-94.4	0	0	0	111.8	W85 L944 A945 G950 T952	W85-Y948 AromaticContact CE2-CD2 3.8Å; W85-Y948 AromaticContact CZ2-CD2 3.6Å; W85-Y948 HydrophobicContact CZ2-CD2 3.6Å; W85-Y948 HydrophobicContact CZ2-CE2 4.48Å; W85-Y948 HydrophobicContact CZ2-CG 4.43Å; W85-Y948 AromaticContact NE1-CD2 3.74Å; L944-Y948 PolarHBondContact O-N 2.79Å; A945-Y948 PolarHBondContact O-N 3.38Å; Y948-G950 PolarHBondContact O-N 3.1Å; Y948-T952 PolarHBondContact O-OG1 3.08Å
949	E	39.7	Very low	40.5	Very low	130 Å²	130	80.1 Å²	80.1	61%	0.607	43%	0.429	S	S	*	.	H	α-helix	trans	-67.6	-33.5	-174.7	-75.5	-173.2	164	0	0	114.1	A945 W951	A945-E949 PolarHBondContact O-N 2.86Å; E949-W951 PolarHBondContact O-N 2.85Å
950	G	40.2	Very low	40.2	Very low	18 Å²	18	78.6 Å²	78.6	19%	0.186	43%	0.432	C	S	.	.	H	α-helix	trans	-62.4	-32.6	-176.3	0	0	0	0	0	113.6	L902 Y948	L902-G950 WeakPolarHBondContact CD2-O 3.49Å; Y948-G950 PolarHBondContact O-N 3.1Å
951	W	32	Very low	39.3	Very low	24 Å²	24	79.9 Å²	79.9	9%	0.091	44%	0.439	C	S	.	.	H	α-helix	trans	-84.1	-34.5	-172.8	-119.8	65.8	0	0	0	113.6	L74 W77 F899 E949 A953 W954 V955	L74-W951 HydrophobicContact CD1-CH2 3.9Å; L74-W951 HydrophobicContact CD1-CZ3 3.5Å; W77-W951 HydrophobicContact CB-CH2 3.31Å; W77-W951 HydrophobicContact CB-CZ2 4.03Å; W77-W951 HydrophobicContact CB-CZ3 3.82Å; W77-W951 AromaticContact CD1-CD2 3.65Å; W77-W951 AromaticContact CD1-CE2 3.7Å; W77-W951 AromaticContact CD1-CE3 3.23Å; W77-W951 AromaticContact CD1-CH2 3.03Å; W77-W951 AromaticContact CD1-CZ2 3.44Å; W77-W951 VanDerWaalsContact CD1-CZ2 3.44Å; W77-W951 AromaticContact CD1-CZ3 2.88Å; W77-W951 HydrophobicContact CD2-CD2 4.28Å; W77-W951 AromaticContact CD2-CE2 3.55Å; W77-W951 HydrophobicContact CD2-CE3 4.45Å; W77-W951 AromaticContact CD2-CH2 3.28Å; W77-W951 HydrophobicContact CD2-CH2 3.28Å; W77-W951 AromaticContact CD2-CZ2 2.99Å; W77-W951 HydrophobicContact CD2-CZ2 2.99Å; W77-W951 AromaticContact CD2-CZ3 4Å; W77-W951 HydrophobicContact CD2-CZ3 4Å; W77-W951 AromaticContact CE2-CD2 3.52Å; W77-W951 AromaticContact CE2-CE2 2.97Å; W77-W951 AromaticContact CE2-CE3 3.98Å; W77-W951 AromaticContact CE2-CH2 3.58Å; W77-W951 AromaticContact CE2-CZ2 3.03Å; W77-W951 AromaticContact CE2-CZ3 3.99Å; W77-W951 AromaticContact CE2-NE1 3.34Å; W77-W951 VanDerWaalsContact CE2-NE1 3.34Å; W77-W951 HydrophobicContact CE3-CH2 4.02Å; W77-W951 AromaticContact CE3-CZ2 3.49Å; W77-W951 HydrophobicContact CE3-CZ2 3.49Å; W77-W951 VanDerWaalsContact CE3-CZ2 3.49Å; W77-W951 HydrophobicContact CG-CD2 4.32Å; W77-W951 AromaticContact CG-CE2 3.93Å; W77-W951 HydrophobicContact CG-CE3 4.02Å; W77-W951 AromaticContact CG-CH2 2.88Å; W77-W951 HydrophobicContact CG-CH2 2.88Å; W77-W951 AromaticContact CG-CZ2 3.24Å; W77-W951 HydrophobicContact CG-CZ2 3.24Å; W77-W951 AromaticContact CG-CZ3 3.31Å; W77-W951 HydrophobicContact CG-CZ3 3.31Å; W77-W951 AromaticContact CH2-CE2 3.71Å; W77-W951 AromaticContact CH2-CZ2 3.79Å; W77-W951 HydrophobicContact CH2-CZ2 3.79Å; W77-W951 AromaticContact CH2-NE1 3.35Å; W77-W951 AromaticContact CZ2-CD1 3.58Å; W77-W951 AromaticContact CZ2-CD2 3.86Å; W77-W951 HydrophobicContact CZ2-CD2 3.86Å; W77-W951 AromaticContact CZ2-CE2 3.11Å; W77-W951 HydrophobicContact CZ2-CG 4.16Å; W77-W951 HydrophobicContact CZ2-CH2 4.44Å; W77-W951 AromaticContact CZ2-CZ2 3.48Å; W77-W951 HydrophobicContact CZ2-CZ2 3.48Å; W77-W951 VanDerWaalsContact CZ2-CZ2 3.48Å; W77-W951 AromaticContact CZ2-NE1 2.87Å; W77-W951 AromaticContact CZ3-CZ2 3.86Å; W77-W951 HydrophobicContact CZ3-CZ2 3.86Å; W77-W951 AromaticContact NE1-CD2 3.11Å; W77-W951 AromaticContact NE1-CE2 3.13Å; W77-W951 AromaticContact NE1-CE3 3.21Å; W77-W951 AromaticContact NE1-CG 3.88Å; W77-W951 AromaticContact NE1-CH2 3.45Å; W77-W951 AromaticContact NE1-CZ2 3.33Å; W77-W951 VanDerWaalsContact NE1-CZ2 3.33Å; W77-W951 AromaticContact NE1-CZ3 3.36Å; W77-W951 AromaticContact NE1-NE1 3.77Å; F899-W951 HydrophobicContact CE2-CZ2 4.15Å; E949-W951 PolarHBondContact O-N 2.85Å; W951-A953 VanDerWaalsContact C-N 3.35Å; W951-A953 PolarHBondContact O-N 3.13Å; W951-W954 PolarHBondContact O-N 2.64Å; W951-V955 HydrophobicContact CE3-CG2 4.34Å; W951-V955 HydrophobicContact CZ3-CG2 4.25Å
952	T	37.2	Very low	38.8	Very low	96 Å²	96	78.1 Å²	78.1	59%	0.589	43%	0.425	S	S	*	.	H	α-helix	trans	-69.1	-29.6	-175.9	-15.7	0	0	0	0	113.5	Y948 W954	Y948-T952 PolarHBondContact O-OG1 3.08Å; T952-W954 VanDerWaalsContact C-N 3.35Å
953	A	34.1	Very low	38.1	Very low	93 Å²	93	75.7 Å²	75.7	77%	0.769	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.6	-177.9	0	0	0	0	0	113.9	W951	W951-A953 VanDerWaalsContact C-N 3.35Å; W951-A953 PolarHBondContact O-N 3.13Å
954	W	33.5	Very low	37.5	Very low	103 Å²	103	76.4 Å²	76.4	39%	0.39	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-32.6	-176.1	-174.9	78.6	0	0	0	113.9	F899 W951 T952	F899-W954 HydrophobicContact CB-CD2 4.43Å; F899-W954 HydrophobicContact CB-CZ2 4.22Å; F899-W954 AromaticContact CD2-CD2 3.62Å; F899-W954 HydrophobicContact CD2-CD2 3.62Å; F899-W954 AromaticContact CD2-CE2 3.73Å; F899-W954 AromaticContact CD2-CE3 3.75Å; F899-W954 HydrophobicContact CD2-CE3 3.75Å; F899-W954 HydrophobicContact CD2-CG 4.16Å; F899-W954 HydrophobicContact CD2-CH2 4.09Å; F899-W954 AromaticContact CD2-CZ2 3.98Å; F899-W954 HydrophobicContact CD2-CZ2 3.98Å; F899-W954 AromaticContact CD2-CZ3 3.99Å; F899-W954 HydrophobicContact CD2-CZ3 3.99Å; F899-W954 HydrophobicContact CE2-CD2 4.27Å; F899-W954 AromaticContact CE2-CE3 3.91Å; F899-W954 HydrophobicContact CE2-CE3 3.91Å; F899-W954 HydrophobicContact CE2-CH2 4.17Å; F899-W954 AromaticContact CE2-CZ3 3.86Å; F899-W954 HydrophobicContact CE2-CZ3 3.86Å; F899-W954 HydrophobicContact CG-CD2 4.29Å; F899-W954 AromaticContact CG-CE2 3.93Å; F899-W954 HydrophobicContact CG-CH2 4.4Å; F899-W954 AromaticContact CG-CZ2 4Å; F899-W954 HydrophobicContact CG-CZ2 4Å; W951-W954 PolarHBondContact O-N 2.64Å; T952-W954 VanDerWaalsContact C-N 3.35Å
955	V	32	Very low	37.1	Very low	120 Å²	120	78.5 Å²	78.5	73%	0.727	43%	0.43	S	S	*	.			trans	-69.1	0	169.7	-178.6	0	0	0	0	109.4	L74 W951	L74-V955 HydrophobicContact CD1-CG1 4.18Å; L74-V955 HydrophobicContact CD1-CG2 3.5Å; L74-V955 VanDerWaalsContact CD1-CG2 3.5Å; L74-V955 HydrophobicContact CD2-CG1 3.88Å; W951-V955 HydrophobicContact CE3-CG2 4.34Å; W951-V955 HydrophobicContact CZ3-CG2 4.25Å

Retrieved 955 of 955 residues in 5365.3 ms (Link to these results)

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