A0A3Q0KM36_SCHMA Loading...

Conserved oligomeric Golgi complex subunit 5

AlphaFold DB , UniProt , Accession A0A3Q0KM36, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 937 aa.

						>A0A3Q0KM36_SCHMA|A0A3Q0KM36
MDENLENFSNADFDARLFVSYIIGTNKVSNVLCTIDNRIRELASLIYQHVADNHVDLFKRASDIDNLQNVLQAVEDKIRNLSISLSKVKKKIDTPHETLSTNVTHFKNLHTTCAVLRNISRIATLMKRIQSRSKDLCQCAMYVNELDFIFNSMEWEGIHVLESYNRALVQVRESMVSQAWSLINSSYELSDQTQLATGLQVFYHLNMLMDVIHELVTKWKSEFVSVLSSSVDIDSLTQRMRTRQKIQQGGSGPGRASLSAVGGQAAAFHVTIWTSLDGTIDKMEQLISCSRLLGLTLMKQRETHIDVCMTSICRLDQYISELYPSLAELLIHEMLINWQNNKNSEKYSSILLIFASANFKETLTPQENNIDSSSSIDNAISHNQINDNRADIRNALISNEGFLGWASDQLATKLSIVSNQSPVIKEVLEGEYPKLLKLILDLERRVTSTFSNEFSNDSNYDQYTLSPIHHQTTLEQLPSCLVRALHPFETAYLSRSVSRLFDRVTLAFSTSTTAGPDTNELNDIIQTAANELGYVTVHHDLLLKVTRNLDKLIALFATKTEALISSGGISAVQLTDSQTLGQQSNIHLVNLLCQFGTNLQLTVNKRLSNLNTITASNINHKRYNKSSTCLDGTFPLTTTIETMTPIKNPLQLISESTRNHLNNLCISILNPFLLAISNKIDEILSSMHNEYDSYQNVSVNELNSKSKYLQDLQNFTARVRQQYLFDLSQPPKFVNTISNVFTQSGCYVCGEFALQDALKPILTMCVNSYLWRSTLIRSSKESVRLKLAADYKEFELALMPLCSPNYGYTLSKLIPESYEQLREFPSILSMENEQLVQTYAKENSVGSSSNHVLPSMICQHMFSRAPDEIRYPHIIAGWSTNYYVSWLVKRENDTERLIFLRNGLSAYVHEVQIRQQREYPPIYLQLKEFLDYHIGKD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.5	Very low	55.8	Low	219 Å²	219	114.3 Å²	114.3	100%	1.079	62%	0.62	S	S	*	*				0	77.6	0	-71.6	-81.9	-99.3	0	0	105.3
2	D	48.4	Very low	56.3	Low	85 Å²	85	117.9 Å²	117.9	46%	0.455	64%	0.639	S	S	.	*			trans	-88.6	129.4	-179.9	-76.1	-50.2	0	0	0	107.8	N4 L5	D2-N4 PolarHBondContact O-N 2.89Å; D2-L5 HydrophobicContact CB-CD1 4.45Å; D2-L5 PolarHBondContact O-N 2.9Å
3	E	55.1	Low	56.9	Low	180 Å²	180	114.2 Å²	114.2	84%	0.841	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	-18.9	-175.3	-78.8	177.4	143.7	0	0	114.5	L5	E3-L5 VanDerWaalsContact C-N 3.31Å; E3-L5 PolarHBondContact O-N 2.77Å
4	N	53.6	Low	57.6	Low	87 Å²	87	112 Å²	112	47%	0.465	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-12	175.6	-67.6	-38.4	0	0	0	114.3	D2	D2-N4 PolarHBondContact O-N 2.89Å
5	L	56.3	Low	58	Low	62 Å²	62	108.3 Å²	108.3	33%	0.325	59%	0.592	S	S	.	*	S	Bend	trans	-99.3	-17.2	-175.5	-87.2	151.5	0	0	0	114.6	D2 E3 N7 F8	D2-L5 HydrophobicContact CB-CD1 4.45Å; D2-L5 PolarHBondContact O-N 2.9Å; E3-L5 VanDerWaalsContact C-N 3.31Å; E3-L5 PolarHBondContact O-N 2.77Å; L5-N7 VanDerWaalsContact C-N 3.26Å; L5-N7 PolarHBondContact O-N 3.35Å; L5-F8 HydrophobicContact CD2-CD2 4.37Å; L5-F8 PolarHBondContact O-N 3.25Å
6	E	59.5	Low	58.5	Low	138 Å²	138	114.2 Å²	114.2	65%	0.645	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-64.9	-32.7	172.7	-92.2	-176	165.7	0	0	111.8	F8 S9	E6-F8 PolarHBondContact O-N 3.46Å; E6-S9 PolarHBondContact O-N 2.88Å; E6-S9 VanDerWaalsContact O-N 3.16Å
7	N	56	Low	58.7	Low	78 Å²	78	114.9 Å²	114.9	42%	0.417	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-60.2	-29.4	176.3	-77.3	-20.4	0	0	0	113.1	L5 F13	L5-N7 VanDerWaalsContact C-N 3.26Å; L5-N7 PolarHBondContact O-N 3.35Å; N7-F13 HydrophobicContact CB-CD2 4.38Å; N7-F13 HydrophobicContact CB-CE2 4.39Å; N7-F13 WeakPolarHBondContact O-CD2 3.48Å
8	F	58.3	Low	59.1	Low	81 Å²	81	110.1 Å²	110.1	36%	0.355	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-80.7	-14.6	-179.9	-72.5	-82.1	0	0	0	114.5	L5 E6 F13 F18 I35	L5-F8 HydrophobicContact CD2-CD2 4.37Å; L5-F8 PolarHBondContact O-N 3.25Å; E6-F8 PolarHBondContact O-N 3.46Å; F8-F13 HydrophobicContact CD1-CD1 4.37Å; F8-F13 AromaticContact CD1-CE1 3.75Å; F8-F13 HydrophobicContact CD1-CE1 3.75Å; F8-F13 HydrophobicContact CD1-CE2 4.01Å; F8-F13 AromaticContact CD1-CZ 3.54Å; F8-F13 HydrophobicContact CD1-CZ 3.54Å; F8-F13 AromaticContact CE1-CE1 3.69Å; F8-F13 HydrophobicContact CE1-CE1 3.69Å; F8-F13 HydrophobicContact CE1-CE2 4.01Å; F8-F13 AromaticContact CE1-CZ 3.26Å; F8-F13 HydrophobicContact CE1-CZ 3.26Å; F8-F13 HydrophobicContact CG-CE2 4.4Å; F8-F13 HydrophobicContact CG-CZ 4.35Å; F8-F13 HydrophobicContact CZ-CE2 4.39Å; F8-F13 AromaticContact CZ-CZ 3.88Å; F8-F13 HydrophobicContact CZ-CZ 3.88Å; F8-F18 HydrophobicContact CE1-CE1 4.49Å; F8-F18 AromaticContact CE2-CE1 3.79Å; F8-F18 HydrophobicContact CE2-CE1 3.79Å; F8-F18 AromaticContact CE2-CZ 3.68Å; F8-F18 HydrophobicContact CE2-CZ 3.68Å; F8-F18 HydrophobicContact CZ-CD1 4.13Å; F8-F18 AromaticContact CZ-CE1 3.46Å; F8-F18 HydrophobicContact CZ-CE1 3.46Å; F8-F18 VanDerWaalsContact CZ-CE1 3.46Å; F8-F18 AromaticContact CZ-CZ 3.88Å; F8-F18 HydrophobicContact CZ-CZ 3.88Å; F8-I35 HydrophobicContact CE1-CD1 4.33Å; F8-I35 HydrophobicContact CE2-CD1 3.82Å; F8-I35 HydrophobicContact CE2-CG1 4.44Å; F8-I35 HydrophobicContact CZ-CD1 3.48Å; F8-I35 VanDerWaalsContact CZ-CD1 3.48Å; F8-I35 HydrophobicContact CZ-CG1 4.48Å
9	S	59.8	Low	59.3	Low	111 Å²	111	108.5 Å²	108.5	78%	0.776	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-96.3	-4.7	177.8	-60	0	0	0	0	113	E6	E6-S9 PolarHBondContact O-N 2.88Å; E6-S9 VanDerWaalsContact O-N 3.16Å
10	N	59.9	Low	59.5	Low	109 Å²	109	107.1 Å²	107.1	58%	0.583	57%	0.574	S	S	*	*	S	Bend	trans	-78.3	135.1	175.7	-97.5	-25.7	0	0	0	111.2	D12 F13	N10-D12 PolarHBondContact O-N 3.38Å; N10-F13 WeakPolarHBondContact O-CB 3.22Å; N10-F13 PolarHBondContact O-N 3.09Å
11	A	62.7	Low	59.6	Low	107 Å²	107	109.8 Å²	109.8	88%	0.884	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-23.8	-178.3	0	0	0	0	0	113.9
12	D	62	Low	60.4	Low	158 Å²	158	100.2 Å²	100.2	85%	0.845	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	25.6	-178.9	-64.4	-33	0	0	0	113.6	N10 D14	N10-D12 PolarHBondContact O-N 3.38Å; D12-D14 PolarHBondContact O-N 3.38Å
13	F	64.3	Low	61.1	Low	69 Å²	69	101.4 Å²	101.4	30%	0.303	54%	0.535	S	S	.	.			trans	-64.2	106.2	180	178.2	-104.6	0	0	0	112.2	N7 F8 N10 A15 F18	N7-F13 HydrophobicContact CB-CD2 4.38Å; N7-F13 HydrophobicContact CB-CE2 4.39Å; N7-F13 WeakPolarHBondContact O-CD2 3.48Å; F8-F13 HydrophobicContact CD1-CD1 4.37Å; F8-F13 AromaticContact CD1-CE1 3.75Å; F8-F13 HydrophobicContact CD1-CE1 3.75Å; F8-F13 HydrophobicContact CD1-CE2 4.01Å; F8-F13 AromaticContact CD1-CZ 3.54Å; F8-F13 HydrophobicContact CD1-CZ 3.54Å; F8-F13 AromaticContact CE1-CE1 3.69Å; F8-F13 HydrophobicContact CE1-CE1 3.69Å; F8-F13 HydrophobicContact CE1-CE2 4.01Å; F8-F13 AromaticContact CE1-CZ 3.26Å; F8-F13 HydrophobicContact CE1-CZ 3.26Å; F8-F13 HydrophobicContact CG-CE2 4.4Å; F8-F13 HydrophobicContact CG-CZ 4.35Å; F8-F13 HydrophobicContact CZ-CE2 4.39Å; F8-F13 AromaticContact CZ-CZ 3.88Å; F8-F13 HydrophobicContact CZ-CZ 3.88Å; N10-F13 WeakPolarHBondContact O-CB 3.22Å; N10-F13 PolarHBondContact O-N 3.09Å; F13-A15 HydrophobicContact CE1-CB 4.19Å; F13-F18 HydrophobicContact CE2-CB 4Å; F13-F18 HydrophobicContact CE2-CD1 4.28Å; F13-F18 HydrophobicContact CE2-CD2 4.26Å; F13-F18 AromaticContact CE2-CG 3.94Å; F13-F18 HydrophobicContact CE2-CG 3.94Å; F13-F18 HydrophobicContact CZ-CB 4.16Å; F13-F18 HydrophobicContact CZ-CD1 4.06Å; F13-F18 HydrophobicContact CZ-CG 4.13Å
14	D	66.2	Low	61.4	Low	84 Å²	84	96.1 Å²	96.1	45%	0.449	53%	0.529	S	S	.	.			trans	-92.9	108.1	170.4	-167.7	-14.4	0	0	0	111	D12 R16 L17 F18	D12-D14 PolarHBondContact O-N 3.38Å; D14-R16 PolarHBondContact O-N 3.37Å; D14-R16 VanDerWaalsContact O-N 3.09Å; D14-R16 PolarHBondContact OD1-N 3.23Å; D14-L17 PolarHBondContact O-N 3.49Å; D14-F18 PolarHBondContact O-N 3.33Å
15	A	63.7	Low	61.8	Low	56 Å²	56	94.8 Å²	94.8	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-54.9	-28.3	179.1	0	0	0	0	0	113.2	F13 V19	F13-A15 HydrophobicContact CE1-CB 4.19Å; A15-V19 WeakPolarHBondContact O-CG2 3.25Å; A15-V19 PolarHBondContact O-N 3.15Å; A15-V19 VanDerWaalsContact O-N 3.17Å
16	R	66.1	Low	61.8	Low	203 Å²	203	99.3 Å²	99.3	77%	0.766	55%	0.549	S	S	*	.	H	α-helix	trans	-76.2	-37.8	-175.8	-65.4	-178.5	-176.9	179.2	2.8	113.2	D14 S20	D14-R16 PolarHBondContact O-N 3.37Å; D14-R16 VanDerWaalsContact O-N 3.09Å; D14-R16 PolarHBondContact OD1-N 3.23Å; R16-S20 PolarHBondContact O-N 3.44Å; R16-S20 VanDerWaalsContact O-N 3.15Å; R16-S20 PolarHBondContact O-OG 3.41Å
17	L	62.1	Low	61.8	Low	126 Å²	126	99.5 Å²	99.5	66%	0.66	55%	0.547	S	S	*	.	H	α-helix	trans	-69.1	-40.4	176.6	-83.3	167.5	0	0	0	111.2	D14 S20 Y21	D14-L17 PolarHBondContact O-N 3.49Å; L17-S20 PolarHBondContact O-N 2.6Å; L17-Y21 PolarHBondContact O-N 3.24Å
18	F	65.8	Low	62.1	Low	29 Å²	29	98.9 Å²	98.9	13%	0.127	55%	0.547	C	S	.	.	H	α-helix	trans	-63.8	-43.5	177.5	-173.1	-108	0	0	0	112.2	F8 F13 D14 S20 Y21 I22 V31	F8-F18 HydrophobicContact CE1-CE1 4.49Å; F8-F18 AromaticContact CE2-CE1 3.79Å; F8-F18 HydrophobicContact CE2-CE1 3.79Å; F8-F18 AromaticContact CE2-CZ 3.68Å; F8-F18 HydrophobicContact CE2-CZ 3.68Å; F8-F18 HydrophobicContact CZ-CD1 4.13Å; F8-F18 AromaticContact CZ-CE1 3.46Å; F8-F18 HydrophobicContact CZ-CE1 3.46Å; F8-F18 VanDerWaalsContact CZ-CE1 3.46Å; F8-F18 AromaticContact CZ-CZ 3.88Å; F8-F18 HydrophobicContact CZ-CZ 3.88Å; F13-F18 HydrophobicContact CE2-CB 4Å; F13-F18 HydrophobicContact CE2-CD1 4.28Å; F13-F18 HydrophobicContact CE2-CD2 4.26Å; F13-F18 AromaticContact CE2-CG 3.94Å; F13-F18 HydrophobicContact CE2-CG 3.94Å; F13-F18 HydrophobicContact CZ-CB 4.16Å; F13-F18 HydrophobicContact CZ-CD1 4.06Å; F13-F18 HydrophobicContact CZ-CG 4.13Å; D14-F18 PolarHBondContact O-N 3.33Å; F18-S20 VanDerWaalsContact C-N 3.32Å; F18-S20 PolarHBondContact O-N 3.33Å; F18-Y21 PolarHBondContact O-N 3.22Å; F18-I22 HydrophobicContact CD1-CD1 3.53Å; F18-I22 HydrophobicContact CD2-CD1 4.19Å; F18-I22 HydrophobicContact CE1-CD1 3.19Å; F18-I22 HydrophobicContact CE2-CD1 3.89Å; F18-I22 HydrophobicContact CG-CD1 4.04Å; F18-I22 HydrophobicContact CZ-CD1 3.41Å; F18-I22 VanDerWaalsContact CZ-CD1 3.41Å; F18-I22 VanDerWaalsContact O-CG1 3.25Å; F18-I22 WeakPolarHBondContact O-CG1 3.3Å; F18-I22 PolarHBondContact O-N 3.18Å; F18-I22 VanDerWaalsContact O-N 3.15Å; F18-V31 HydrophobicContact CE1-CG1 4.12Å; F18-V31 HydrophobicContact CZ-CG1 4.01Å
19	V	62.8	Low	62.5	Low	80 Å²	80	99.5 Å²	99.5	49%	0.485	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-39.2	175.1	171.2	0	0	0	0	111.4	A15 I22 I23	A15-V19 WeakPolarHBondContact O-CG2 3.25Å; A15-V19 PolarHBondContact O-N 3.15Å; A15-V19 VanDerWaalsContact O-N 3.17Å; V19-I22 PolarHBondContact O-N 3.15Å; V19-I23 HydrophobicContact CG1-CD1 3.73Å; V19-I23 HydrophobicContact CG1-CG1 4.39Å; V19-I23 VanDerWaalsContact O-CG1 3.3Å; V19-I23 WeakPolarHBondContact O-CG1 3.03Å; V19-I23 PolarHBondContact O-N 3.41Å
20	S	62.8	Low	62.7	Low	79 Å²	79	99.8 Å²	99.8	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-66.9	-39.3	179.2	-59.1	0	0	0	0	112.8	R16 L17 F18 I22 G24	R16-S20 PolarHBondContact O-N 3.44Å; R16-S20 VanDerWaalsContact O-N 3.15Å; R16-S20 PolarHBondContact O-OG 3.41Å; L17-S20 PolarHBondContact O-N 2.6Å; F18-S20 VanDerWaalsContact C-N 3.32Å; F18-S20 PolarHBondContact O-N 3.33Å; S20-I22 VanDerWaalsContact C-N 3.34Å; S20-G24 PolarHBondContact O-N 3.41Å; S20-G24 VanDerWaalsContact O-N 3.15Å
21	Y	62.4	Low	62.9	Low	164 Å²	164	95.3 Å²	95.3	64%	0.643	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-37	175	-179	-100.6	0	0	0	112.6	L17 F18 G24 T25	L17-Y21 PolarHBondContact O-N 3.24Å; F18-Y21 PolarHBondContact O-N 3.22Å; Y21-G24 PolarHBondContact O-N 3.16Å; Y21-T25 HydrophobicContact CE1-CG2 4.38Å; Y21-T25 HydrophobicContact CE2-CG2 4.42Å; Y21-T25 WeakPolarHBondContact O-CG2 3.48Å; Y21-T25 PolarHBondContact O-N 3.45Å; Y21-T25 PolarHBondContact O-OG1 3.43Å
22	I	61.3	Low	63.1	Low	18 Å²	18	95.9 Å²	95.9	9%	0.092	52%	0.518	C	S	.	.	H	α-helix	trans	-76.3	-33.3	-178.2	-67	172.7	0	0	0	111.9	F18 V19 S20 T25 N26 V28 V31	F18-I22 HydrophobicContact CD1-CD1 3.53Å; F18-I22 HydrophobicContact CD2-CD1 4.19Å; F18-I22 HydrophobicContact CE1-CD1 3.19Å; F18-I22 HydrophobicContact CE2-CD1 3.89Å; F18-I22 HydrophobicContact CG-CD1 4.04Å; F18-I22 HydrophobicContact CZ-CD1 3.41Å; F18-I22 VanDerWaalsContact CZ-CD1 3.41Å; F18-I22 VanDerWaalsContact O-CG1 3.25Å; F18-I22 WeakPolarHBondContact O-CG1 3.3Å; F18-I22 PolarHBondContact O-N 3.18Å; F18-I22 VanDerWaalsContact O-N 3.15Å; V19-I22 PolarHBondContact O-N 3.15Å; S20-I22 VanDerWaalsContact C-N 3.34Å; I22-T25 PolarHBondContact O-OG1 3.26Å; I22-N26 PolarHBondContact O-N 3.42Å; I22-V28 VanDerWaalsContact CG2-CA 3.43Å; I22-V28 HydrophobicContact CG2-CB 4.04Å; I22-V28 HydrophobicContact CG2-CG2 3.7Å; I22-V31 HydrophobicContact CD1-CB 4.3Å; I22-V31 HydrophobicContact CD1-CG1 4.02Å; I22-V31 HydrophobicContact CD1-CG2 4.15Å
23	I	62	Low	63.8	Low	110 Å²	110	91.9 Å²	91.9	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-67.6	-41.7	172.4	-67.3	168.9	0	0	0	110.3	V19 T25 N26 V28	V19-I23 HydrophobicContact CG1-CD1 3.73Å; V19-I23 HydrophobicContact CG1-CG1 4.39Å; V19-I23 VanDerWaalsContact O-CG1 3.3Å; V19-I23 WeakPolarHBondContact O-CG1 3.03Å; V19-I23 PolarHBondContact O-N 3.41Å; I23-T25 VanDerWaalsContact C-N 3.28Å; I23-T25 PolarHBondContact O-N 3.31Å; I23-N26 PolarHBondContact O-N 3.16Å; I23-V28 HydrophobicContact CG1-CG2 4.33Å
24	G	61.8	Low	64.1	Low	69 Å²	69	91 Å²	91	71%	0.711	50%	0.502	S	S	*	.	H	α-helix	trans	-66.5	-24	178.4	0	0	0	0	0	114.9	S20 Y21	S20-G24 PolarHBondContact O-N 3.41Å; S20-G24 VanDerWaalsContact O-N 3.15Å; Y21-G24 PolarHBondContact O-N 3.16Å
25	T	61.6	Low	64.3	Low	60 Å²	60	89.5 Å²	89.5	37%	0.368	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	2.5	-179.4	51.7	0	0	0	0	114	Y21 I22 I23 K27	Y21-T25 HydrophobicContact CE1-CG2 4.38Å; Y21-T25 HydrophobicContact CE2-CG2 4.42Å; Y21-T25 WeakPolarHBondContact O-CG2 3.48Å; Y21-T25 PolarHBondContact O-N 3.45Å; Y21-T25 PolarHBondContact O-OG1 3.43Å; I22-T25 PolarHBondContact O-OG1 3.26Å; I23-T25 VanDerWaalsContact C-N 3.28Å; I23-T25 PolarHBondContact O-N 3.31Å; T25-K27 PolarHBondContact O-N 3.19Å; T25-K27 VanDerWaalsContact O-N 3.09Å
26	N	55.9	Low	64.9	Low	157 Å²	157	90.3 Å²	90.3	84%	0.84	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	29.7	179	-123.4	1.5	0	0	0	114.4	I22 I23	I22-N26 PolarHBondContact O-N 3.42Å; I23-N26 PolarHBondContact O-N 3.16Å
27	K	61.2	Low	65.4	Low	141 Å²	141	84.7 Å²	84.7	61%	0.613	48%	0.475	S	S	*	.			trans	-114.2	23	-177.9	-77.3	-176.8	-179.5	-180	0	113.8	T25 S29 N30	T25-K27 PolarHBondContact O-N 3.19Å; T25-K27 VanDerWaalsContact O-N 3.09Å; K27-S29 VanDerWaalsContact C-N 3.3Å; K27-S29 PolarHBondContact O-N 3.35Å; K27-N30 PolarHBondContact O-N 3.15Å
28	V	62.3	Low	65.9	Low	66 Å²	66	84.4 Å²	84.4	40%	0.4	47%	0.465	S	S	.	.	H	α-helix	trans	-52.6	-43.5	-178.4	-179	0	0	0	0	113	I22 I23 N30 L32	I22-V28 VanDerWaalsContact CG2-CA 3.43Å; I22-V28 HydrophobicContact CG2-CB 4.04Å; I22-V28 HydrophobicContact CG2-CG2 3.7Å; I23-V28 HydrophobicContact CG1-CG2 4.33Å; V28-N30 PolarHBondContact O-N 3.41Å; V28-L32 PolarHBondContact O-N 3.03Å
29	S	65.9	Low	66.5	Low	94 Å²	94	88 Å²	88	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-65.1	-39.2	-174	-167.4	0	0	0	0	113.4	K27 C33	K27-S29 VanDerWaalsContact C-N 3.3Å; K27-S29 PolarHBondContact O-N 3.35Å; S29-C33 PolarHBondContact O-N 3.44Å
30	N	63.8	Low	67.2	Low	116 Å²	116	91.4 Å²	91.4	62%	0.62	49%	0.489	S	S	*	.	H	α-helix	trans	-69.8	-39.5	-177	-84.9	1.1	0	0	0	112.4	K27 V28 T34	K27-N30 PolarHBondContact O-N 3.15Å; V28-N30 PolarHBondContact O-N 3.41Å; N30-T34 PolarHBondContact O-N 3.01Å; N30-T34 PolarHBondContact O-OG1 2.76Å
31	V	63.4	Low	67.9	Low	16 Å²	16	92.3 Å²	92.3	10%	0.097	48%	0.484	C	S	.	.	H	α-helix	trans	-68.5	-41.2	180	-179.6	0	0	0	0	110.7	F18 I22 C33 T34 I35	F18-V31 HydrophobicContact CE1-CG1 4.12Å; F18-V31 HydrophobicContact CZ-CG1 4.01Å; I22-V31 HydrophobicContact CD1-CB 4.3Å; I22-V31 HydrophobicContact CD1-CG1 4.02Å; I22-V31 HydrophobicContact CD1-CG2 4.15Å; V31-C33 PolarHBondContact O-N 3.15Å; V31-T34 PolarHBondContact O-N 3.17Å; V31-I35 HydrophobicContact CG1-CD1 4.11Å; V31-I35 PolarHBondContact O-N 3.1Å; V31-I35 VanDerWaalsContact O-N 3.15Å
32	L	68.5	Low	68.6	Low	119 Å²	119	89.9 Å²	89.9	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-63.3	-41.8	178.9	-135.9	114.1	0	0	0	112.1	V28 T34 I35 D36	V28-L32 PolarHBondContact O-N 3.03Å; L32-T34 VanDerWaalsContact C-N 3.3Å; L32-T34 PolarHBondContact O-N 3.44Å; L32-I35 PolarHBondContact O-N 2.98Å; L32-D36 WeakPolarHBondContact O-CB 3.44Å; L32-D36 PolarHBondContact O-N 3.21Å
33	C	75	Confident	69.4	Low	73 Å²	73	91.7 Å²	91.7	49%	0.493	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-36	177.6	-168	0	0	0	0	112.2	S29 V31 N37	S29-C33 PolarHBondContact O-N 3.44Å; V31-C33 PolarHBondContact O-N 3.15Å; C33-N37 PolarHBondContact O-N 3.26Å; C33-N37 VanDerWaalsContact O-N 3.16Å; C33-N37 PolarHBondContact O-ND2 2.97Å
34	T	70.9	Confident	70.2	Confident	52 Å²	52	89.4 Å²	89.4	32%	0.319	49%	0.493	S	S	.	.	H	α-helix	trans	-69.2	-41.8	179.4	-44.8	0	0	0	0	111.8	N30 V31 L32 R38	N30-T34 PolarHBondContact O-N 3.01Å; N30-T34 PolarHBondContact O-OG1 2.76Å; V31-T34 PolarHBondContact O-N 3.17Å; L32-T34 VanDerWaalsContact C-N 3.3Å; L32-T34 PolarHBondContact O-N 3.44Å; T34-R38 PolarHBondContact O-N 2.89Å
35	I	71.1	Confident	70.8	Confident	52 Å²	52	91.6 Å²	91.6	27%	0.267	49%	0.488	S	S	.	.	H	α-helix	trans	-65.8	-45.8	177	-68	170.4	0	0	0	110.7	F8 V31 L32 N37 R38 I39	F8-I35 HydrophobicContact CE1-CD1 4.33Å; F8-I35 HydrophobicContact CE2-CD1 3.82Å; F8-I35 HydrophobicContact CE2-CG1 4.44Å; F8-I35 HydrophobicContact CZ-CD1 3.48Å; F8-I35 VanDerWaalsContact CZ-CD1 3.48Å; F8-I35 HydrophobicContact CZ-CG1 4.48Å; V31-I35 HydrophobicContact CG1-CD1 4.11Å; V31-I35 PolarHBondContact O-N 3.1Å; V31-I35 VanDerWaalsContact O-N 3.15Å; L32-I35 PolarHBondContact O-N 2.98Å; I35-N37 VanDerWaalsContact C-N 3.31Å; I35-N37 PolarHBondContact O-N 3.18Å; I35-R38 PolarHBondContact O-N 3.48Å; I35-R38 VanDerWaalsContact O-N 3.16Å; I35-I39 HydrophobicContact CG2-CD1 3.72Å; I35-I39 HydrophobicContact CG2-CG1 4.29Å; I35-I39 WeakPolarHBondContact O-CG1 3.49Å; I35-I39 PolarHBondContact O-N 2.96Å
36	D	77	Confident	71.5	Confident	73 Å²	73	93.6 Å²	93.6	39%	0.39	50%	0.495	S	S	.	.	H	α-helix	trans	-65.3	-35.9	-176.4	-160.7	46.3	0	0	0	112.2	L32 R40	L32-D36 WeakPolarHBondContact O-CB 3.44Å; L32-D36 PolarHBondContact O-N 3.21Å; D36-R40 WeakPolarHBondContact O-CG 3.44Å; D36-R40 PolarHBondContact O-N 3.45Å; D36-R40 IonicContact OD2-CZ 3.41Å; D36-R40 IonicContact OD2-NE 2.6Å; D36-R40 IonicContact OD2-NH2 3.49Å; D36-R40 PolarHBondContact OD2-NH2 2.97Å
37	N	76.2	Confident	72.6	Confident	84 Å²	84	95 Å²	95	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-39.1	173.8	-78.4	-19.5	0	0	0	112.8	C33 I35 R40 E41	C33-N37 PolarHBondContact O-N 3.26Å; C33-N37 VanDerWaalsContact O-N 3.16Å; C33-N37 PolarHBondContact O-ND2 2.97Å; I35-N37 VanDerWaalsContact C-N 3.31Å; I35-N37 PolarHBondContact O-N 3.18Å; N37-R40 PolarHBondContact O-N 3.37Å; N37-E41 PolarHBondContact O-N 3.16Å
38	R	72.8	Confident	73.4	Confident	120 Å²	120	93.9 Å²	93.9	45%	0.453	49%	0.487	S	S	.	.	H	α-helix	trans	-75.7	-34.9	-179.9	-69.3	-62.5	-178.7	-176.4	-5.6	113.1	T34 I35 R40 E41 L42	T34-R38 PolarHBondContact O-N 2.89Å; I35-R38 PolarHBondContact O-N 3.48Å; I35-R38 VanDerWaalsContact O-N 3.16Å; R38-R40 PolarHBondContact O-N 2.64Å; R38-E41 WeakPolarHBondContact CD-OE2 3.49Å; R38-E41 IonicContact CZ-OE2 3.48Å; R38-E41 IonicContact NE-OE2 2.67Å; R38-E41 IonicContact NH1-OE1 2.65Å; R38-E41 PolarHBondContact NH1-OE1 3.19Å; R38-E41 IonicContact NH1-OE2 2.71Å; R38-E41 PolarHBondContact NH1-OE2 3.04Å; R38-E41 PolarHBondContact O-N 3.38Å; R38-L42 PolarHBondContact O-N 3.31Å
39	I	77.8	Confident	74.1	Confident	105 Å²	105	97 Å²	97	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-59	-39.6	171.9	-70.4	173.5	0	0	0	110.2	I35 L42 A43	I35-I39 HydrophobicContact CG2-CD1 3.72Å; I35-I39 HydrophobicContact CG2-CG1 4.29Å; I35-I39 WeakPolarHBondContact O-CG1 3.49Å; I35-I39 PolarHBondContact O-N 2.96Å; I39-L42 PolarHBondContact O-N 3Å; I39-A43 VanDerWaalsContact O-CB 3.29Å; I39-A43 WeakPolarHBondContact O-CB 3.21Å; I39-A43 PolarHBondContact O-N 3.09Å
40	R	78.4	Confident	74.3	Confident	152 Å²	152	96.8 Å²	96.8	57%	0.574	49%	0.492	S	S	*	.	H	α-helix	trans	-66.7	-40.8	175.5	-72.3	-178.1	-144.3	162.2	2.2	113.3	D36 N37 R38 A43 S44	D36-R40 WeakPolarHBondContact O-CG 3.44Å; D36-R40 PolarHBondContact O-N 3.45Å; D36-R40 IonicContact OD2-CZ 3.41Å; D36-R40 IonicContact OD2-NE 2.6Å; D36-R40 IonicContact OD2-NH2 3.49Å; D36-R40 PolarHBondContact OD2-NH2 2.97Å; N37-R40 PolarHBondContact O-N 3.37Å; R38-R40 PolarHBondContact O-N 2.64Å; R40-A43 PolarHBondContact O-N 3.43Å; R40-S44 PolarHBondContact O-N 3.25Å
41	E	76.3	Confident	74.9	Confident	98 Å²	98	93.5 Å²	93.5	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-60.9	-45.6	174.5	-105.5	-177.9	173.1	0	0	111.9	N37 R38 S44 L45	N37-E41 PolarHBondContact O-N 3.16Å; R38-E41 WeakPolarHBondContact CD-OE2 3.49Å; R38-E41 IonicContact CZ-OE2 3.48Å; R38-E41 IonicContact NE-OE2 2.67Å; R38-E41 IonicContact NH1-OE1 2.65Å; R38-E41 PolarHBondContact NH1-OE1 3.19Å; R38-E41 IonicContact NH1-OE2 2.71Å; R38-E41 PolarHBondContact NH1-OE2 3.04Å; R38-E41 PolarHBondContact O-N 3.38Å; E41-S44 WeakPolarHBondContact O-CB 3.45Å; E41-S44 PolarHBondContact O-N 3.04Å; E41-S44 VanDerWaalsContact O-N 3.1Å; E41-S44 PolarHBondContact O-OG 3.22Å; E41-L45 PolarHBondContact O-N 3.28Å
42	L	77.8	Confident	75.4	Confident	112 Å²	112	98.6 Å²	98.6	59%	0.586	51%	0.507	S	S	*	.	H	α-helix	trans	-67.8	-38.5	-178.8	-155.5	134.1	0	0	0	111.5	R38 I39 S44 L45 I46	R38-L42 PolarHBondContact O-N 3.31Å; I39-L42 PolarHBondContact O-N 3Å; L42-S44 VanDerWaalsContact C-N 3.29Å; L42-S44 PolarHBondContact O-N 2.9Å; L42-L45 PolarHBondContact O-N 3.28Å; L42-I46 HydrophobicContact CD2-CD1 3.69Å; L42-I46 HydrophobicContact CD2-CG1 4.43Å; L42-I46 WeakPolarHBondContact O-CG1 3.26Å; L42-I46 PolarHBondContact O-N 3.39Å
43	A	77.4	Confident	75.5	Confident	56 Å²	56	96.9 Å²	96.9	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-40.9	170	0	0	0	0	0	111.4	I39 R40 Y47	I39-A43 VanDerWaalsContact O-CB 3.29Å; I39-A43 WeakPolarHBondContact O-CB 3.21Å; I39-A43 PolarHBondContact O-N 3.09Å; R40-A43 PolarHBondContact O-N 3.43Å; A43-Y47 WeakPolarHBondContact O-CB 3.41Å; A43-Y47 PolarHBondContact O-N 3.39Å
44	S	78.8	Confident	75.4	Confident	62 Å²	62	97.5 Å²	97.5	43%	0.434	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-41.2	178.1	85.7	0	0	0	0	112.8	R40 E41 L42 Y47 Q48	R40-S44 PolarHBondContact O-N 3.25Å; E41-S44 WeakPolarHBondContact O-CB 3.45Å; E41-S44 PolarHBondContact O-N 3.04Å; E41-S44 VanDerWaalsContact O-N 3.1Å; E41-S44 PolarHBondContact O-OG 3.22Å; L42-S44 VanDerWaalsContact C-N 3.29Å; L42-S44 PolarHBondContact O-N 2.9Å; S44-Y47 WeakPolarHBondContact O-CB 3.29Å; S44-Y47 PolarHBondContact O-N 3.36Å; S44-Q48 WeakPolarHBondContact O-CB 3.42Å; S44-Q48 PolarHBondContact O-N 2.91Å
45	L	75.2	Confident	75.7	Confident	116 Å²	116	99.2 Å²	99.2	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-66.9	-41.8	179.2	-80.8	167	0	0	0	112.2	E41 L42 Y47 Q48 H49	E41-L45 PolarHBondContact O-N 3.28Å; L42-L45 PolarHBondContact O-N 3.28Å; L45-Y47 VanDerWaalsContact C-N 3.32Å; L45-Q48 PolarHBondContact O-N 3.26Å; L45-H49 PolarHBondContact O-N 3.37Å
46	I	76	Confident	75.7	Confident	102 Å²	102	102.2 Å²	102.2	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-43.9	173.3	-69.5	173.4	0	0	0	109.9	L42 Q48 H49 V50	L42-I46 HydrophobicContact CD2-CD1 3.69Å; L42-I46 HydrophobicContact CD2-CG1 4.43Å; L42-I46 WeakPolarHBondContact O-CG1 3.26Å; L42-I46 PolarHBondContact O-N 3.39Å; I46-Q48 VanDerWaalsContact C-N 3.29Å; I46-Q48 PolarHBondContact O-N 3.01Å; I46-H49 PolarHBondContact O-N 3.44Å; I46-V50 HydrophobicContact CG2-CG2 4.3Å; I46-V50 WeakPolarHBondContact O-CB 3.48Å; I46-V50 VanDerWaalsContact O-CG2 3.26Å; I46-V50 WeakPolarHBondContact O-CG2 3.36Å; I46-V50 PolarHBondContact O-N 3Å
47	Y	78.8	Confident	75.5	Confident	185 Å²	185	105.1 Å²	105.1	73%	0.725	54%	0.536	S	S	*	.	H	α-helix	trans	-61.2	-41	179.1	-144.6	-87.9	0	0	0	111.7	A43 S44 L45 A51	A43-Y47 WeakPolarHBondContact O-CB 3.41Å; A43-Y47 PolarHBondContact O-N 3.39Å; S44-Y47 WeakPolarHBondContact O-CB 3.29Å; S44-Y47 PolarHBondContact O-N 3.36Å; L45-Y47 VanDerWaalsContact C-N 3.32Å; Y47-A51 WeakPolarHBondContact O-CB 3.14Å; Y47-A51 PolarHBondContact O-N 2.91Å
48	Q	78.9	Confident	75.5	Confident	119 Å²	119	108 Å²	108	56%	0.556	55%	0.545	S	S	*	.	H	α-helix	trans	-70.4	-40.9	-179.5	-154.9	160.8	5.4	0	0	112	S44 L45 I46 A51 D52	S44-Q48 WeakPolarHBondContact O-CB 3.42Å; S44-Q48 PolarHBondContact O-N 2.91Å; L45-Q48 PolarHBondContact O-N 3.26Å; I46-Q48 VanDerWaalsContact C-N 3.29Å; I46-Q48 PolarHBondContact O-N 3.01Å; Q48-A51 PolarHBondContact O-N 2.97Å; Q48-D52 PolarHBondContact O-N 3.05Å
49	H	75.3	Confident	75.8	Confident	130 Å²	130	108.9 Å²	108.9	60%	0.602	55%	0.552	S	S	*	*	H	α-helix	trans	-67.7	-37.9	176.6	-167	63.8	0	0	0	112.9	L45 I46 N53	L45-H49 PolarHBondContact O-N 3.37Å; I46-H49 PolarHBondContact O-N 3.44Å; H49-N53 PolarHBondContact CE1-ND2 3.2Å; H49-N53 VanDerWaalsContact CE1-ND2 3.28Å; H49-N53 PolarHBondContact O-N 3.31Å
50	V	71.9	Confident	75.6	Confident	90 Å²	90	113.4 Å²	113.4	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-66.7	-40.4	171.9	172.8	0	0	0	0	110.2	I46 D52 N53 H54	I46-V50 HydrophobicContact CG2-CG2 4.3Å; I46-V50 WeakPolarHBondContact O-CB 3.48Å; I46-V50 VanDerWaalsContact O-CG2 3.26Å; I46-V50 WeakPolarHBondContact O-CG2 3.36Å; I46-V50 PolarHBondContact O-N 3Å; V50-D52 PolarHBondContact O-N 3.5Å; V50-N53 PolarHBondContact O-N 2.67Å; V50-H54 VanDerWaalsContact O-CB 3.32Å; V50-H54 WeakPolarHBondContact O-CB 3.07Å; V50-H54 PolarHBondContact O-N 2.83Å
51	A	75.4	Confident	75.5	Confident	47 Å²	47	109 Å²	109	39%	0.388	56%	0.558	S	S	.	*	H	α-helix	trans	-65.5	-35.2	178	0	0	0	0	0	112.9	Y47 Q48 H54	Y47-A51 WeakPolarHBondContact O-CB 3.14Å; Y47-A51 PolarHBondContact O-N 2.91Å; Q48-A51 PolarHBondContact O-N 2.97Å; A51-H54 PolarHBondContact O-CE1 3.02Å; A51-H54 PolarHBondContact O-ND1 3.47Å
52	D	74	Confident	75.7	Confident	123 Å²	123	107.2 Å²	107.2	66%	0.658	56%	0.556	S	S	*	*	H	α-helix	trans	-77.5	-31.5	179.9	-70.6	-19.6	0	0	0	112.8	Q48 V50	Q48-D52 PolarHBondContact O-N 3.05Å; V50-D52 PolarHBondContact O-N 3.5Å
53	N	70.8	Confident	75.8	Confident	84 Å²	84	106.8 Å²	106.8	45%	0.449	56%	0.555	S	S	.	*	H	α-helix	trans	-109.2	4.7	-173.7	-68.6	-55.7	0	0	0	115.7	H49 V50 V55 L57	H49-N53 PolarHBondContact CE1-ND2 3.2Å; H49-N53 VanDerWaalsContact CE1-ND2 3.28Å; H49-N53 PolarHBondContact O-N 3.31Å; V50-N53 PolarHBondContact O-N 2.67Å; N53-V55 VanDerWaalsContact C-N 3.28Å; N53-V55 PolarHBondContact O-N 3.05Å; N53-L57 PolarHBondContact O-N 3.48Å
54	H	73	Confident	75.9	Confident	85 Å²	85	109.6 Å²	109.6	39%	0.394	56%	0.561	S	S	.	*	H	α-helix	trans	-57.8	-36.9	-176.1	66.6	-71.6	0	0	0	113.7	V50 A51 D56 L57 F58	V50-H54 VanDerWaalsContact O-CB 3.32Å; V50-H54 WeakPolarHBondContact O-CB 3.07Å; V50-H54 PolarHBondContact O-N 2.83Å; A51-H54 PolarHBondContact O-CE1 3.02Å; A51-H54 PolarHBondContact O-ND1 3.47Å; H54-D56 PolarHBondContact O-N 3.4Å; H54-L57 PolarHBondContact O-N 3.45Å; H54-F58 HydrophobicContact CB-CD2 4.19Å; H54-F58 HydrophobicContact CB-CE2 4.17Å; H54-F58 WeakPolarHBondContact O-CD2 3.32Å; H54-F58 PolarHBondContact O-N 3.48Å
55	V	76.3	Confident	76.1	Confident	89 Å²	89	111.1 Å²	111.1	54%	0.539	56%	0.564	S	S	.	*	H	α-helix	trans	-64.3	-44.1	-173.7	-177.8	0	0	0	0	112.3	N53 F58 K59	N53-V55 VanDerWaalsContact C-N 3.28Å; N53-V55 PolarHBondContact O-N 3.05Å; V55-F58 PolarHBondContact O-N 3.24Å; V55-K59 PolarHBondContact O-N 2.99Å
56	D	72.2	Confident	76.5	Confident	114 Å²	114	109.6 Å²	109.6	61%	0.61	56%	0.557	S	S	*	*	H	α-helix	trans	-73.7	-33.3	-179.6	-85	-12.9	0	0	0	112.5	H54 K59 R60	H54-D56 PolarHBondContact O-N 3.4Å; D56-K59 PolarHBondContact O-N 3.13Å; D56-R60 PolarHBondContact O-N 3.41Å; D56-R60 VanDerWaalsContact O-N 3.13Å
57	L	72.1	Confident	76.7	Confident	134 Å²	134	110.3 Å²	110.3	70%	0.702	56%	0.561	S	S	*	*	H	α-helix	trans	-64.4	-43.5	173.8	-158.2	91.3	0	0	0	110.9	N53 H54 A61	N53-L57 PolarHBondContact O-N 3.48Å; H54-L57 PolarHBondContact O-N 3.45Å; L57-A61 WeakPolarHBondContact O-CB 3.28Å; L57-A61 PolarHBondContact O-N 3.27Å
58	F	75.6	Confident	77	Confident	144 Å²	144	107.3 Å²	107.3	63%	0.632	55%	0.554	S	S	*	*	H	α-helix	trans	-66.1	-37.5	176.6	-82.3	-62.5	0	0	0	112.5	H54 V55 A61 S62	H54-F58 HydrophobicContact CB-CD2 4.19Å; H54-F58 HydrophobicContact CB-CE2 4.17Å; H54-F58 WeakPolarHBondContact O-CD2 3.32Å; H54-F58 PolarHBondContact O-N 3.48Å; V55-F58 PolarHBondContact O-N 3.24Å; F58-A61 PolarHBondContact O-N 2.89Å; F58-S62 VanDerWaalsContact O-CB 3.28Å; F58-S62 WeakPolarHBondContact O-CB 3.4Å; F58-S62 PolarHBondContact O-N 3.49Å
59	K	79.4	Confident	77.4	Confident	139 Å²	139	105.7 Å²	105.7	60%	0.604	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-46.8	179	-134.6	176.3	-173.7	177.2	0	112.1	V55 D56 S62 D63	V55-K59 PolarHBondContact O-N 2.99Å; D56-K59 PolarHBondContact O-N 3.13Å; K59-S62 PolarHBondContact O-N 3.04Å; K59-D63 PolarHBondContact O-N 3.27Å
60	R	73.6	Confident	77.9	Confident	201 Å²	201	104.1 Å²	104.1	76%	0.758	55%	0.548	S	S	*	.	H	α-helix	trans	-67.4	-36.3	176.9	-75.2	-162.4	177.8	-166.3	1.8	113.2	D56 I64	D56-R60 PolarHBondContact O-N 3.41Å; D56-R60 VanDerWaalsContact O-N 3.13Å; R60-I64 WeakPolarHBondContact O-CG1 3.33Å; R60-I64 PolarHBondContact O-N 2.99Å
61	A	76.8	Confident	78.4	Confident	59 Å²	59	105 Å²	105	49%	0.488	55%	0.549	S	S	.	.	H	α-helix	trans	-64.4	-41.7	173.1	0	0	0	0	0	111.3	L57 F58 D65	L57-A61 WeakPolarHBondContact O-CB 3.28Å; L57-A61 PolarHBondContact O-N 3.27Å; F58-A61 PolarHBondContact O-N 2.89Å; A61-D65 WeakPolarHBondContact O-CB 3.37Å; A61-D65 PolarHBondContact O-N 3.07Å
62	S	80.1	Confident	79	Confident	60 Å²	60	106.9 Å²	106.9	42%	0.42	55%	0.55	S	S	.	.	H	α-helix	trans	-67.5	-38.6	179.5	-172	0	0	0	0	113.2	F58 K59 D65 N66	F58-S62 VanDerWaalsContact O-CB 3.28Å; F58-S62 WeakPolarHBondContact O-CB 3.4Å; F58-S62 PolarHBondContact O-N 3.49Å; K59-S62 PolarHBondContact O-N 3.04Å; S62-D65 PolarHBondContact O-N 3.48Å; S62-N66 WeakPolarHBondContact O-CB 3.43Å; S62-N66 VanDerWaalsContact O-CG 3.26Å; S62-N66 PolarHBondContact O-N 3.19Å; S62-N66 PolarHBondContact O-ND2 2.96Å
63	D	79.9	Confident	79.6	Confident	103 Å²	103	103.3 Å²	103.3	55%	0.551	54%	0.537	S	S	*	.	H	α-helix	trans	-70.2	-36.9	179.6	-71.8	-22.5	0	0	0	112	K59 N66 L67	K59-D63 PolarHBondContact O-N 3.27Å; D63-N66 PolarHBondContact O-N 3.43Å; D63-L67 PolarHBondContact O-N 3.02Å
64	I	80.5	Confident	80.4	Confident	116 Å²	116	102.7 Å²	102.7	60%	0.595	54%	0.536	S	S	*	.	H	α-helix	trans	-66.7	-41.9	173.7	-69.6	172.6	0	0	0	110.5	R60 N66 L67 Q68	R60-I64 WeakPolarHBondContact O-CG1 3.33Å; R60-I64 PolarHBondContact O-N 2.99Å; I64-N66 VanDerWaalsContact C-N 3.35Å; I64-N66 PolarHBondContact O-N 3.1Å; I64-L67 PolarHBondContact O-N 2.93Å; I64-Q68 WeakPolarHBondContact O-CB 3.45Å; I64-Q68 PolarHBondContact O-N 3.33Å
65	D	81.7	Confident	81.1	Confident	93 Å²	93	104.3 Å²	104.3	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.9	-163	54.8	0	0	0	111.4	A61 S62 L67 Q68 N69	A61-D65 WeakPolarHBondContact O-CB 3.37Å; A61-D65 PolarHBondContact O-N 3.07Å; S62-D65 PolarHBondContact O-N 3.48Å; D65-L67 PolarHBondContact O-N 3.45Å; D65-Q68 PolarHBondContact O-N 3.24Å; D65-N69 WeakPolarHBondContact O-CB 3.44Å; D65-N69 PolarHBondContact O-N 3.38Å; D65-N69 PolarHBondContact O-ND2 3.45Å; D65-N69 PolarHBondContact OD2-ND2 2.93Å
66	N	83.9	Confident	81.6	Confident	85 Å²	85	102.8 Å²	102.8	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-62.4	-41.9	175.9	-75.4	-31.1	0	0	0	113	S62 D63 I64 N69 V70	S62-N66 WeakPolarHBondContact O-CB 3.43Å; S62-N66 VanDerWaalsContact O-CG 3.26Å; S62-N66 PolarHBondContact O-N 3.19Å; S62-N66 PolarHBondContact O-ND2 2.96Å; D63-N66 PolarHBondContact O-N 3.43Å; I64-N66 VanDerWaalsContact C-N 3.35Å; I64-N66 PolarHBondContact O-N 3.1Å; N66-N69 PolarHBondContact O-N 3.39Å; N66-V70 WeakPolarHBondContact O-CG2 3.39Å; N66-V70 PolarHBondContact O-N 2.97Å; N66-V70 VanDerWaalsContact O-N 3.1Å
67	L	81.3	Confident	82.4	Confident	116 Å²	116	104.7 Å²	104.7	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-67.6	-43	177.3	-167.3	104.2	0	0	0	111.6	D63 I64 D65 N69 V70 L71	D63-L67 PolarHBondContact O-N 3.02Å; I64-L67 PolarHBondContact O-N 2.93Å; D65-L67 PolarHBondContact O-N 3.45Å; L67-N69 VanDerWaalsContact C-N 3.26Å; L67-N69 PolarHBondContact O-N 3.48Å; L67-V70 PolarHBondContact O-N 3.36Å; L67-L71 HydrophobicContact CD2-CD1 3.9Å; L67-L71 HydrophobicContact CG-CD1 4.22Å; L67-L71 PolarHBondContact O-N 2.95Å
68	Q	84.3	Confident	83.2	Confident	123 Å²	123	103.6 Å²	103.6	58%	0.575	53%	0.529	S	S	*	.	H	α-helix	trans	-55.8	-44.5	174.4	-169.5	92.8	6.3	0	0	110.2	I64 D65 V70 L71 Q72	I64-Q68 WeakPolarHBondContact O-CB 3.45Å; I64-Q68 PolarHBondContact O-N 3.33Å; D65-Q68 PolarHBondContact O-N 3.24Å; Q68-V70 PolarHBondContact O-N 3.25Å; Q68-L71 PolarHBondContact O-N 2.98Å; Q68-Q72 WeakPolarHBondContact O-CB 3.37Å; Q68-Q72 PolarHBondContact O-N 3.47Å
69	N	86.3	Confident	83.8	Confident	85 Å²	85	103.6 Å²	103.6	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-39.8	179.1	-71.2	-33.8	0	0	0	113	D65 N66 L67 A73	D65-N69 WeakPolarHBondContact O-CB 3.44Å; D65-N69 PolarHBondContact O-N 3.38Å; D65-N69 PolarHBondContact O-ND2 3.45Å; D65-N69 PolarHBondContact OD2-ND2 2.93Å; N66-N69 PolarHBondContact O-N 3.39Å; L67-N69 VanDerWaalsContact C-N 3.26Å; L67-N69 PolarHBondContact O-N 3.48Å; N69-A73 WeakPolarHBondContact O-CB 3.38Å; N69-A73 PolarHBondContact O-N 2.93Å
70	V	87.3	Confident	84.3	Confident	96 Å²	96	101.1 Å²	101.1	58%	0.582	52%	0.519	S	S	*	.	H	α-helix	trans	-70.9	-43.6	177.5	174.7	0	0	0	0	111.6	N66 L67 Q68 Q72 A73 V74	N66-V70 WeakPolarHBondContact O-CG2 3.39Å; N66-V70 PolarHBondContact O-N 2.97Å; N66-V70 VanDerWaalsContact O-N 3.1Å; L67-V70 PolarHBondContact O-N 3.36Å; Q68-V70 PolarHBondContact O-N 3.25Å; V70-Q72 VanDerWaalsContact C-N 3.35Å; V70-A73 PolarHBondContact O-N 3.49Å; V70-V74 HydrophobicContact CG1-CG2 4.47Å; V70-V74 WeakPolarHBondContact O-CG2 3.22Å; V70-V74 PolarHBondContact O-N 3.43Å
71	L	82.2	Confident	85	Confident	109 Å²	109	97.6 Å²	97.6	57%	0.571	51%	0.514	S	S	*	.	H	α-helix	trans	-62.2	-44	176.3	-93.5	158	0	0	0	111.2	L67 Q68 A73 V74 E75	L67-L71 HydrophobicContact CD2-CD1 3.9Å; L67-L71 HydrophobicContact CG-CD1 4.22Å; L67-L71 PolarHBondContact O-N 2.95Å; Q68-L71 PolarHBondContact O-N 2.98Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 2.86Å; L71-V74 PolarHBondContact O-N 3.26Å; L71-E75 WeakPolarHBondContact O-CB 3.33Å; L71-E75 PolarHBondContact O-N 2.89Å
72	Q	87.2	Confident	85.7	Confident	87 Å²	87	98.5 Å²	98.5	41%	0.407	52%	0.517	S	S	.	.	H	α-helix	trans	-59	-44.9	174.2	-169.4	62.7	47	0	0	111.1	Q68 V70 V74 E75 D76	Q68-Q72 WeakPolarHBondContact O-CB 3.37Å; Q68-Q72 PolarHBondContact O-N 3.47Å; V70-Q72 VanDerWaalsContact C-N 3.35Å; Q72-V74 PolarHBondContact O-N 3.05Å; Q72-E75 PolarHBondContact O-N 2.83Å; Q72-D76 PolarHBondContact NE2-OD2 2.86Å; Q72-D76 VanDerWaalsContact O-CB 3.29Å; Q72-D76 WeakPolarHBondContact O-CB 3.3Å; Q72-D76 VanDerWaalsContact O-CG 3.3Å; Q72-D76 PolarHBondContact O-N 2.9Å
73	A	87	Confident	86.1	Confident	47 Å²	47	98.5 Å²	98.5	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-65.3	-36	178.5	0	0	0	0	0	113.5	N69 V70 L71 K77	N69-A73 WeakPolarHBondContact O-CB 3.38Å; N69-A73 PolarHBondContact O-N 2.93Å; V70-A73 PolarHBondContact O-N 3.49Å; L71-A73 VanDerWaalsContact C-N 3.33Å; L71-A73 PolarHBondContact O-N 2.86Å; A73-K77 WeakPolarHBondContact O-CB 3.41Å; A73-K77 VanDerWaalsContact O-CG 3.3Å; A73-K77 WeakPolarHBondContact O-CG 3.4Å; A73-K77 PolarHBondContact O-N 3.43Å
74	V	86.7	Confident	86.5	Confident	72 Å²	72	96.5 Å²	96.5	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-72.5	-44.1	176.5	171.7	0	0	0	0	110.7	V70 L71 Q72 D76 K77 I78	V70-V74 HydrophobicContact CG1-CG2 4.47Å; V70-V74 WeakPolarHBondContact O-CG2 3.22Å; V70-V74 PolarHBondContact O-N 3.43Å; L71-V74 PolarHBondContact O-N 3.26Å; Q72-V74 PolarHBondContact O-N 3.05Å; V74-D76 VanDerWaalsContact C-N 3.34Å; V74-D76 PolarHBondContact O-N 3.24Å; V74-K77 PolarHBondContact O-N 3.49Å; V74-I78 HydrophobicContact CG1-CD1 3.84Å; V74-I78 HydrophobicContact CG1-CG1 4.44Å; V74-I78 WeakPolarHBondContact O-CG1 3.18Å; V74-I78 PolarHBondContact O-N 2.85Å
75	E	88.2	Confident	86.9	Confident	119 Å²	119	96.9 Å²	96.9	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-59.5	-46.8	175.2	-171.7	-179.2	166.4	0	0	110.6	L71 Q72 K77 I78 R79	L71-E75 WeakPolarHBondContact O-CB 3.33Å; L71-E75 PolarHBondContact O-N 2.89Å; Q72-E75 PolarHBondContact O-N 2.83Å; E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 3.28Å; E75-I78 PolarHBondContact O-N 3.39Å; E75-R79 VanDerWaalsContact O-CB 3.24Å; E75-R79 WeakPolarHBondContact O-CB 3.24Å; E75-R79 PolarHBondContact O-N 3.41Å
76	D	87.6	Confident	87	Confident	56 Å²	56	95.2 Å²	95.2	30%	0.299	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-40.5	177	-77.8	-36.1	0	0	0	111.8	Q72 V74 N80	Q72-D76 PolarHBondContact NE2-OD2 2.86Å; Q72-D76 VanDerWaalsContact O-CB 3.29Å; Q72-D76 WeakPolarHBondContact O-CB 3.3Å; Q72-D76 VanDerWaalsContact O-CG 3.3Å; Q72-D76 PolarHBondContact O-N 2.9Å; V74-D76 VanDerWaalsContact C-N 3.34Å; V74-D76 PolarHBondContact O-N 3.24Å; D76-N80 WeakPolarHBondContact O-CB 3.44Å; D76-N80 PolarHBondContact O-N 3.01Å; D76-N80 PolarHBondContact O-ND2 3.33Å
77	K	88.7	Confident	87.1	Confident	155 Å²	155	97.2 Å²	97.2	67%	0.674	51%	0.508	S	S	*	.	H	α-helix	trans	-66.1	-44	175.8	-80.2	178.2	-179	-179.5	0	112.8	A73 V74 E75 N80 L81	A73-K77 WeakPolarHBondContact O-CB 3.41Å; A73-K77 VanDerWaalsContact O-CG 3.3Å; A73-K77 WeakPolarHBondContact O-CG 3.4Å; A73-K77 PolarHBondContact O-N 3.43Å; V74-K77 PolarHBondContact O-N 3.49Å; E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 3.28Å; K77-N80 PolarHBondContact O-N 2.89Å; K77-L81 WeakPolarHBondContact O-CB 3.29Å; K77-L81 PolarHBondContact O-N 3.25Å
78	I	88.2	Confident	87.3	Confident	110 Å²	110	95.4 Å²	95.4	56%	0.564	50%	0.502	S	S	*	.	H	α-helix	trans	-66.4	-42.5	178.4	-69.4	171.8	0	0	0	110.2	V74 E75 N80 L81 S82	V74-I78 HydrophobicContact CG1-CD1 3.84Å; V74-I78 HydrophobicContact CG1-CG1 4.44Å; V74-I78 WeakPolarHBondContact O-CG1 3.18Å; V74-I78 PolarHBondContact O-N 2.85Å; E75-I78 PolarHBondContact O-N 3.39Å; I78-N80 VanDerWaalsContact C-N 3.33Å; I78-N80 PolarHBondContact O-N 3.47Å; I78-L81 PolarHBondContact O-N 3.35Å; I78-S82 WeakPolarHBondContact O-CB 3.41Å; I78-S82 PolarHBondContact O-N 2.85Å
79	R	89.5	Confident	87.5	Confident	145 Å²	145	95.8 Å²	95.8	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-45	175	-163.6	174.1	79.6	119.8	-1.1	110.6	E75 L81 S82 I83	E75-R79 VanDerWaalsContact O-CB 3.24Å; E75-R79 WeakPolarHBondContact O-CB 3.24Å; E75-R79 PolarHBondContact O-N 3.41Å; R79-L81 PolarHBondContact O-N 3.39Å; R79-S82 PolarHBondContact O-N 2.73Å; R79-I83 HydrophobicContact CG-CD1 4Å; R79-I83 WeakPolarHBondContact O-CB 3.38Å; R79-I83 WeakPolarHBondContact O-CD1 3.38Å; R79-I83 WeakPolarHBondContact O-CG1 3.17Å; R79-I83 PolarHBondContact O-N 2.83Å
80	N	89.4	Confident	87.4	Confident	87 Å²	87	99 Å²	99	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-37.7	176.3	-73.1	-27	0	0	0	112.8	D76 K77 I78 S84	D76-N80 WeakPolarHBondContact O-CB 3.44Å; D76-N80 PolarHBondContact O-N 3.01Å; D76-N80 PolarHBondContact O-ND2 3.33Å; K77-N80 PolarHBondContact O-N 2.89Å; I78-N80 VanDerWaalsContact C-N 3.33Å; I78-N80 PolarHBondContact O-N 3.47Å; N80-S84 VanDerWaalsContact O-CB 3.27Å; N80-S84 WeakPolarHBondContact O-CB 3.4Å; N80-S84 PolarHBondContact O-N 3.48Å; N80-S84 PolarHBondContact O-OG 3.44Å
81	L	89	Confident	87.3	Confident	127 Å²	127	102.2 Å²	102.2	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-45.6	176	-169.4	79.9	0	0	0	111.1	K77 I78 R79 I83 S84 L85	K77-L81 WeakPolarHBondContact O-CB 3.29Å; K77-L81 PolarHBondContact O-N 3.25Å; I78-L81 PolarHBondContact O-N 3.35Å; R79-L81 PolarHBondContact O-N 3.39Å; L81-I83 PolarHBondContact O-N 2.78Å; L81-S84 CarbonylContact O-C 3.58Å; L81-S84 PolarHBondContact O-N 3.49Å; L81-S84 VanDerWaalsContact O-N 3.12Å; L81-L85 WeakPolarHBondContact O-CB 3.27Å; L81-L85 PolarHBondContact O-N 3.12Å
82	S	91.4	Very high	87.5	Confident	77 Å²	77	102 Å²	102	54%	0.538	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-42.7	176.3	-177.6	0	0	0	0	111.7	I78 R79 S84 L85 S86	I78-S82 WeakPolarHBondContact O-CB 3.41Å; I78-S82 PolarHBondContact O-N 2.85Å; R79-S82 PolarHBondContact O-N 2.73Å; S82-S84 VanDerWaalsContact C-N 3.32Å; S82-S84 PolarHBondContact O-N 2.93Å; S82-L85 PolarHBondContact O-N 3.26Å; S82-S86 WeakPolarHBondContact O-CB 3.38Å; S82-S86 PolarHBondContact O-N 2.84Å; S82-S86 PolarHBondContact O-OG 3.46Å
83	I	88.9	Confident	87.5	Confident	60 Å²	60	101.4 Å²	101.4	31%	0.308	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-40.1	172.9	-68.5	165.9	0	0	0	110.7	R79 L81 S86 K87	R79-I83 HydrophobicContact CG-CD1 4Å; R79-I83 WeakPolarHBondContact O-CB 3.38Å; R79-I83 WeakPolarHBondContact O-CD1 3.38Å; R79-I83 WeakPolarHBondContact O-CG1 3.17Å; R79-I83 PolarHBondContact O-N 2.83Å; L81-I83 PolarHBondContact O-N 2.78Å; I83-S86 WeakPolarHBondContact CA-OG 3.49Å; I83-S86 PolarHBondContact O-OG 3.44Å; I83-K87 HydrophobicContact CG2-CD 3.99Å; I83-K87 VanDerWaalsContact CG2-CE 3.48Å; I83-K87 WeakPolarHBondContact O-CB 3.15Å; I83-K87 WeakPolarHBondContact O-CD 3.41Å; I83-K87 WeakPolarHBondContact O-CG 3.32Å; I83-K87 PolarHBondContact O-N 2.98Å
84	S	88	Confident	87.4	Confident	62 Å²	62	103 Å²	103	43%	0.434	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-42.3	178.5	-61.6	0	0	0	0	112.2	N80 L81 S82 K87 V88	N80-S84 VanDerWaalsContact O-CB 3.27Å; N80-S84 WeakPolarHBondContact O-CB 3.4Å; N80-S84 PolarHBondContact O-N 3.48Å; N80-S84 PolarHBondContact O-OG 3.44Å; L81-S84 CarbonylContact O-C 3.58Å; L81-S84 PolarHBondContact O-N 3.49Å; L81-S84 VanDerWaalsContact O-N 3.12Å; S82-S84 VanDerWaalsContact C-N 3.32Å; S82-S84 PolarHBondContact O-N 2.93Å; S84-K87 WeakPolarHBondContact O-CB 3.38Å; S84-K87 PolarHBondContact O-N 2.82Å; S84-V88 WeakPolarHBondContact O-CG2 3.43Å; S84-V88 PolarHBondContact O-N 2.96Å
85	L	87.8	Confident	87.4	Confident	124 Å²	124	102.7 Å²	102.7	65%	0.649	52%	0.52	S	S	*	.	H	α-helix	trans	-66.6	-43.5	178.2	-176.1	63.9	0	0	0	111.4	L81 S82 K87 V88 K89	L81-L85 WeakPolarHBondContact O-CB 3.27Å; L81-L85 PolarHBondContact O-N 3.12Å; S82-L85 PolarHBondContact O-N 3.26Å; L85-K87 VanDerWaalsContact C-N 3.3Å; L85-K87 PolarHBondContact O-N 2.84Å; L85-V88 PolarHBondContact O-N 2.95Å; L85-K89 WeakPolarHBondContact O-CB 3.42Å; L85-K89 PolarHBondContact O-N 3.24Å
86	S	85.2	Confident	87.5	Confident	58 Å²	58	103.1 Å²	103.1	41%	0.406	52%	0.522	S	S	.	.	H	α-helix	trans	-64.1	-35	173.6	55.8	0	0	0	0	112.2	S82 I83 K90	S82-S86 WeakPolarHBondContact O-CB 3.38Å; S82-S86 PolarHBondContact O-N 2.84Å; S82-S86 PolarHBondContact O-OG 3.46Å; I83-S86 WeakPolarHBondContact CA-OG 3.49Å; I83-S86 PolarHBondContact O-OG 3.44Å; S86-K90 WeakPolarHBondContact O-CB 3.37Å; S86-K90 WeakPolarHBondContact O-CG 3.41Å; S86-K90 PolarHBondContact O-N 2.83Å
87	K	85.2	Confident	87.5	Confident	127 Å²	127	106.7 Å²	106.7	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-66.2	-42.4	171.2	-77.2	171.3	-179.2	176.6	0	112.5	I83 S84 L85 K91	I83-K87 HydrophobicContact CG2-CD 3.99Å; I83-K87 VanDerWaalsContact CG2-CE 3.48Å; I83-K87 WeakPolarHBondContact O-CB 3.15Å; I83-K87 WeakPolarHBondContact O-CD 3.41Å; I83-K87 WeakPolarHBondContact O-CG 3.32Å; I83-K87 PolarHBondContact O-N 2.98Å; S84-K87 WeakPolarHBondContact O-CB 3.38Å; S84-K87 PolarHBondContact O-N 2.82Å; L85-K87 VanDerWaalsContact C-N 3.3Å; L85-K87 PolarHBondContact O-N 2.84Å; K87-K91 VanDerWaalsContact O-CB 3.31Å; K87-K91 WeakPolarHBondContact O-CB 3.31Å; K87-K91 WeakPolarHBondContact O-CG 3.31Å; K87-K91 PolarHBondContact O-N 2.99Å
88	V	85.1	Confident	87.6	Confident	77 Å²	77	102.9 Å²	102.9	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-66	-45.3	176.8	171.1	0	0	0	0	110.6	S84 L85 K90 K91 I92	S84-V88 WeakPolarHBondContact O-CG2 3.43Å; S84-V88 PolarHBondContact O-N 2.96Å; L85-V88 PolarHBondContact O-N 2.95Å; V88-K90 PolarHBondContact O-N 3.02Å; V88-K91 CarbonylContact O-C 3.52Å; V88-K91 WeakPolarHBondContact O-CA 3.41Å; V88-K91 WeakPolarHBondContact O-CB 3.2Å; V88-K91 PolarHBondContact O-N 3.47Å; V88-K91 VanDerWaalsContact O-N 3.07Å; V88-I92 HydrophobicContact CG1-CD1 3.87Å; V88-I92 WeakPolarHBondContact O-CG1 3.43Å; V88-I92 PolarHBondContact O-N 3.07Å
89	K	88.1	Confident	87.7	Confident	131 Å²	131	102.8 Å²	102.8	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-56.3	-51.6	174.4	-177.4	177.5	178.9	-177.4	0	111	L85 K91 I92 D93	L85-K89 WeakPolarHBondContact O-CB 3.42Å; L85-K89 PolarHBondContact O-N 3.24Å; K89-K91 VanDerWaalsContact C-N 3.28Å; K89-K91 PolarHBondContact O-N 3.22Å; K89-I92 PolarHBondContact O-N 3.01Å; K89-D93 WeakPolarHBondContact CE-OD2 3.45Å; K89-D93 VanDerWaalsContact CG-OD2 3.31Å; K89-D93 WeakPolarHBondContact CG-OD2 3.34Å; K89-D93 PolarHBondContact O-N 2.85Å
90	K	84.7	Confident	87.8	Confident	153 Å²	153	98.8 Å²	98.8	67%	0.665	52%	0.521	S	S	*	.	H	α-helix	trans	-58.4	-39.3	174.3	-77.6	-174	176.6	-174	0	112.4	S86 V88 I92 T94	S86-K90 WeakPolarHBondContact O-CB 3.37Å; S86-K90 WeakPolarHBondContact O-CG 3.41Å; S86-K90 PolarHBondContact O-N 2.83Å; V88-K90 PolarHBondContact O-N 3.02Å; K90-I92 PolarHBondContact O-N 3.29Å; K90-T94 WeakPolarHBondContact O-CG2 3.35Å; K90-T94 PolarHBondContact O-N 3.32Å; K90-T94 PolarHBondContact O-OG1 2.85Å
91	K	84.5	Confident	87.9	Confident	163 Å²	163	97.7 Å²	97.7	71%	0.709	52%	0.518	S	S	*	.	H	α-helix	trans	-66.6	-16.6	176.2	-85.1	-177.2	173.4	-171.4	0	114.2	K87 V88 K89 P95	K87-K91 VanDerWaalsContact O-CB 3.31Å; K87-K91 WeakPolarHBondContact O-CB 3.31Å; K87-K91 WeakPolarHBondContact O-CG 3.31Å; K87-K91 PolarHBondContact O-N 2.99Å; V88-K91 CarbonylContact O-C 3.52Å; V88-K91 WeakPolarHBondContact O-CA 3.41Å; V88-K91 WeakPolarHBondContact O-CB 3.2Å; V88-K91 PolarHBondContact O-N 3.47Å; V88-K91 VanDerWaalsContact O-N 3.07Å; K89-K91 VanDerWaalsContact C-N 3.28Å; K89-K91 PolarHBondContact O-N 3.22Å; K91-P95 WeakPolarHBondContact O-CD 3.44Å; K91-P95 WeakPolarHBondContact O-CG 3.05Å
92	I	86.9	Confident	88	Confident	105 Å²	105	96 Å²	96	54%	0.538	51%	0.509	S	S	.	.	H	α-helix	trans	-102.5	-42.3	177.7	-65	169.5	0	0	0	111.1	V88 K89 K90 T94 P95 H96	V88-I92 HydrophobicContact CG1-CD1 3.87Å; V88-I92 WeakPolarHBondContact O-CG1 3.43Å; V88-I92 PolarHBondContact O-N 3.07Å; K89-I92 PolarHBondContact O-N 3.01Å; K90-I92 PolarHBondContact O-N 3.29Å; I92-T94 VanDerWaalsContact C-N 3.33Å; I92-T94 PolarHBondContact O-N 3.05Å; I92-P95 VanDerWaalsContact C-CD 3.48Å; I92-P95 WeakPolarHBondContact O-CD 3.42Å; I92-P95 VanDerWaalsContact O-CG 3.22Å; I92-P95 WeakPolarHBondContact O-CG 3.22Å; I92-H96 WeakPolarHBondContact O-CB 3.43Å; I92-H96 PolarHBondContact O-N 3.42Å
93	D	87.6	Confident	88	Confident	74 Å²	74	96.6 Å²	96.6	40%	0.396	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-44	179.4	-71.6	-15.9	0	0	0	110.7	K89 H96 E97	K89-D93 WeakPolarHBondContact CE-OD2 3.45Å; K89-D93 VanDerWaalsContact CG-OD2 3.31Å; K89-D93 WeakPolarHBondContact CG-OD2 3.34Å; K89-D93 PolarHBondContact O-N 2.85Å; D93-H96 PolarHBondContact O-N 2.91Å; D93-E97 PolarHBondContact O-N 3.27Å
94	T	85.5	Confident	88.2	Confident	81 Å²	81	97 Å²	97	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-49.8	-179.6	59	0	0	0	0	113.4	K90 I92 H96 E97 T98	K90-T94 WeakPolarHBondContact O-CG2 3.35Å; K90-T94 PolarHBondContact O-N 3.32Å; K90-T94 PolarHBondContact O-OG1 2.85Å; I92-T94 VanDerWaalsContact C-N 3.33Å; I92-T94 PolarHBondContact O-N 3.05Å; T94-H96 VanDerWaalsContact C-N 3.32Å; T94-H96 PolarHBondContact O-N 3.32Å; T94-E97 PolarHBondContact O-N 2.79Å; T94-T98 WeakPolarHBondContact O-CB 3.02Å; T94-T98 PolarHBondContact O-N 3.48Å; T94-T98 PolarHBondContact O-OG1 2.85Å
95	P	86	Confident	88.3	Confident	66 Å²	66	99.6 Å²	99.6	43%	0.429	52%	0.52	S	S	.	.	H	α-helix	trans	-67.2	-29.3	175.3	25.8	-34.1	0	0	0	113.1	K91 I92 L99	K91-P95 WeakPolarHBondContact O-CD 3.44Å; K91-P95 WeakPolarHBondContact O-CG 3.05Å; I92-P95 VanDerWaalsContact C-CD 3.48Å; I92-P95 WeakPolarHBondContact O-CD 3.42Å; I92-P95 VanDerWaalsContact O-CG 3.22Å; I92-P95 WeakPolarHBondContact O-CG 3.22Å; P95-L99 WeakPolarHBondContact O-CB 3.16Å; P95-L99 PolarHBondContact O-N 3.13Å
96	H	90.2	Very high	88.5	Confident	127 Å²	127	100.7 Å²	100.7	59%	0.588	52%	0.519	S	S	*	.	H	α-helix	trans	-66	-48.9	174.2	175.9	-87.9	0	0	0	111.7	I92 D93 T94 T98 L99 S100	I92-H96 WeakPolarHBondContact O-CB 3.43Å; I92-H96 PolarHBondContact O-N 3.42Å; D93-H96 PolarHBondContact O-N 2.91Å; T94-H96 VanDerWaalsContact C-N 3.32Å; T94-H96 PolarHBondContact O-N 3.32Å; H96-T98 VanDerWaalsContact C-N 3.31Å; H96-T98 PolarHBondContact O-N 3.25Å; H96-L99 PolarHBondContact O-N 3.45Å; H96-S100 WeakPolarHBondContact O-CB 3.14Å; H96-S100 PolarHBondContact O-N 3.28Å
97	E	88.6	Confident	88.8	Confident	132 Å²	132	104.9 Å²	104.9	62%	0.617	53%	0.53	S	S	*	.	H	α-helix	trans	-59.5	-44.8	174.9	-75.5	-176.4	167.5	0	0	111	D93 T94 L99 S100 T101	D93-E97 PolarHBondContact O-N 3.27Å; T94-E97 PolarHBondContact O-N 2.79Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 2.92Å; E97-S100 PolarHBondContact O-N 2.97Å; E97-T101 WeakPolarHBondContact O-CG2 3.48Å; E97-T101 PolarHBondContact O-N 3.44Å; E97-T101 PolarHBondContact O-OG1 2.95Å; E97-T101 VanDerWaalsContact O-OG1 3.13Å
98	T	89.9	Confident	89	Confident	74 Å²	74	103.5 Å²	103.5	45%	0.454	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-37.4	178.1	-47.3	0	0	0	0	111.9	T94 H96 T101 N102	T94-T98 WeakPolarHBondContact O-CB 3.02Å; T94-T98 PolarHBondContact O-N 3.48Å; T94-T98 PolarHBondContact O-OG1 2.85Å; H96-T98 VanDerWaalsContact C-N 3.31Å; H96-T98 PolarHBondContact O-N 3.25Å; T98-T101 WeakPolarHBondContact CA-OG1 3.36Å; T98-T101 PolarHBondContact O-OG1 3.45Å; T98-N102 VanDerWaalsContact O-CB 3.25Å; T98-N102 WeakPolarHBondContact O-CB 3.49Å; T98-N102 PolarHBondContact O-N 2.65Å; T98-N102 PolarHBondContact O-ND2 3.32Å
99	L	90.5	Very high	89.3	Confident	109 Å²	109	104.9 Å²	104.9	57%	0.571	53%	0.533	S	S	*	.	H	α-helix	trans	-69.6	-43.6	176.4	-178.6	63.3	0	0	0	110.9	P95 H96 E97 N102 V103	P95-L99 WeakPolarHBondContact O-CB 3.16Å; P95-L99 PolarHBondContact O-N 3.13Å; H96-L99 PolarHBondContact O-N 3.45Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 2.92Å; L99-N102 PolarHBondContact O-N 3.17Å; L99-V103 HydrophobicContact CD1-CG2 4.31Å; L99-V103 HydrophobicContact CG-CG2 4.44Å; L99-V103 WeakPolarHBondContact O-CB 3.37Å; L99-V103 VanDerWaalsContact O-CG2 3.28Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 2.82Å
100	S	91.7	Very high	89.4	Confident	61 Å²	61	104.1 Å²	104.1	43%	0.427	53%	0.531	S	S	.	.	H	α-helix	trans	-61.2	-46.4	177.4	-175.9	0	0	0	0	111.2	H96 E97 V103 T104	H96-S100 WeakPolarHBondContact O-CB 3.14Å; H96-S100 PolarHBondContact O-N 3.28Å; E97-S100 PolarHBondContact O-N 2.97Å; S100-V103 PolarHBondContact O-N 2.94Å; S100-T104 WeakPolarHBondContact O-CG2 3.28Å; S100-T104 PolarHBondContact O-N 2.82Å; S100-T104 PolarHBondContact O-OG1 2.97Å
101	T	91.9	Very high	89.5	Confident	64 Å²	64	100.5 Å²	100.5	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-45.6	175.3	55.3	0	0	0	0	110.7	E97 T98 V103 T104 H105	E97-T101 WeakPolarHBondContact O-CG2 3.48Å; E97-T101 PolarHBondContact O-N 3.44Å; E97-T101 PolarHBondContact O-OG1 2.95Å; E97-T101 VanDerWaalsContact O-OG1 3.13Å; T98-T101 WeakPolarHBondContact CA-OG1 3.36Å; T98-T101 PolarHBondContact O-OG1 3.45Å; T101-V103 PolarHBondContact O-N 3.05Å; T101-T104 WeakPolarHBondContact CA-OG1 3.25Å; T101-T104 PolarHBondContact O-N 2.71Å; T101-T104 PolarHBondContact O-OG1 3.18Å; T101-H105 WeakPolarHBondContact O-CB 3.5Å; T101-H105 PolarHBondContact O-CD2 3.46Å; T101-H105 PolarHBondContact O-N 3.26Å
102	N	91	Very high	89.6	Confident	92 Å²	92	96.4 Å²	96.4	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-40	176.5	-75	-20	0	0	0	113.2	T98 L99 H105 F106	T98-N102 VanDerWaalsContact O-CB 3.25Å; T98-N102 WeakPolarHBondContact O-CB 3.49Å; T98-N102 PolarHBondContact O-N 2.65Å; T98-N102 PolarHBondContact O-ND2 3.32Å; L99-N102 PolarHBondContact O-N 3.17Å; N102-H105 PolarHBondContact O-N 3.35Å; N102-F106 WeakPolarHBondContact O-CB 3.21Å; N102-F106 PolarHBondContact O-N 2.83Å
103	V	91.5	Very high	89.7	Confident	89 Å²	89	93.7 Å²	93.7	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-65.4	-42.4	175.6	170	0	0	0	0	110.8	L99 S100 T101 F106 K107	L99-V103 HydrophobicContact CD1-CG2 4.31Å; L99-V103 HydrophobicContact CG-CG2 4.44Å; L99-V103 WeakPolarHBondContact O-CB 3.37Å; L99-V103 VanDerWaalsContact O-CG2 3.28Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 2.82Å; S100-V103 PolarHBondContact O-N 2.94Å; T101-V103 PolarHBondContact O-N 3.05Å; V103-F106 PolarHBondContact O-N 3.38Å; V103-K107 PolarHBondContact O-N 2.94Å
104	T	92.1	Very high	89.6	Confident	68 Å²	68	92 Å²	92	42%	0.417	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-41.3	174.8	55.5	0	0	0	0	112.2	S100 T101 F106 K107 N108	S100-T104 WeakPolarHBondContact O-CG2 3.28Å; S100-T104 PolarHBondContact O-N 2.82Å; S100-T104 PolarHBondContact O-OG1 2.97Å; T101-T104 WeakPolarHBondContact CA-OG1 3.25Å; T101-T104 PolarHBondContact O-N 2.71Å; T101-T104 PolarHBondContact O-OG1 3.18Å; T104-F106 VanDerWaalsContact C-N 3.32Å; T104-F106 PolarHBondContact O-N 3.44Å; T104-K107 PolarHBondContact O-N 2.86Å; T104-N108 WeakPolarHBondContact O-CB 3.42Å; T104-N108 VanDerWaalsContact O-CG 3.22Å; T104-N108 PolarHBondContact O-N 2.89Å
105	H	91.4	Very high	89.5	Confident	117 Å²	117	90.1 Å²	90.1	54%	0.542	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-42.2	172.7	-73.7	-55.2	0	0	0	111.4	T101 N102 N108 L109	T101-H105 WeakPolarHBondContact O-CB 3.5Å; T101-H105 PolarHBondContact O-CD2 3.46Å; T101-H105 PolarHBondContact O-N 3.26Å; N102-H105 PolarHBondContact O-N 3.35Å; H105-N108 PolarHBondContact O-N 3.27Å; H105-L109 WeakPolarHBondContact O-CB 3.34Å; H105-L109 PolarHBondContact O-N 2.82Å
106	F	91.8	Very high	89.6	Confident	146 Å²	146	92 Å²	92	64%	0.64	49%	0.491	S	S	*	.	H	α-helix	trans	-65.3	-42.3	177.9	-166.7	-92.5	0	0	0	112.2	N102 V103 T104 L109 H110	N102-F106 WeakPolarHBondContact O-CB 3.21Å; N102-F106 PolarHBondContact O-N 2.83Å; V103-F106 PolarHBondContact O-N 3.38Å; T104-F106 VanDerWaalsContact C-N 3.32Å; T104-F106 PolarHBondContact O-N 3.44Å; F106-L109 PolarHBondContact O-N 3.39Å; F106-H110 WeakPolarHBondContact O-CB 3.28Å; F106-H110 PolarHBondContact O-N 2.99Å
107	K	90.8	Very high	89.4	Confident	147 Å²	147	94.4 Å²	94.4	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-61.8	-48.5	174.9	-174.6	178.2	179.3	179.8	0	111.3	V103 T104 L109 H110 T111	V103-K107 PolarHBondContact O-N 2.94Å; T104-K107 PolarHBondContact O-N 2.86Å; K107-L109 VanDerWaalsContact C-N 3.32Å; K107-L109 PolarHBondContact O-N 3.2Å; K107-H110 PolarHBondContact O-N 2.89Å; K107-T111 PolarHBondContact O-N 3.44Å; K107-T111 PolarHBondContact O-OG1 2.93Å
108	N	89.6	Confident	89.3	Confident	98 Å²	98	90.5 Å²	90.5	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-40.6	178.3	-68.9	-7.2	0	0	0	111.4	T104 H105 T112	T104-N108 WeakPolarHBondContact O-CB 3.42Å; T104-N108 VanDerWaalsContact O-CG 3.22Å; T104-N108 PolarHBondContact O-N 2.89Å; H105-N108 PolarHBondContact O-N 3.27Å; N108-T112 VanDerWaalsContact O-CB 3.28Å; N108-T112 WeakPolarHBondContact O-CB 3.41Å; N108-T112 PolarHBondContact O-N 3.39Å; N108-T112 PolarHBondContact O-OG1 3.21Å
109	L	91.8	Very high	89.1	Confident	105 Å²	105	89 Å²	89	55%	0.55	47%	0.468	S	S	.	.	H	α-helix	trans	-63.7	-42	175.2	-169.3	115.5	0	0	0	111.1	H105 F106 K107 T112 C113	H105-L109 WeakPolarHBondContact O-CB 3.34Å; H105-L109 PolarHBondContact O-N 2.82Å; F106-L109 PolarHBondContact O-N 3.39Å; K107-L109 VanDerWaalsContact C-N 3.32Å; K107-L109 PolarHBondContact O-N 3.2Å; L109-T112 PolarHBondContact O-N 3.44Å; L109-C113 WeakPolarHBondContact O-CB 3.36Å; L109-C113 PolarHBondContact O-N 3.48Å; L109-C113 PolarHBondContact O-SG 3.45Å; L109-C113 VanDerWaalsContact O-SG 3.34Å
110	H	89.7	Confident	88.9	Confident	115 Å²	115	87.3 Å²	87.3	53%	0.532	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-47.5	177.4	-170.2	78.4	0	0	0	112.1	F106 K107 T112 C113 A114	F106-H110 WeakPolarHBondContact O-CB 3.28Å; F106-H110 PolarHBondContact O-N 2.99Å; K107-H110 PolarHBondContact O-N 2.89Å; H110-T112 VanDerWaalsContact C-N 3.34Å; H110-T112 PolarHBondContact O-N 3.2Å; H110-C113 PolarHBondContact O-N 2.67Å; H110-A114 PolarHBondContact O-N 3.29Å
111	T	87	Confident	88.7	Confident	77 Å²	77	91 Å²	91	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-43.8	174.9	-55.4	0	0	0	0	111.2	K107 C113 A114 V115	K107-T111 PolarHBondContact O-N 3.44Å; K107-T111 PolarHBondContact O-OG1 2.93Å; T111-C113 PolarHBondContact O-N 3.34Å; T111-A114 PolarHBondContact O-N 2.8Å; T111-V115 WeakPolarHBondContact O-CG2 3.43Å; T111-V115 PolarHBondContact O-N 3.19Å
112	T	86.7	Confident	88.5	Confident	77 Å²	77	88 Å²	88	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-43.6	176.9	-56.4	0	0	0	0	111.1	N108 L109 H110 V115 L116	N108-T112 VanDerWaalsContact O-CB 3.28Å; N108-T112 WeakPolarHBondContact O-CB 3.41Å; N108-T112 PolarHBondContact O-N 3.39Å; N108-T112 PolarHBondContact O-OG1 3.21Å; L109-T112 PolarHBondContact O-N 3.44Å; H110-T112 VanDerWaalsContact C-N 3.34Å; H110-T112 PolarHBondContact O-N 3.2Å; T112-V115 PolarHBondContact O-N 3.18Å; T112-L116 HydrophobicContact CG2-CD1 3.94Å; T112-L116 WeakPolarHBondContact O-CB 3.37Å; T112-L116 PolarHBondContact O-N 2.91Å
113	C	87.9	Confident	88.3	Confident	49 Å²	49	85.1 Å²	85.1	33%	0.331	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-39.2	175.1	-76.3	0	0	0	0	112.5	L109 H110 T111 L116 R117	L109-C113 WeakPolarHBondContact O-CB 3.36Å; L109-C113 PolarHBondContact O-N 3.48Å; L109-C113 PolarHBondContact O-SG 3.45Å; L109-C113 VanDerWaalsContact O-SG 3.34Å; H110-C113 PolarHBondContact O-N 2.67Å; T111-C113 PolarHBondContact O-N 3.34Å; C113-L116 PolarHBondContact O-N 3.32Å; C113-R117 WeakPolarHBondContact O-CB 3.27Å; C113-R117 VanDerWaalsContact O-CG 3.27Å; C113-R117 WeakPolarHBondContact O-CG 3.47Å; C113-R117 PolarHBondContact O-N 2.95Å
114	A	86.1	Confident	88.1	Confident	39 Å²	39	84.3 Å²	84.3	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-63.9	-47	176.3	0	0	0	0	0	111.3	H110 T111 L116 R117 N118	H110-A114 PolarHBondContact O-N 3.29Å; T111-A114 PolarHBondContact O-N 2.8Å; A114-L116 PolarHBondContact O-N 2.87Å; A114-R117 PolarHBondContact O-N 3.22Å; A114-N118 PolarHBondContact O-N 3.48Å
115	V	84.2	Confident	87.8	Confident	40 Å²	40	81.4 Å²	81.4	24%	0.242	42%	0.417	C	S	.	.	H	α-helix	trans	-59.4	-45.8	174.1	166.2	0	0	0	0	111.3	T111 T112 R117 N118 I119 M153 I158	T111-V115 WeakPolarHBondContact O-CG2 3.43Å; T111-V115 PolarHBondContact O-N 3.19Å; T112-V115 PolarHBondContact O-N 3.18Å; V115-R117 PolarHBondContact O-N 3.23Å; V115-N118 PolarHBondContact O-N 3.45Å; V115-I119 HydrophobicContact CG1-CD1 3.67Å; V115-I119 HydrophobicContact CG1-CG1 4.36Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.44Å; V115-I119 PolarHBondContact O-N 3.5Å; V115-M153 HydrophobicContact CB-CE 4.24Å; V115-M153 HydrophobicContact CG1-CE 3.53Å; V115-M153 HydrophobicContact CG2-CE 4.1Å; V115-I158 HydrophobicContact CG1-CD1 4.3Å
116	L	86.4	Confident	87.5	Confident	106 Å²	106	76 Å²	76	56%	0.555	39%	0.393	S	S	*	.	H	α-helix	trans	-61.7	-39.5	175.8	-93.3	152.3	0	0	0	112.9	T112 C113 A114 I119 S120	T112-L116 HydrophobicContact CG2-CD1 3.94Å; T112-L116 WeakPolarHBondContact O-CB 3.37Å; T112-L116 PolarHBondContact O-N 2.91Å; C113-L116 PolarHBondContact O-N 3.32Å; A114-L116 PolarHBondContact O-N 2.87Å; L116-I119 PolarHBondContact O-N 3.34Å; L116-S120 WeakPolarHBondContact O-CB 3.01Å; L116-S120 PolarHBondContact O-N 3.19Å
117	R	87.6	Confident	87.2	Confident	177 Å²	177	76.7 Å²	76.7	67%	0.668	40%	0.395	S	S	*	.	H	α-helix	trans	-64	-42.8	174.7	-75.4	173.8	-169.2	172.3	3.3	111.1	C113 A114 V115 S120 R121	C113-R117 WeakPolarHBondContact O-CB 3.27Å; C113-R117 VanDerWaalsContact O-CG 3.27Å; C113-R117 WeakPolarHBondContact O-CG 3.47Å; C113-R117 PolarHBondContact O-N 2.95Å; A114-R117 PolarHBondContact O-N 3.22Å; V115-R117 PolarHBondContact O-N 3.23Å; R117-S120 PolarHBondContact O-N 2.9Å; R117-R121 WeakPolarHBondContact O-CB 3.49Å; R117-R121 PolarHBondContact O-N 3.44Å
118	N	85.4	Confident	86.8	Confident	51 Å²	51	76 Å²	76	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-46.2	175.8	-70.6	-7.6	0	0	0	111.1	A114 V115 S120 R121 I122 I149 M153	A114-N118 PolarHBondContact O-N 3.48Å; V115-N118 PolarHBondContact O-N 3.45Å; N118-S120 VanDerWaalsContact C-N 3.32Å; N118-S120 PolarHBondContact O-N 3.41Å; N118-R121 PolarHBondContact O-N 3.07Å; N118-R121 VanDerWaalsContact O-N 3.16Å; N118-I122 WeakPolarHBondContact O-CB 3.27Å; N118-I122 VanDerWaalsContact O-CG1 3.25Å; N118-I122 WeakPolarHBondContact O-CG1 3.49Å; N118-I122 PolarHBondContact O-N 2.85Å; N118-I149 HydrophobicContact CB-CG2 4.39Å; N118-M153 HydrophobicContact CB-SD 3.81Å
119	I	86.1	Confident	86.4	Confident	43 Å²	43	71.8 Å²	71.8	22%	0.221	37%	0.366	C	S	.	.	H	α-helix	trans	-58.2	-44.5	174.7	-68.3	165.1	0	0	0	110.9	V115 L116 R121 I122 A123 I158 L161	V115-I119 HydrophobicContact CG1-CD1 3.67Å; V115-I119 HydrophobicContact CG1-CG1 4.36Å; V115-I119 VanDerWaalsContact O-CG1 3.27Å; V115-I119 WeakPolarHBondContact O-CG1 3.44Å; V115-I119 PolarHBondContact O-N 3.5Å; L116-I119 PolarHBondContact O-N 3.34Å; I119-R121 PolarHBondContact O-N 3.49Å; I119-I122 PolarHBondContact O-N 3.45Å; I119-A123 WeakPolarHBondContact O-CB 3.49Å; I119-A123 PolarHBondContact O-N 2.79Å; I119-I158 HydrophobicContact CD1-CD1 4.39Å; I119-L161 HydrophobicContact CD1-CD1 4.46Å; I119-L161 HydrophobicContact CG1-CD1 3.93Å; I119-L161 HydrophobicContact CG1-CD2 4.12Å; I119-L161 HydrophobicContact CG1-CG 4.23Å
120	S	86.9	Confident	85.9	Confident	73 Å²	73	72.4 Å²	72.4	51%	0.51	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-44.3	176.7	-175.2	0	0	0	0	111.5	L116 R117 N118 A123 T124	L116-S120 WeakPolarHBondContact O-CB 3.01Å; L116-S120 PolarHBondContact O-N 3.19Å; R117-S120 PolarHBondContact O-N 2.9Å; N118-S120 VanDerWaalsContact C-N 3.32Å; N118-S120 PolarHBondContact O-N 3.41Å; S120-A123 PolarHBondContact O-N 2.95Å; S120-T124 WeakPolarHBondContact O-CG2 3.24Å; S120-T124 PolarHBondContact O-N 2.89Å; S120-T124 PolarHBondContact O-OG1 3.09Å
121	R	87.4	Confident	85	Confident	137 Å²	137	71 Å²	71	52%	0.517	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-47.8	177.5	-170.4	169.6	-177.3	147.8	-1.7	110.8	R117 N118 I119 A123 T124 L125 E145 I149	R117-R121 WeakPolarHBondContact O-CB 3.49Å; R117-R121 PolarHBondContact O-N 3.44Å; N118-R121 PolarHBondContact O-N 3.07Å; N118-R121 VanDerWaalsContact O-N 3.16Å; I119-R121 PolarHBondContact O-N 3.49Å; R121-A123 VanDerWaalsContact C-N 3.33Å; R121-A123 PolarHBondContact O-N 3.19Å; R121-T124 WeakPolarHBondContact CA-OG1 3.25Å; R121-T124 PolarHBondContact O-N 2.84Å; R121-T124 VanDerWaalsContact O-N 3.15Å; R121-T124 PolarHBondContact O-OG1 3.48Å; R121-L125 HydrophobicContact CG-CD1 4.06Å; R121-L125 WeakPolarHBondContact O-CG 3.46Å; R121-L125 PolarHBondContact O-N 3.32Å; R121-E145 IonicContact CZ-OE1 3.46Å; R121-E145 IonicContact NE-OE1 2.81Å; R121-E145 PolarHBondContact NE-OE1 3.33Å; R121-E145 IonicContact NH2-OE1 3.16Å; R121-E145 PolarHBondContact NH2-OE1 3.47Å; R121-I149 HydrophobicContact CG-CD1 4.02Å
122	I	87.4	Confident	83.7	Confident	2 Å²	2	78.1 Å²	78.1	1%	0.01	39%	0.387	C	S	.	.	H	α-helix	trans	-55.7	-48.1	175.6	-68.7	166.3	0	0	0	110.7	N118 I119 T124 L125 M126 L146 I149 F150 L161 Y164	N118-I122 WeakPolarHBondContact O-CB 3.27Å; N118-I122 VanDerWaalsContact O-CG1 3.25Å; N118-I122 WeakPolarHBondContact O-CG1 3.49Å; N118-I122 PolarHBondContact O-N 2.85Å; I119-I122 PolarHBondContact O-N 3.45Å; I122-T124 VanDerWaalsContact C-N 3.34Å; I122-T124 PolarHBondContact O-N 3.05Å; I122-L125 PolarHBondContact O-N 3.47Å; I122-M126 VanDerWaalsContact O-CB 3.29Å; I122-M126 WeakPolarHBondContact O-CB 3.34Å; I122-M126 PolarHBondContact O-N 2.97Å; I122-L146 HydrophobicContact CB-CD2 4.04Å; I122-L146 HydrophobicContact CG1-CD2 3.93Å; I122-L146 HydrophobicContact CG2-CD2 3.91Å; I122-I149 HydrophobicContact CD1-CG2 3.84Å; I122-I149 HydrophobicContact CG1-CG2 3.83Å; I122-F150 HydrophobicContact CD1-CE1 4.23Å; I122-F150 HydrophobicContact CD1-CZ 4.24Å; I122-F150 HydrophobicContact CG2-CE2 4.24Å; I122-F150 HydrophobicContact CG2-CZ 3.92Å; I122-L161 HydrophobicContact CB-CD2 4.43Å; I122-L161 HydrophobicContact CD1-CD2 3.66Å; I122-L161 HydrophobicContact CG2-CD2 4.05Å; I122-Y164 HydrophobicContact CG2-CD2 4.07Å
123	A	86.2	Confident	82.4	Confident	32 Å²	32	76.4 Å²	76.4	26%	0.264	38%	0.378	S	S	.	.	H	α-helix	trans	-62.1	-40.6	179.3	0	0	0	0	0	112.2	I119 S120 R121 K127 Y164	I119-A123 WeakPolarHBondContact O-CB 3.49Å; I119-A123 PolarHBondContact O-N 2.79Å; S120-A123 PolarHBondContact O-N 2.95Å; R121-A123 VanDerWaalsContact C-N 3.33Å; R121-A123 PolarHBondContact O-N 3.19Å; A123-K127 VanDerWaalsContact O-CB 3.28Å; A123-K127 WeakPolarHBondContact O-CB 3.35Å; A123-K127 PolarHBondContact O-N 3.01Å; A123-Y164 HydrophobicContact CB-CE2 4.48Å
124	T	87.6	Confident	81.2	Confident	72 Å²	72	84 Å²	84	44%	0.442	41%	0.406	S	S	.	.	H	α-helix	trans	-66.6	-42	176.9	56.6	0	0	0	0	112.8	S120 R121 I122 R128	S120-T124 WeakPolarHBondContact O-CG2 3.24Å; S120-T124 PolarHBondContact O-N 2.89Å; S120-T124 PolarHBondContact O-OG1 3.09Å; R121-T124 WeakPolarHBondContact CA-OG1 3.25Å; R121-T124 PolarHBondContact O-N 2.84Å; R121-T124 VanDerWaalsContact O-N 3.15Å; R121-T124 PolarHBondContact O-OG1 3.48Å; I122-T124 VanDerWaalsContact C-N 3.34Å; I122-T124 PolarHBondContact O-N 3.05Å; T124-R128 WeakPolarHBondContact O-CG 3.45Å; T124-R128 PolarHBondContact O-N 3.06Å; T124-R128 VanDerWaalsContact O-N 3.14Å
125	L	84.8	Confident	80.8	Confident	7 Å²	7	86.6 Å²	86.6	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-68.9	-44.6	178.1	-69.5	172.7	0	0	0	111.3	R121 I122 K127 R128 I129 Y142 E145 L146 I149	R121-L125 HydrophobicContact CG-CD1 4.06Å; R121-L125 WeakPolarHBondContact O-CG 3.46Å; R121-L125 PolarHBondContact O-N 3.32Å; I122-L125 PolarHBondContact O-N 3.47Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 2.89Å; L125-R128 WeakPolarHBondContact O-CB 3.38Å; L125-R128 PolarHBondContact O-N 3.34Å; L125-I129 WeakPolarHBondContact O-CG1 3.49Å; L125-I129 PolarHBondContact O-N 3.42Å; L125-Y142 HydrophobicContact CD2-CD1 3.7Å; L125-Y142 HydrophobicContact CD2-CE1 4.28Å; L125-Y142 HydrophobicContact CD2-CG 4.35Å; L125-E145 HydrophobicContact CD1-CB 4.42Å; L125-E145 HydrophobicContact CD1-CG 4.06Å; L125-L146 HydrophobicContact CB-CD1 4.15Å; L125-L146 HydrophobicContact CB-CD2 3.83Å; L125-L146 HydrophobicContact CB-CG 3.95Å; L125-L146 HydrophobicContact CD1-CD2 3.91Å; L125-L146 HydrophobicContact CD1-CG 4.12Å; L125-I149 HydrophobicContact CD1-CD1 3.97Å
126	M	86	Confident	80.6	Confident	4 Å²	4	86.9 Å²	86.9	2%	0.02	41%	0.414	C	S	.	.	H	α-helix	trans	-62.6	-38.4	177	-166.3	65.2	-157.4	0	0	111.5	I122 R128 I129 Q130 L146 Y164 A167 V171	I122-M126 VanDerWaalsContact O-CB 3.29Å; I122-M126 WeakPolarHBondContact O-CB 3.34Å; I122-M126 PolarHBondContact O-N 2.97Å; M126-R128 VanDerWaalsContact C-N 3.32Å; M126-R128 PolarHBondContact O-N 3.13Å; M126-I129 HydrophobicContact CE-CG2 4.46Å; M126-I129 PolarHBondContact O-N 3.16Å; M126-I129 HydrophobicContact SD-CD1 4.45Å; M126-Q130 HydrophobicContact CE-CG 3.94Å; M126-Q130 HydrophobicContact CG-CG 4.49Å; M126-Q130 WeakPolarHBondContact O-CB 3.42Å; M126-Q130 WeakPolarHBondContact O-CG 3.14Å; M126-Q130 PolarHBondContact O-N 2.87Å; M126-L146 HydrophobicContact SD-CD1 4.32Å; M126-Y164 HydrophobicContact CB-CD1 4.4Å; M126-Y164 HydrophobicContact CG-CD1 3.8Å; M126-Y164 HydrophobicContact CG-CE1 4.21Å; M126-Y164 HydrophobicContact CG-CG 4.43Å; M126-A167 HydrophobicContact CE-CB 3.69Å; M126-V171 HydrophobicContact CE-CG2 4.3Å
127	K	84.8	Confident	80.4	Confident	159 Å²	159	82.8 Å²	82.8	69%	0.691	39%	0.394	S	S	*	.	H	α-helix	trans	-63.1	-37.6	173.9	-172.1	175.7	-179.4	179.2	0	112	A123 L125 Q130 S131	A123-K127 VanDerWaalsContact O-CB 3.28Å; A123-K127 WeakPolarHBondContact O-CB 3.35Å; A123-K127 PolarHBondContact O-N 3.01Å; L125-K127 VanDerWaalsContact C-N 3.29Å; L125-K127 PolarHBondContact O-N 2.89Å; K127-Q130 PolarHBondContact O-N 3.37Å; K127-S131 WeakPolarHBondContact O-CB 3.47Å; K127-S131 PolarHBondContact O-N 3.27Å
128	R	83.4	Confident	80.2	Confident	132 Å²	132	77.8 Å²	77.8	50%	0.498	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-45	174.4	-72.3	176.8	179	-171.2	0.7	111.3	T124 L125 M126 Q130 S131 Y142	T124-R128 WeakPolarHBondContact O-CG 3.45Å; T124-R128 PolarHBondContact O-N 3.06Å; T124-R128 VanDerWaalsContact O-N 3.14Å; L125-R128 WeakPolarHBondContact O-CB 3.38Å; L125-R128 PolarHBondContact O-N 3.34Å; M126-R128 VanDerWaalsContact C-N 3.32Å; M126-R128 PolarHBondContact O-N 3.13Å; R128-Q130 PolarHBondContact O-N 3.16Å; R128-S131 PolarHBondContact O-N 3.43Å; R128-S131 PolarHBondContact O-OG 2.82Å; R128-Y142 HydrophobicContact CB-CD2 4.23Å; R128-Y142 HydrophobicContact CB-CE2 4.1Å
129	I	81.6	Confident	80.1	Confident	11 Å²	11	75.9 Å²	75.9	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-59.9	-48	175.2	-66.9	170.5	0	0	0	111.1	L125 M126 S131 R132 Y142 V143 L146 L168 V171	L125-I129 WeakPolarHBondContact O-CG1 3.49Å; L125-I129 PolarHBondContact O-N 3.42Å; M126-I129 HydrophobicContact CE-CG2 4.46Å; M126-I129 PolarHBondContact O-N 3.16Å; M126-I129 HydrophobicContact SD-CD1 4.45Å; I129-S131 PolarHBondContact O-N 3.5Å; I129-R132 PolarHBondContact O-N 3.39Å; I129-Y142 HydrophobicContact CG1-CD2 4.34Å; I129-V143 HydrophobicContact CD1-CG2 3.87Å; I129-L146 HydrophobicContact CD1-CD1 3.43Å; I129-L146 VanDerWaalsContact CD1-CD1 3.43Å; I129-L168 HydrophobicContact CD1-CD1 4.38Å; I129-V171 HydrophobicContact CG2-CB 4.42Å; I129-V171 HydrophobicContact CG2-CG1 3.71Å; I129-V171 HydrophobicContact CG2-CG2 4.08Å
130	Q	79.9	Confident	80.1	Confident	118 Å²	118	73.8 Å²	73.8	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-67.5	-24.5	179.7	-72.2	179.3	-3	0	0	113.3	M126 K127 R128 R132	M126-Q130 HydrophobicContact CE-CG 3.94Å; M126-Q130 HydrophobicContact CG-CG 4.49Å; M126-Q130 WeakPolarHBondContact O-CB 3.42Å; M126-Q130 WeakPolarHBondContact O-CG 3.14Å; M126-Q130 PolarHBondContact O-N 2.87Å; K127-Q130 PolarHBondContact O-N 3.37Å; R128-Q130 PolarHBondContact O-N 3.16Å; Q130-R132 PolarHBondContact O-N 2.96Å
131	S	71.7	Confident	79.9	Confident	86 Å²	86	72.9 Å²	72.9	60%	0.601	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	0.1	175.9	75.8	0	0	0	0	113.9	K127 R128 I129 S133	K127-S131 WeakPolarHBondContact O-CB 3.47Å; K127-S131 PolarHBondContact O-N 3.27Å; R128-S131 PolarHBondContact O-N 3.43Å; R128-S131 PolarHBondContact O-OG 2.82Å; I129-S131 PolarHBondContact O-N 3.5Å; S131-S133 PolarHBondContact O-N 3.46Å
132	R	60.1	Low	79.8	Confident	226 Å²	226	68.5 Å²	68.5	85%	0.853	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	51	169.8	-146.2	166.3	-171.4	162.9	1.2	111	I129 Q130 K134	I129-R132 PolarHBondContact O-N 3.39Å; Q130-R132 PolarHBondContact O-N 2.96Å; R132-K134 PolarHBondContact O-N 2.82Å
133	S	58.2	Low	79.7	Confident	40 Å²	40	68.4 Å²	68.4	28%	0.28	33%	0.33	S	S	.	.			trans	-58	135.1	170.6	47.3	0	0	0	0	109.5	S131 D135 C139	S131-S133 PolarHBondContact O-N 3.46Å; S133-D135 PolarHBondContact O-N 3.37Å; S133-C139 PolarHBondContact OG-SG 2.97Å
134	K	63.8	Low	79.7	Confident	209 Å²	209	69.1 Å²	69.1	91%	0.909	33%	0.329	S	S	*	.	S	Bend	trans	-62.9	-19.9	179.6	-68.8	-177.9	177.1	-178.9	0	112.8	R132 L136	R132-K134 PolarHBondContact O-N 2.82Å; K134-L136 PolarHBondContact O-N 2.8Å
135	D	76.8	Confident	79.5	Confident	94 Å²	94	68.4 Å²	68.4	50%	0.503	32%	0.321	S	S	.	.			trans	-84.1	98.6	178.1	-80.8	-38	0	0	0	112.2	S133 C137 Q138 C139	S133-D135 PolarHBondContact O-N 3.37Å; D135-C137 PolarHBondContact O-N 3.18Å; D135-Q138 HydrophobicContact CB-CB 4.17Å; D135-Q138 HydrophobicContact CB-CG 4.07Å; D135-Q138 PolarHBondContact O-N 3.32Å; D135-C139 PolarHBondContact O-N 3.1Å
136	L	81.6	Confident	79.6	Confident	46 Å²	46	68.1 Å²	68.1	24%	0.241	32%	0.319	C	S	.	.	H	α-helix	trans	-57	-35.7	173.9	-74.2	164.7	0	0	0	112.5	K134 C139 A140 M175 L182 V201	K134-L136 PolarHBondContact O-N 2.8Å; L136-C139 WeakPolarHBondContact O-CB 3.4Å; L136-C139 PolarHBondContact O-N 3.08Å; L136-A140 PolarHBondContact O-N 3.16Å; L136-M175 VanDerWaalsContact O-CE 3.28Å; L136-M175 WeakPolarHBondContact O-CE 3.33Å; L136-L182 HydrophobicContact CD1-CD1 3.89Å; L136-V201 HydrophobicContact CB-CG2 3.79Å
137	C	81.7	Confident	79.5	Confident	20 Å²	20	69.8 Å²	69.8	14%	0.135	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-44	179.7	-62.3	0	0	0	0	112.2	D135 A140 M141 H204	D135-C137 PolarHBondContact O-N 3.18Å; C137-A140 WeakPolarHBondContact O-CB 3.4Å; C137-A140 PolarHBondContact O-N 3.06Å; C137-M141 WeakPolarHBondContact O-CG 3.24Å; C137-M141 PolarHBondContact O-N 3.37Å; C137-M141 VanDerWaalsContact O-N 3.13Å; C137-H204 PolarHBondContact O-ND1 3.28Å
138	Q	82.4	Confident	79.5	Confident	71 Å²	71	69.2 Å²	69.2	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-66.3	-40.2	177.4	-70.6	-173	10	0	0	111.8	D135 A140 M141 Y142	D135-Q138 HydrophobicContact CB-CB 4.17Å; D135-Q138 HydrophobicContact CB-CG 4.07Å; D135-Q138 PolarHBondContact O-N 3.32Å; Q138-A140 PolarHBondContact O-N 2.67Å; Q138-M141 PolarHBondContact O-N 3.5Å; Q138-Y142 HydrophobicContact CB-CE2 4.23Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.26Å; Q138-Y142 PolarHBondContact O-N 3.35Å; Q138-Y142 VanDerWaalsContact O-N 3.08Å
139	C	84	Confident	79.4	Confident	11 Å²	11	63.5 Å²	63.5	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-56.5	-41.4	172.8	-70.2	0	0	0	0	111.3	S133 D135 L136 M141 Y142 V143 M175	S133-C139 PolarHBondContact OG-SG 2.97Å; D135-C139 PolarHBondContact O-N 3.1Å; L136-C139 WeakPolarHBondContact O-CB 3.4Å; L136-C139 PolarHBondContact O-N 3.08Å; C139-M141 PolarHBondContact O-N 3.49Å; C139-Y142 PolarHBondContact O-N 3Å; C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 2.95Å; C139-M175 HydrophobicContact CB-CE 3.89Å; C139-M175 HydrophobicContact CB-SD 3.93Å
140	A	84.9	Confident	79.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-39.6	-178.3	0	0	0	0	0	111.4	L136 C137 Q138 V143 N144 M175 V201 H204 L205	L136-A140 PolarHBondContact O-N 3.16Å; C137-A140 WeakPolarHBondContact O-CB 3.4Å; C137-A140 PolarHBondContact O-N 3.06Å; Q138-A140 PolarHBondContact O-N 2.67Å; A140-V143 PolarHBondContact O-N 3.39Å; A140-N144 PolarHBondContact O-N 2.63Å; A140-M175 VanDerWaalsContact CA-CE 3.49Å; A140-M175 HydrophobicContact CB-CE 3.48Å; A140-M175 VanDerWaalsContact CB-CE 3.48Å; A140-V201 HydrophobicContact CB-CG1 4.16Å; A140-H204 HydrophobicContact CB-CB 3.49Å; A140-H204 VanDerWaalsContact CB-CB 3.49Å; A140-L205 HydrophobicContact CB-CD2 4.35Å; A140-L205 HydrophobicContact CB-CG 4.28Å
141	M	84.4	Confident	79.8	Confident	54 Å²	54	64.5 Å²	64.5	27%	0.266	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-46	173.8	-65.1	174.7	71.6	0	0	111.8	C137 Q138 C139 V143 N144 E145 H204 H304	C137-M141 WeakPolarHBondContact O-CG 3.24Å; C137-M141 PolarHBondContact O-N 3.37Å; C137-M141 VanDerWaalsContact O-N 3.13Å; Q138-M141 PolarHBondContact O-N 3.5Å; C139-M141 PolarHBondContact O-N 3.49Å; M141-V143 VanDerWaalsContact C-N 3.27Å; M141-V143 PolarHBondContact O-N 3.08Å; M141-N144 PolarHBondContact O-N 3.24Å; M141-E145 PolarHBondContact O-N 2.97Å; M141-H204 HydrophobicContact CG-CB 4.39Å; M141-H204 VanDerWaalsContact CG-CE1 3.47Å; M141-H204 WeakPolarHBondContact CG-CE1 3.47Å; M141-H204 WeakPolarHBondContact CG-NE2 3.46Å; M141-H304 HydrophobicContact CE-CB 3.51Å; M141-H304 HydrophobicContact SD-CB 4.32Å
142	Y	84.7	Confident	80.3	Confident	44 Å²	44	64 Å²	64	17%	0.173	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-35.2	177.3	-60.3	-40.9	0	0	0	112.1	L125 R128 I129 Q138 C139 L146	L125-Y142 HydrophobicContact CD2-CD1 3.7Å; L125-Y142 HydrophobicContact CD2-CE1 4.28Å; L125-Y142 HydrophobicContact CD2-CG 4.35Å; R128-Y142 HydrophobicContact CB-CD2 4.23Å; R128-Y142 HydrophobicContact CB-CE2 4.1Å; I129-Y142 HydrophobicContact CG1-CD2 4.34Å; Q138-Y142 HydrophobicContact CB-CE2 4.23Å; Q138-Y142 WeakPolarHBondContact O-CD2 3.26Å; Q138-Y142 PolarHBondContact O-N 3.35Å; Q138-Y142 VanDerWaalsContact O-N 3.08Å; C139-Y142 PolarHBondContact O-N 3Å; Y142-L146 WeakPolarHBondContact O-CB 3.49Å; Y142-L146 VanDerWaalsContact O-CG 3.25Å; Y142-L146 WeakPolarHBondContact O-CG 3.36Å; Y142-L146 PolarHBondContact O-N 2.97Å
143	V	85.9	Confident	81.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-45.7	174.5	170.7	0	0	0	0	110.8	I129 C139 A140 M141 E145 L146 D147 L168 V171 R172 M175 L205	I129-V143 HydrophobicContact CD1-CG2 3.87Å; C139-V143 WeakPolarHBondContact O-CG2 3.42Å; C139-V143 PolarHBondContact O-N 2.95Å; A140-V143 PolarHBondContact O-N 3.39Å; M141-V143 VanDerWaalsContact C-N 3.27Å; M141-V143 PolarHBondContact O-N 3.08Å; V143-E145 PolarHBondContact O-N 3.47Å; V143-L146 WeakPolarHBondContact O-CB 3.46Å; V143-L146 PolarHBondContact O-N 3.21Å; V143-D147 PolarHBondContact O-N 2.94Å; V143-L168 HydrophobicContact CB-CD1 4.27Å; V143-L168 HydrophobicContact CG1-CD1 4.01Å; V143-L168 HydrophobicContact CG2-CD1 3.96Å; V143-V171 HydrophobicContact CG2-CG1 4.24Å; V143-R172 HydrophobicContact CG1-CB 4.4Å; V143-R172 HydrophobicContact CG1-CG 4.44Å; V143-M175 HydrophobicContact CG2-SD 4.07Å; V143-L205 HydrophobicContact CB-CD2 4.19Å; V143-L205 HydrophobicContact CG1-CD2 3.8Å
144	N	84.5	Confident	82	Confident	47 Å²	47	61.3 Å²	61.3	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-42.6	178.2	-164.4	10.6	0	0	0	112.3	A140 M141 L146 D147 F148 H204 N206	A140-N144 PolarHBondContact O-N 2.63Å; M141-N144 PolarHBondContact O-N 3.24Å; N144-L146 VanDerWaalsContact C-N 3.32Å; N144-L146 PolarHBondContact O-N 2.77Å; N144-D147 PolarHBondContact O-N 2.88Å; N144-F148 PolarHBondContact O-N 3.41Å; N144-H204 WeakPolarHBondContact CB-O 3.47Å; N144-H204 PolarHBondContact ND2-O 3.41Å; N144-N206 PolarHBondContact OD1-ND2 3.34Å
145	E	84.7	Confident	82.7	Confident	57 Å²	57	53.9 Å²	53.9	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-40.7	175.6	-168.6	-172.8	159.4	0	0	111.4	R121 L125 M141 V143 F148 I149	R121-E145 IonicContact CZ-OE1 3.46Å; R121-E145 IonicContact NE-OE1 2.81Å; R121-E145 PolarHBondContact NE-OE1 3.33Å; R121-E145 IonicContact NH2-OE1 3.16Å; R121-E145 PolarHBondContact NH2-OE1 3.47Å; L125-E145 HydrophobicContact CD1-CB 4.42Å; L125-E145 HydrophobicContact CD1-CG 4.06Å; M141-E145 PolarHBondContact O-N 2.97Å; V143-E145 PolarHBondContact O-N 3.47Å; E145-F148 PolarHBondContact O-N 2.94Å; E145-I149 HydrophobicContact CG-CD1 4.13Å; E145-I149 VanDerWaalsContact O-CG1 3.24Å; E145-I149 WeakPolarHBondContact O-CG1 3.47Å; E145-I149 PolarHBondContact O-N 3.31Å
146	L	85.7	Confident	82.5	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-46.6	174.6	-78.3	175.2	0	0	0	111.7	I122 L125 M126 I129 Y142 V143 N144 F148 I149 F150 L168	I122-L146 HydrophobicContact CB-CD2 4.04Å; I122-L146 HydrophobicContact CG1-CD2 3.93Å; I122-L146 HydrophobicContact CG2-CD2 3.91Å; L125-L146 HydrophobicContact CB-CD1 4.15Å; L125-L146 HydrophobicContact CB-CD2 3.83Å; L125-L146 HydrophobicContact CB-CG 3.95Å; L125-L146 HydrophobicContact CD1-CD2 3.91Å; L125-L146 HydrophobicContact CD1-CG 4.12Å; M126-L146 HydrophobicContact SD-CD1 4.32Å; I129-L146 HydrophobicContact CD1-CD1 3.43Å; I129-L146 VanDerWaalsContact CD1-CD1 3.43Å; Y142-L146 WeakPolarHBondContact O-CB 3.49Å; Y142-L146 VanDerWaalsContact O-CG 3.25Å; Y142-L146 WeakPolarHBondContact O-CG 3.36Å; Y142-L146 PolarHBondContact O-N 2.97Å; V143-L146 WeakPolarHBondContact O-CB 3.46Å; V143-L146 PolarHBondContact O-N 3.21Å; N144-L146 VanDerWaalsContact C-N 3.32Å; N144-L146 PolarHBondContact O-N 2.77Å; L146-F148 VanDerWaalsContact C-N 3.27Å; L146-F148 PolarHBondContact O-N 3.4Å; L146-I149 PolarHBondContact O-N 3.15Å; L146-I149 VanDerWaalsContact O-N 3.13Å; L146-F150 HydrophobicContact CB-CD2 4.32Å; L146-F150 HydrophobicContact CB-CE2 4.39Å; L146-F150 HydrophobicContact CD2-CE2 4.36Å; L146-F150 WeakPolarHBondContact O-CB 3.25Å; L146-F150 WeakPolarHBondContact O-CD2 3.38Å; L146-F150 PolarHBondContact O-N 3Å; L146-L168 HydrophobicContact CB-CD1 4.09Å; L146-L168 HydrophobicContact CB-CD2 3.87Å; L146-L168 HydrophobicContact CD1-CD1 3.7Å
147	D	84.3	Confident	82.2	Confident	39 Å²	39	58 Å²	58	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-58	-41.7	176.9	-79	-23	0	0	0	111	V143 N144 F150 N151 L168	V143-D147 PolarHBondContact O-N 2.94Å; N144-D147 PolarHBondContact O-N 2.88Å; D147-F150 PolarHBondContact O-N 3.32Å; D147-N151 WeakPolarHBondContact O-CB 3.29Å; D147-N151 PolarHBondContact O-N 3.41Å; D147-N151 PolarHBondContact O-ND2 3.25Å; D147-N151 VanDerWaalsContact O-ND2 3.16Å; D147-L168 WeakPolarHBondContact OD1-CD2 3.3Å
148	F	84.4	Confident	82.1	Confident	148 Å²	148	59.8 Å²	59.8	65%	0.649	31%	0.308	S	S	*	.	H	α-helix	trans	-62.3	-46.3	174.2	-178.6	-95.9	0	0	0	112.4	N144 E145 L146 N151 S152	N144-F148 PolarHBondContact O-N 3.41Å; E145-F148 PolarHBondContact O-N 2.94Å; L146-F148 VanDerWaalsContact C-N 3.27Å; L146-F148 PolarHBondContact O-N 3.4Å; F148-N151 PolarHBondContact O-N 2.72Å; F148-S152 PolarHBondContact O-N 2.97Å
149	I	83.2	Confident	82	Confident	12 Å²	12	63.5 Å²	63.5	6%	0.062	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-43.4	179	-65	164.6	0	0	0	110.5	N118 R121 I122 L125 E145 L146 N151 S152 M153	N118-I149 HydrophobicContact CB-CG2 4.39Å; R121-I149 HydrophobicContact CG-CD1 4.02Å; I122-I149 HydrophobicContact CD1-CG2 3.84Å; I122-I149 HydrophobicContact CG1-CG2 3.83Å; L125-I149 HydrophobicContact CD1-CD1 3.97Å; E145-I149 HydrophobicContact CG-CD1 4.13Å; E145-I149 VanDerWaalsContact O-CG1 3.24Å; E145-I149 WeakPolarHBondContact O-CG1 3.47Å; E145-I149 PolarHBondContact O-N 3.31Å; L146-I149 PolarHBondContact O-N 3.15Å; L146-I149 VanDerWaalsContact O-N 3.13Å; I149-N151 VanDerWaalsContact C-N 3.31Å; I149-N151 PolarHBondContact O-N 3.39Å; I149-S152 PolarHBondContact O-N 3.18Å; I149-S152 PolarHBondContact O-OG 3.25Å; I149-M153 PolarHBondContact O-N 3.46Å
150	F	84.5	Confident	81.9	Confident	8 Å²	8	66.7 Å²	66.7	4%	0.035	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-37.3	176.2	-82.6	-67.6	0	0	0	111.9	I122 L146 D147 S152 W155 L161 N165 L168	I122-F150 HydrophobicContact CD1-CE1 4.23Å; I122-F150 HydrophobicContact CD1-CZ 4.24Å; I122-F150 HydrophobicContact CG2-CE2 4.24Å; I122-F150 HydrophobicContact CG2-CZ 3.92Å; L146-F150 HydrophobicContact CB-CD2 4.32Å; L146-F150 HydrophobicContact CB-CE2 4.39Å; L146-F150 HydrophobicContact CD2-CE2 4.36Å; L146-F150 WeakPolarHBondContact O-CB 3.25Å; L146-F150 WeakPolarHBondContact O-CD2 3.38Å; L146-F150 PolarHBondContact O-N 3Å; D147-F150 PolarHBondContact O-N 3.32Å; F150-S152 VanDerWaalsContact C-N 3.33Å; F150-S152 PolarHBondContact O-N 3.13Å; F150-W155 HydrophobicContact CD1-CB 4.48Å; F150-W155 AromaticContact CD1-CD1 3.68Å; F150-W155 HydrophobicContact CD1-CD2 4Å; F150-W155 AromaticContact CD1-CG 3.81Å; F150-W155 HydrophobicContact CD1-CG 3.81Å; F150-W155 AromaticContact CD1-NE1 3.83Å; F150-W155 HydrophobicContact CE1-CD2 4.45Å; F150-W155 HydrophobicContact CE1-CG 4.35Å; F150-W155 PolarHBondContact O-NE1 3.4Å; F150-L161 HydrophobicContact CE1-CB 4.29Å; F150-L161 HydrophobicContact CE1-CD2 4.31Å; F150-N165 HydrophobicContact CE1-CB 4.15Å; F150-N165 HydrophobicContact CZ-CB 4.23Å; F150-L168 HydrophobicContact CD2-CD2 3.73Å; F150-L168 HydrophobicContact CE2-CD2 3.77Å
151	N	83.7	Confident	81.8	Confident	142 Å²	142	66.7 Å²	66.7	76%	0.759	34%	0.344	S	S	*	.	H	α-helix	trans	-72.1	-25.9	176.4	-70.4	-25.4	0	0	0	113.5	D147 F148 I149	D147-N151 WeakPolarHBondContact O-CB 3.29Å; D147-N151 PolarHBondContact O-N 3.41Å; D147-N151 PolarHBondContact O-ND2 3.25Å; D147-N151 VanDerWaalsContact O-ND2 3.16Å; F148-N151 PolarHBondContact O-N 2.72Å; I149-N151 VanDerWaalsContact C-N 3.31Å; I149-N151 PolarHBondContact O-N 3.39Å
152	S	82.5	Confident	81.9	Confident	76 Å²	76	66.6 Å²	66.6	53%	0.531	34%	0.343	S	S	.	.	H	α-helix	trans	-83.8	-9.7	-178.8	72.5	0	0	0	0	114.7	F148 I149 F150	F148-S152 PolarHBondContact O-N 2.97Å; I149-S152 PolarHBondContact O-N 3.18Å; I149-S152 PolarHBondContact O-OG 3.25Å; F150-S152 VanDerWaalsContact C-N 3.33Å; F150-S152 PolarHBondContact O-N 3.13Å
153	M	79	Confident	81.9	Confident	20 Å²	20	67.1 Å²	67.1	10%	0.099	35%	0.353	C	S	.	.	S	Bend	trans	-126.1	142.1	-169.9	176.7	175.7	162.7	0	0	111.5	V115 N118 I149 W155 I158 L161	V115-M153 HydrophobicContact CB-CE 4.24Å; V115-M153 HydrophobicContact CG1-CE 3.53Å; V115-M153 HydrophobicContact CG2-CE 4.1Å; N118-M153 HydrophobicContact CB-SD 3.81Å; I149-M153 PolarHBondContact O-N 3.46Å; M153-W155 HydrophobicContact CE-CB 4.37Å; M153-W155 PolarHBondContact O-N 2.92Å; M153-I158 HydrophobicContact CE-CD1 3.91Å; M153-L161 HydrophobicContact CE-CD1 3.58Å; M153-L161 HydrophobicContact SD-CD1 4.37Å
154	E	74.4	Confident	82	Confident	188 Å²	188	70 Å²	70	88%	0.879	37%	0.365	S	S	*	.			trans	-77.5	96.1	164.2	-67.2	176.9	178.4	0	0	108.8
155	W	79.3	Confident	82	Confident	53 Å²	53	69.5 Å²	69.5	20%	0.201	36%	0.362	C	S	.	.			trans	-104.1	-8.9	-178.4	53.2	-93.9	0	0	0	113.9	F150 M153 G157 I158 L161 E162 N165	F150-W155 HydrophobicContact CD1-CB 4.48Å; F150-W155 AromaticContact CD1-CD1 3.68Å; F150-W155 HydrophobicContact CD1-CD2 4Å; F150-W155 AromaticContact CD1-CG 3.81Å; F150-W155 HydrophobicContact CD1-CG 3.81Å; F150-W155 AromaticContact CD1-NE1 3.83Å; F150-W155 HydrophobicContact CE1-CD2 4.45Å; F150-W155 HydrophobicContact CE1-CG 4.35Å; F150-W155 PolarHBondContact O-NE1 3.4Å; M153-W155 HydrophobicContact CE-CB 4.37Å; M153-W155 PolarHBondContact O-N 2.92Å; W155-G157 PolarHBondContact O-N 2.85Å; W155-I158 PolarHBondContact O-N 2.96Å; W155-L161 HydrophobicContact CB-CB 4.21Å; W155-L161 HydrophobicContact CB-CD1 3.61Å; W155-E162 HydrophobicContact CZ3-CG 4.41Å; W155-N165 WeakPolarHBondContact CH2-ND2 3.28Å; W155-N165 WeakPolarHBondContact CZ2-ND2 3.33Å; W155-N165 HydrophobicContact CZ3-CB 4.43Å
156	E	72.7	Confident	82.1	Confident	169 Å²	169	74.9 Å²	74.9	79%	0.79	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	126	178.3	-65.9	-174.5	169.4	0	0	110.4
157	G	75.7	Confident	82.2	Confident	58 Å²	58	76 Å²	76	60%	0.598	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-10.7	-176.6	0	0	0	0	0	115.5	W155 H159 E162	W155-G157 PolarHBondContact O-N 2.85Å; G157-H159 PolarHBondContact O-N 2.98Å; G157-E162 PolarHBondContact N-OE1 2.82Å
158	I	78.8	Confident	82.3	Confident	57 Å²	57	74.1 Å²	74.1	29%	0.292	38%	0.379	S	S	.	.			trans	-92.9	98.7	172.5	-57.3	174.3	0	0	0	109	V115 I119 M153 W155 V160 L161 E162	V115-I158 HydrophobicContact CG1-CD1 4.3Å; I119-I158 HydrophobicContact CD1-CD1 4.39Å; M153-I158 HydrophobicContact CE-CD1 3.91Å; W155-I158 PolarHBondContact O-N 2.96Å; I158-V160 PolarHBondContact O-N 3.27Å; I158-L161 HydrophobicContact CB-CB 4.19Å; I158-L161 HydrophobicContact CB-CD1 4.04Å; I158-L161 HydrophobicContact CB-CG 4.21Å; I158-L161 HydrophobicContact CD1-CD1 3.86Å; I158-L161 HydrophobicContact CG2-CB 4.21Å; I158-L161 HydrophobicContact CG2-CD1 4.05Å; I158-L161 HydrophobicContact CG2-CG 3.89Å; I158-L161 WeakPolarHBondContact O-CA 3.4Å; I158-L161 WeakPolarHBondContact O-CB 3.33Å; I158-L161 PolarHBondContact O-N 3.28Å; I158-E162 PolarHBondContact O-N 3.02Å
159	H	81.4	Confident	82.4	Confident	149 Å²	149	70.4 Å²	70.4	69%	0.69	37%	0.368	S	S	*	.	H	α-helix	trans	-51.7	-35	-174.9	-78.9	-45.3	0	0	0	115.5	G157 E162 S163	G157-H159 PolarHBondContact O-N 2.98Å; H159-E162 IonicContact CE1-OE2 3.73Å; H159-E162 IonicContact ND1-OE2 2.66Å; H159-E162 PolarHBondContact ND1-OE2 2.96Å; H159-E162 VanDerWaalsContact ND1-OE2 3.09Å; H159-S163 PolarHBondContact O-N 3.36Å
160	V	80.6	Confident	82.6	Confident	78 Å²	78	76.3 Å²	76.3	47%	0.473	40%	0.396	S	S	.	.	H	α-helix	trans	-65.6	-43.4	176.8	179.2	0	0	0	0	110.6	I158 S163 Y164	I158-V160 PolarHBondContact O-N 3.27Å; V160-S163 PolarHBondContact O-N 3.37Å; V160-S163 PolarHBondContact O-OG 3.26Å; V160-Y164 HydrophobicContact CG1-CD2 3.94Å; V160-Y164 HydrophobicContact CG1-CE2 3.44Å; V160-Y164 VanDerWaalsContact CG1-CE2 3.44Å; V160-Y164 WeakPolarHBondContact O-CD2 3.41Å; V160-Y164 PolarHBondContact O-N 3.36Å
161	L	83.4	Confident	82.7	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	41%	0.405	C	S	.	.	H	α-helix	trans	-69.9	-37.8	178.1	-68.8	-179.7	0	0	0	112	I119 I122 F150 M153 W155 I158 S163 Y164 N165	I119-L161 HydrophobicContact CD1-CD1 4.46Å; I119-L161 HydrophobicContact CG1-CD1 3.93Å; I119-L161 HydrophobicContact CG1-CD2 4.12Å; I119-L161 HydrophobicContact CG1-CG 4.23Å; I122-L161 HydrophobicContact CB-CD2 4.43Å; I122-L161 HydrophobicContact CD1-CD2 3.66Å; I122-L161 HydrophobicContact CG2-CD2 4.05Å; F150-L161 HydrophobicContact CE1-CB 4.29Å; F150-L161 HydrophobicContact CE1-CD2 4.31Å; M153-L161 HydrophobicContact CE-CD1 3.58Å; M153-L161 HydrophobicContact SD-CD1 4.37Å; W155-L161 HydrophobicContact CB-CB 4.21Å; W155-L161 HydrophobicContact CB-CD1 3.61Å; I158-L161 HydrophobicContact CB-CB 4.19Å; I158-L161 HydrophobicContact CB-CD1 4.04Å; I158-L161 HydrophobicContact CB-CG 4.21Å; I158-L161 HydrophobicContact CD1-CD1 3.86Å; I158-L161 HydrophobicContact CG2-CB 4.21Å; I158-L161 HydrophobicContact CG2-CD1 4.05Å; I158-L161 HydrophobicContact CG2-CG 3.89Å; I158-L161 WeakPolarHBondContact O-CA 3.4Å; I158-L161 WeakPolarHBondContact O-CB 3.33Å; I158-L161 PolarHBondContact O-N 3.28Å; L161-S163 VanDerWaalsContact C-N 3.26Å; L161-S163 PolarHBondContact O-N 3.13Å; L161-Y164 HydrophobicContact CD2-CD2 4.41Å; L161-Y164 PolarHBondContact O-N 3.26Å; L161-N165 WeakPolarHBondContact O-CB 3.47Å; L161-N165 PolarHBondContact O-N 3.2Å
162	E	85.5	Confident	83	Confident	52 Å²	52	75.5 Å²	75.5	24%	0.243	39%	0.386	C	S	.	.	H	α-helix	trans	-60.5	-37.3	173.1	-68.9	173.8	174.4	0	0	112.2	W155 G157 I158 H159 R166	W155-E162 HydrophobicContact CZ3-CG 4.41Å; G157-E162 PolarHBondContact N-OE1 2.82Å; I158-E162 PolarHBondContact O-N 3.02Å; H159-E162 IonicContact CE1-OE2 3.73Å; H159-E162 IonicContact ND1-OE2 2.66Å; H159-E162 PolarHBondContact ND1-OE2 2.96Å; H159-E162 VanDerWaalsContact ND1-OE2 3.09Å; E162-R166 PolarHBondContact O-N 3.11Å; E162-R166 VanDerWaalsContact O-N 3.1Å
163	S	86.6	Confident	83.2	Confident	55 Å²	55	78 Å²	78	39%	0.385	39%	0.389	S	S	.	.	H	α-helix	trans	-68.6	-40.5	175.6	80.3	0	0	0	0	111.7	H159 V160 L161 R166 A167	H159-S163 PolarHBondContact O-N 3.36Å; V160-S163 PolarHBondContact O-N 3.37Å; V160-S163 PolarHBondContact O-OG 3.26Å; L161-S163 VanDerWaalsContact C-N 3.26Å; L161-S163 PolarHBondContact O-N 3.13Å; S163-R166 PolarHBondContact O-N 3.06Å; S163-A167 PolarHBondContact O-N 2.79Å; S163-A167 VanDerWaalsContact O-N 3.08Å
164	Y	86.4	Confident	83.7	Confident	61 Å²	61	79.8 Å²	79.8	24%	0.239	40%	0.403	C	S	.	.	H	α-helix	trans	-68.3	-39.1	175.7	-70.6	-38.5	0	0	0	112.5	I122 A123 M126 V160 L161 A167 L168	I122-Y164 HydrophobicContact CG2-CD2 4.07Å; A123-Y164 HydrophobicContact CB-CE2 4.48Å; M126-Y164 HydrophobicContact CB-CD1 4.4Å; M126-Y164 HydrophobicContact CG-CD1 3.8Å; M126-Y164 HydrophobicContact CG-CE1 4.21Å; M126-Y164 HydrophobicContact CG-CG 4.43Å; V160-Y164 HydrophobicContact CG1-CD2 3.94Å; V160-Y164 HydrophobicContact CG1-CE2 3.44Å; V160-Y164 VanDerWaalsContact CG1-CE2 3.44Å; V160-Y164 WeakPolarHBondContact O-CD2 3.41Å; V160-Y164 PolarHBondContact O-N 3.36Å; L161-Y164 HydrophobicContact CD2-CD2 4.41Å; L161-Y164 PolarHBondContact O-N 3.26Å; Y164-A167 PolarHBondContact O-N 3.01Å; Y164-L168 WeakPolarHBondContact O-CB 3.35Å; Y164-L168 PolarHBondContact O-N 3.37Å
165	N	85.5	Confident	84.3	Confident	36 Å²	36	71.1 Å²	71.1	19%	0.193	36%	0.363	C	S	.	.	H	α-helix	trans	-63.8	-43.8	176.1	-172.3	24.2	0	0	0	111.3	F150 W155 L161 A167 L168 V169	F150-N165 HydrophobicContact CE1-CB 4.15Å; F150-N165 HydrophobicContact CZ-CB 4.23Å; W155-N165 WeakPolarHBondContact CH2-ND2 3.28Å; W155-N165 WeakPolarHBondContact CZ2-ND2 3.33Å; W155-N165 HydrophobicContact CZ3-CB 4.43Å; L161-N165 WeakPolarHBondContact O-CB 3.47Å; L161-N165 PolarHBondContact O-N 3.2Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 2.79Å; N165-L168 WeakPolarHBondContact O-CB 3.32Å; N165-L168 PolarHBondContact O-N 2.78Å; N165-L168 VanDerWaalsContact O-N 3.13Å; N165-V169 WeakPolarHBondContact O-CG2 3.35Å; N165-V169 PolarHBondContact O-N 3.27Å
166	R	86.8	Confident	84.8	Confident	169 Å²	169	70 Å²	70	64%	0.638	36%	0.362	S	S	*	.	H	α-helix	trans	-58.6	-42.8	173.1	-86.2	-174.7	-87.7	167.6	-11.5	112.7	E162 S163 Q170	E162-R166 PolarHBondContact O-N 3.11Å; E162-R166 VanDerWaalsContact O-N 3.1Å; S163-R166 PolarHBondContact O-N 3.06Å; R166-Q170 WeakPolarHBondContact O-CG 3.49Å; R166-Q170 PolarHBondContact O-N 3.24Å
167	A	86.9	Confident	85.7	Confident	24 Å²	24	65.7 Å²	65.7	20%	0.198	35%	0.351	C	S	.	.	H	α-helix	trans	-66.9	-37.2	175.8	0	0	0	0	0	112.1	M126 S163 Y164 N165 Q170 V171	M126-A167 HydrophobicContact CE-CB 3.69Å; S163-A167 PolarHBondContact O-N 2.79Å; S163-A167 VanDerWaalsContact O-N 3.08Å; Y164-A167 PolarHBondContact O-N 3.01Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 2.79Å; A167-Q170 PolarHBondContact O-N 3.11Å; A167-V171 WeakPolarHBondContact O-CG2 3.35Å; A167-V171 PolarHBondContact O-N 2.9Å
168	L	86	Confident	86.4	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-45.9	177.1	-175.4	66.5	0	0	0	111.3	I129 V143 L146 D147 F150 Y164 N165 Q170 V171 R172	I129-L168 HydrophobicContact CD1-CD1 4.38Å; V143-L168 HydrophobicContact CB-CD1 4.27Å; V143-L168 HydrophobicContact CG1-CD1 4.01Å; V143-L168 HydrophobicContact CG2-CD1 3.96Å; L146-L168 HydrophobicContact CB-CD1 4.09Å; L146-L168 HydrophobicContact CB-CD2 3.87Å; L146-L168 HydrophobicContact CD1-CD1 3.7Å; D147-L168 WeakPolarHBondContact OD1-CD2 3.3Å; F150-L168 HydrophobicContact CD2-CD2 3.73Å; F150-L168 HydrophobicContact CE2-CD2 3.77Å; Y164-L168 WeakPolarHBondContact O-CB 3.35Å; Y164-L168 PolarHBondContact O-N 3.37Å; N165-L168 WeakPolarHBondContact O-CB 3.32Å; N165-L168 PolarHBondContact O-N 2.78Å; N165-L168 VanDerWaalsContact O-N 3.13Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; L168-Q170 PolarHBondContact O-N 3.13Å; L168-V171 PolarHBondContact O-N 3.04Å; L168-R172 WeakPolarHBondContact O-CB 3.39Å; L168-R172 PolarHBondContact O-N 3.17Å
169	V	87.1	Confident	86.9	Confident	69 Å²	69	64.3 Å²	64.3	42%	0.418	33%	0.328	S	S	.	.	H	α-helix	trans	-59	-45.4	176.1	174	0	0	0	0	111.1	N165 V171 R172 E173	N165-V169 WeakPolarHBondContact O-CG2 3.35Å; N165-V169 PolarHBondContact O-N 3.27Å; V169-V171 PolarHBondContact O-N 3.45Å; V169-R172 WeakPolarHBondContact O-CB 3.21Å; V169-R172 PolarHBondContact O-N 3.24Å; V169-E173 PolarHBondContact O-N 2.92Å
170	Q	88.6	Confident	87.4	Confident	136 Å²	136	59.5 Å²	59.5	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-63.7	-40.9	177.3	-71.5	178.5	-4.7	0	0	112.7	R166 A167 L168 R172 S174	R166-Q170 WeakPolarHBondContact O-CG 3.49Å; R166-Q170 PolarHBondContact O-N 3.24Å; A167-Q170 PolarHBondContact O-N 3.11Å; L168-Q170 VanDerWaalsContact C-N 3.35Å; L168-Q170 PolarHBondContact O-N 3.13Å; Q170-R172 VanDerWaalsContact C-N 3.35Å; Q170-S174 WeakPolarHBondContact O-CB 3.34Å; Q170-S174 PolarHBondContact O-N 3.21Å
171	V	86.3	Confident	87.9	Confident	39 Å²	39	59.1 Å²	59.1	24%	0.236	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-44.8	175.1	170.6	0	0	0	0	110	M126 I129 V143 A167 L168 V169 E173 S174 M175	M126-V171 HydrophobicContact CE-CG2 4.3Å; I129-V171 HydrophobicContact CG2-CB 4.42Å; I129-V171 HydrophobicContact CG2-CG1 3.71Å; I129-V171 HydrophobicContact CG2-CG2 4.08Å; V143-V171 HydrophobicContact CG2-CG1 4.24Å; A167-V171 WeakPolarHBondContact O-CG2 3.35Å; A167-V171 PolarHBondContact O-N 2.9Å; L168-V171 PolarHBondContact O-N 3.04Å; V169-V171 PolarHBondContact O-N 3.45Å; V171-E173 PolarHBondContact O-N 3.04Å; V171-S174 PolarHBondContact O-N 2.93Å; V171-M175 HydrophobicContact CG1-CG 4.17Å; V171-M175 HydrophobicContact CG1-SD 3.93Å; V171-M175 WeakPolarHBondContact O-CB 3.28Å; V171-M175 VanDerWaalsContact O-CG 3.27Å; V171-M175 WeakPolarHBondContact O-CG 3.42Å; V171-M175 PolarHBondContact O-N 3.43Å
172	R	88.7	Confident	88.2	Confident	95 Å²	95	60.9 Å²	60.9	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-58.3	-47.4	178.3	-172.6	175.9	179.4	-143.9	-0.6	111.5	V143 L168 V169 Q170 S174 M175 V176 L205	V143-R172 HydrophobicContact CG1-CB 4.4Å; V143-R172 HydrophobicContact CG1-CG 4.44Å; L168-R172 WeakPolarHBondContact O-CB 3.39Å; L168-R172 PolarHBondContact O-N 3.17Å; V169-R172 WeakPolarHBondContact O-CB 3.21Å; V169-R172 PolarHBondContact O-N 3.24Å; Q170-R172 VanDerWaalsContact C-N 3.35Å; R172-S174 PolarHBondContact O-N 2.86Å; R172-M175 PolarHBondContact O-N 3.44Å; R172-V176 WeakPolarHBondContact O-CG2 3.38Å; R172-V176 PolarHBondContact O-N 3.27Å; R172-L205 HydrophobicContact CG-CD2 4.36Å
173	E	88.5	Confident	88.4	Confident	128 Å²	128	58.4 Å²	58.4	60%	0.598	30%	0.302	S	S	*	.	H	α-helix	trans	-62	-41.5	176.2	-73.3	-179.7	173.3	0	0	112.8	V169 V171 M175 V176 S177	V169-E173 PolarHBondContact O-N 2.92Å; V171-E173 PolarHBondContact O-N 3.04Å; E173-M175 VanDerWaalsContact C-N 3.34Å; E173-M175 PolarHBondContact O-N 3.26Å; E173-V176 PolarHBondContact O-N 2.9Å; E173-S177 PolarHBondContact O-N 3.43Å; E173-S177 PolarHBondContact O-OG 3.03Å
174	S	88.3	Confident	88.5	Confident	57 Å²	57	58.7 Å²	58.7	40%	0.399	30%	0.299	S	S	.	.	H	α-helix	trans	-64.3	-39.7	176.1	-172	0	0	0	0	111.9	Q170 V171 R172 S177 Q178	Q170-S174 WeakPolarHBondContact O-CB 3.34Å; Q170-S174 PolarHBondContact O-N 3.21Å; V171-S174 PolarHBondContact O-N 2.93Å; R172-S174 PolarHBondContact O-N 2.86Å; S174-S177 PolarHBondContact O-N 3.06Å; S174-Q178 VanDerWaalsContact O-CG 3.32Å; S174-Q178 WeakPolarHBondContact O-CG 3.5Å; S174-Q178 PolarHBondContact O-N 3.24Å; S174-Q178 PolarHBondContact O-NE2 3.4Å; S174-Q178 PolarHBondContact OG-NE2 3.08Å; S174-Q178 VanDerWaalsContact OG-NE2 3.09Å
175	M	87.2	Confident	88.6	Confident	7 Å²	7	57.7 Å²	57.7	3%	0.034	30%	0.301	C	S	.	.	H	α-helix	trans	-67.5	-42.7	177.5	-73.7	-172	64.1	0	0	112.2	L136 C139 A140 V143 V171 R172 E173 S177 Q178 A179 V201 L205	L136-M175 VanDerWaalsContact O-CE 3.28Å; L136-M175 WeakPolarHBondContact O-CE 3.33Å; C139-M175 HydrophobicContact CB-CE 3.89Å; C139-M175 HydrophobicContact CB-SD 3.93Å; A140-M175 VanDerWaalsContact CA-CE 3.49Å; A140-M175 HydrophobicContact CB-CE 3.48Å; A140-M175 VanDerWaalsContact CB-CE 3.48Å; V143-M175 HydrophobicContact CG2-SD 4.07Å; V171-M175 HydrophobicContact CG1-CG 4.17Å; V171-M175 HydrophobicContact CG1-SD 3.93Å; V171-M175 WeakPolarHBondContact O-CB 3.28Å; V171-M175 VanDerWaalsContact O-CG 3.27Å; V171-M175 WeakPolarHBondContact O-CG 3.42Å; V171-M175 PolarHBondContact O-N 3.43Å; R172-M175 PolarHBondContact O-N 3.44Å; E173-M175 VanDerWaalsContact C-N 3.34Å; E173-M175 PolarHBondContact O-N 3.26Å; M175-S177 VanDerWaalsContact C-N 3.29Å; M175-S177 PolarHBondContact O-N 3.27Å; M175-Q178 PolarHBondContact O-N 3.14Å; M175-A179 WeakPolarHBondContact O-CB 3.47Å; M175-A179 PolarHBondContact O-N 3.41Å; M175-V201 HydrophobicContact CE-CG1 3.97Å; M175-L205 HydrophobicContact CB-CD1 4.41Å
176	V	90.6	Very high	88.6	Confident	28 Å²	28	56 Å²	56	17%	0.17	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-44.3	173.3	167.9	0	0	0	0	110.5	R172 E173 A179 W180 F202 L205 M207	R172-V176 WeakPolarHBondContact O-CG2 3.38Å; R172-V176 PolarHBondContact O-N 3.27Å; E173-V176 PolarHBondContact O-N 2.9Å; V176-A179 PolarHBondContact O-N 3.35Å; V176-W180 PolarHBondContact O-N 3.21Å; V176-F202 HydrophobicContact CG1-CE1 4.2Å; V176-F202 HydrophobicContact CG2-CE1 4.42Å; V176-L205 HydrophobicContact CG2-CD1 3.97Å; V176-M207 HydrophobicContact CG2-SD 4.05Å
177	S	91.2	Very high	88.5	Confident	80 Å²	80	49.5 Å²	49.5	56%	0.559	27%	0.268	S	S	*	.	H	α-helix	trans	-63.8	-42.1	178	-57.3	0	0	0	0	112.5	E173 S174 M175 S181	E173-S177 PolarHBondContact O-N 3.43Å; E173-S177 PolarHBondContact O-OG 3.03Å; S174-S177 PolarHBondContact O-N 3.06Å; M175-S177 VanDerWaalsContact C-N 3.29Å; M175-S177 PolarHBondContact O-N 3.27Å; S177-S181 PolarHBondContact O-N 3.5Å
178	Q	89.4	Confident	88.3	Confident	85 Å²	85	56 Å²	56	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-67.9	-41.3	177.3	-72.9	173.7	54.2	0	0	112	S174 M175 S181 L182	S174-Q178 VanDerWaalsContact O-CG 3.32Å; S174-Q178 WeakPolarHBondContact O-CG 3.5Å; S174-Q178 PolarHBondContact O-N 3.24Å; S174-Q178 PolarHBondContact O-NE2 3.4Å; S174-Q178 PolarHBondContact OG-NE2 3.08Å; S174-Q178 VanDerWaalsContact OG-NE2 3.09Å; M175-Q178 PolarHBondContact O-N 3.14Å; Q178-S181 WeakPolarHBondContact O-CB 3.39Å; Q178-S181 PolarHBondContact O-N 3.5Å; Q178-L182 WeakPolarHBondContact O-CG 3.42Å; Q178-L182 PolarHBondContact O-N 2.99Å
179	A	90.7	Very high	88.1	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-40.9	176.8	0	0	0	0	0	111.7	M175 V176 S181 L182 I183 V201 F202	M175-A179 WeakPolarHBondContact O-CB 3.47Å; M175-A179 PolarHBondContact O-N 3.41Å; V176-A179 PolarHBondContact O-N 3.35Å; A179-S181 VanDerWaalsContact C-N 3.34Å; A179-S181 PolarHBondContact O-N 3.3Å; A179-L182 PolarHBondContact O-N 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 2.96Å; A179-I183 PolarHBondContact O-N 2.98Å; A179-V201 HydrophobicContact CB-CB 4.22Å; A179-V201 HydrophobicContact CB-CG1 3.88Å; A179-F202 HydrophobicContact CB-CD2 3.97Å; A179-F202 HydrophobicContact CB-CE1 4.05Å; A179-F202 HydrophobicContact CB-CE2 3.41Å; A179-F202 VanDerWaalsContact CB-CE2 3.41Å; A179-F202 HydrophobicContact CB-CG 4.49Å; A179-F202 HydrophobicContact CB-CZ 3.47Å; A179-F202 VanDerWaalsContact CB-CZ 3.47Å
180	W	92.2	Very high	87.7	Confident	47 Å²	47	62.8 Å²	62.8	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-39.1	171.8	-88.5	118.3	0	0	0	113.1	V176 L182 I183 N184 F202 V211 E214 L215	V176-W180 PolarHBondContact O-N 3.21Å; W180-L182 VanDerWaalsContact C-N 3.35Å; W180-I183 PolarHBondContact O-N 3.06Å; W180-N184 PolarHBondContact O-N 3.25Å; W180-N184 PolarHBondContact O-ND2 2.87Å; W180-F202 AromaticContact CD1-CZ 3.7Å; W180-F202 HydrophobicContact CD2-CZ 4.2Å; W180-F202 AromaticContact CG-CZ 3.95Å; W180-F202 HydrophobicContact CG-CZ 3.95Å; W180-F202 AromaticContact NE1-CZ 3.78Å; W180-V211 HydrophobicContact CH2-CG1 3.94Å; W180-V211 HydrophobicContact CZ2-CB 4.49Å; W180-V211 HydrophobicContact CZ2-CG1 4Å; W180-V211 HydrophobicContact CZ2-CG2 4.2Å; W180-E214 HydrophobicContact CH2-CB 4.37Å; W180-E214 HydrophobicContact CH2-CG 4.25Å; W180-E214 HydrophobicContact CZ2-CB 4.46Å; W180-E214 HydrophobicContact CZ2-CG 4.3Å; W180-E214 WeakPolarHBondContact CZ2-OE2 3.47Å; W180-L215 HydrophobicContact CH2-CD2 4.19Å; W180-L215 HydrophobicContact CH2-CG 3.98Å; W180-L215 HydrophobicContact CZ3-CD2 3.74Å; W180-L215 HydrophobicContact CZ3-CG 3.98Å
181	S	91	Very high	87.4	Confident	70 Å²	70	58.4 Å²	58.4	49%	0.49	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-44.8	174.4	-171.1	0	0	0	0	111.3	S177 Q178 A179 N184 S185	S177-S181 PolarHBondContact O-N 3.5Å; Q178-S181 WeakPolarHBondContact O-CB 3.39Å; Q178-S181 PolarHBondContact O-N 3.5Å; A179-S181 VanDerWaalsContact C-N 3.34Å; A179-S181 PolarHBondContact O-N 3.3Å; S181-N184 PolarHBondContact O-N 2.9Å; S181-S185 WeakPolarHBondContact O-CB 3.36Å; S181-S185 PolarHBondContact O-N 3.43Å; S181-S185 PolarHBondContact O-OG 2.98Å; S181-S185 VanDerWaalsContact O-OG 3.11Å
182	L	88.6	Confident	87.4	Confident	39 Å²	39	59.4 Å²	59.4	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-44.6	177.5	-70.5	172.1	0	0	0	111.6	L136 Q178 A179 W180 S186 Q194	L136-L182 HydrophobicContact CD1-CD1 3.89Å; Q178-L182 WeakPolarHBondContact O-CG 3.42Å; Q178-L182 PolarHBondContact O-N 2.99Å; A179-L182 PolarHBondContact O-N 3.26Å; W180-L182 VanDerWaalsContact C-N 3.35Å; L182-S186 VanDerWaalsContact O-CB 3.28Å; L182-S186 WeakPolarHBondContact O-CB 3.17Å; L182-S186 PolarHBondContact O-N 3.45Å; L182-Q194 HydrophobicContact CD2-CG 4.44Å
183	I	89.8	Confident	87.2	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-48.6	177.4	-69.8	-173.1	0	0	0	111.1	A179 W180 S185 S186 Y187 L195 L199 F202 V211 L215	A179-I183 WeakPolarHBondContact O-CG1 2.96Å; A179-I183 PolarHBondContact O-N 2.98Å; W180-I183 PolarHBondContact O-N 3.06Å; I183-S185 PolarHBondContact O-N 2.9Å; I183-S186 PolarHBondContact O-N 3.37Å; I183-S186 PolarHBondContact O-OG 3.23Å; I183-Y187 HydrophobicContact CG2-CD2 4.1Å; I183-Y187 HydrophobicContact CG2-CE2 3.37Å; I183-Y187 WeakPolarHBondContact O-CD2 3.33Å; I183-Y187 PolarHBondContact O-N 2.94Å; I183-L195 HydrophobicContact CG1-CD1 4.15Å; I183-L195 HydrophobicContact CG2-CD1 4.28Å; I183-L199 HydrophobicContact CD1-CD2 4.21Å; I183-F202 HydrophobicContact CD1-CD2 3.7Å; I183-F202 HydrophobicContact CD1-CE2 3.46Å; I183-F202 VanDerWaalsContact CD1-CE2 3.46Å; I183-F202 HydrophobicContact CG1-CE2 4.31Å; I183-V211 HydrophobicContact CD1-CG1 3.99Å; I183-L215 HydrophobicContact CG2-CD1 4.18Å; I183-L215 HydrophobicContact CG2-CD2 4.2Å
184	N	89.3	Confident	87.2	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-65	-43.6	-178.4	-71.3	-46.6	0	0	0	111.9	W180 S181 S186 Y187 E188	W180-N184 PolarHBondContact O-N 3.25Å; W180-N184 PolarHBondContact O-ND2 2.87Å; S181-N184 PolarHBondContact O-N 2.9Å; N184-S186 VanDerWaalsContact C-N 3.26Å; N184-S186 PolarHBondContact O-N 2.58Å; N184-Y187 PolarHBondContact O-N 3.4Å; N184-E188 PolarHBondContact O-N 3.25Å
185	S	88.3	Confident	87.2	Confident	39 Å²	39	53 Å²	53	27%	0.273	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-32.5	175.2	-63.3	0	0	0	0	112.6	S181 I183 Y187 E188 L189	S181-S185 WeakPolarHBondContact O-CB 3.36Å; S181-S185 PolarHBondContact O-N 3.43Å; S181-S185 PolarHBondContact O-OG 2.98Å; S181-S185 VanDerWaalsContact O-OG 3.11Å; I183-S185 PolarHBondContact O-N 2.9Å; S185-Y187 VanDerWaalsContact C-N 3.34Å; S185-Y187 PolarHBondContact O-N 2.84Å; S185-E188 PolarHBondContact O-N 3.25Å; S185-L189 WeakPolarHBondContact O-CB 3.46Å; S185-L189 PolarHBondContact O-N 3.07Å
186	S	85.8	Confident	87.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-34.8	178.1	75.3	0	0	0	0	113.2	L182 I183 N184 S190 D191 L195	L182-S186 VanDerWaalsContact O-CB 3.28Å; L182-S186 WeakPolarHBondContact O-CB 3.17Å; L182-S186 PolarHBondContact O-N 3.45Å; I183-S186 PolarHBondContact O-N 3.37Å; I183-S186 PolarHBondContact O-OG 3.23Å; N184-S186 VanDerWaalsContact C-N 3.26Å; N184-S186 PolarHBondContact O-N 2.58Å; S186-S190 CarbonylContact O-C 3.32Å; S186-S190 WeakPolarHBondContact O-CA 3.48Å; S186-S190 PolarHBondContact O-N 3.39Å; S186-D191 WeakPolarHBondContact CB-O 3.34Å; S186-D191 PolarHBondContact O-N 3.44Å; S186-L195 WeakPolarHBondContact OG-CB 3.46Å
187	Y	85	Confident	87	Confident	33 Å²	33	54.4 Å²	54.4	13%	0.129	30%	0.302	C	S	.	.	H	α-helix	trans	-74.7	-32	175.9	-63.7	-55.6	0	0	0	112.5	I183 N184 S185 L195 L215 W219 C289 L292	I183-Y187 HydrophobicContact CG2-CD2 4.1Å; I183-Y187 HydrophobicContact CG2-CE2 3.37Å; I183-Y187 WeakPolarHBondContact O-CD2 3.33Å; I183-Y187 PolarHBondContact O-N 2.94Å; N184-Y187 PolarHBondContact O-N 3.4Å; S185-Y187 VanDerWaalsContact C-N 3.34Å; S185-Y187 PolarHBondContact O-N 2.84Å; Y187-L195 HydrophobicContact CE1-CD2 4.26Å; Y187-L215 HydrophobicContact CE2-CD2 3.98Å; Y187-W219 HydrophobicContact CE1-CH2 4.2Å; Y187-W219 AromaticContact CE1-CZ2 3.9Å; Y187-W219 HydrophobicContact CE1-CZ2 3.9Å; Y187-W219 AromaticContact CE2-CZ2 3.88Å; Y187-W219 HydrophobicContact CE2-CZ2 3.88Å; Y187-W219 AromaticContact CZ-CH2 3.93Å; Y187-W219 AromaticContact CZ-CZ2 3.52Å; Y187-C289 HydrophobicContact CD1-CB 3.85Å; Y187-C289 HydrophobicContact CE1-CB 3.99Å; Y187-L292 HydrophobicContact CD1-CD2 4.37Å
188	E	81.4	Confident	86.8	Confident	162 Å²	162	50.6 Å²	50.6	76%	0.757	28%	0.275	S	S	*	.	H	α-helix	trans	-70.6	-39.1	175.4	-69	-179.3	173.9	0	0	112.1	N184 S185	N184-E188 PolarHBondContact O-N 3.25Å; S185-E188 PolarHBondContact O-N 3.25Å
189	L	81	Confident	86.8	Confident	120 Å²	120	46.6 Å²	46.6	63%	0.628	26%	0.256	S	S	*	.	H	α-helix	trans	-94.9	-6.9	-177.7	-62.9	173.4	0	0	0	113.8	S185 D191	S185-L189 WeakPolarHBondContact O-CB 3.46Å; S185-L189 PolarHBondContact O-N 3.07Å; L189-D191 HydrophobicContact CB-CB 4.22Å; L189-D191 PolarHBondContact O-N 3.46Å
190	S	80.5	Confident	86.5	Confident	91 Å²	91	47.6 Å²	47.6	64%	0.636	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	35.1	-168.3	-56.8	0	0	0	0	113.2	S186 Q192	S186-S190 CarbonylContact O-C 3.32Å; S186-S190 WeakPolarHBondContact O-CA 3.48Å; S186-S190 PolarHBondContact O-N 3.39Å; S190-Q192 PolarHBondContact O-N 3.26Å
191	D	82.2	Confident	86.3	Confident	44 Å²	44	45.5 Å²	45.5	24%	0.235	25%	0.253	C	S	.	.			trans	-91.4	104	-176.3	-175.5	-4.8	0	0	0	111.4	S186 L189 T193 Q194 L195	S186-D191 WeakPolarHBondContact CB-O 3.34Å; S186-D191 PolarHBondContact O-N 3.44Å; L189-D191 HydrophobicContact CB-CB 4.22Å; L189-D191 PolarHBondContact O-N 3.46Å; D191-T193 PolarHBondContact O-N 3.47Å; D191-T193 WeakPolarHBondContact OD1-CB 3.37Å; D191-T193 PolarHBondContact OD1-N 2.86Å; D191-T193 PolarHBondContact OD1-OG1 2.96Å; D191-T193 PolarHBondContact OD2-OG1 3.48Å; D191-Q194 HydrophobicContact CB-CB 4.44Å; D191-Q194 VanDerWaalsContact OD2-CD 3.29Å; D191-Q194 VanDerWaalsContact OD2-CG 3.3Å; D191-Q194 WeakPolarHBondContact OD2-CG 3.44Å; D191-Q194 PolarHBondContact OD2-NE2 2.94Å; D191-L195 PolarHBondContact O-N 2.95Å
192	Q	85.2	Confident	86.2	Confident	61 Å²	61	42.1 Å²	42.1	29%	0.285	23%	0.23	S	C	.	.	H	α-helix	trans	-60.6	-30.2	178.8	-179.5	161.2	44.6	0	0	113.1	S190 A196 L292 T296	S190-Q192 PolarHBondContact O-N 3.26Å; Q192-A196 WeakPolarHBondContact O-CB 2.96Å; Q192-A196 PolarHBondContact O-N 2.76Å; Q192-L292 HydrophobicContact CB-CD1 4.28Å; Q192-T296 HydrophobicContact CG-CG2 4.16Å; Q192-T296 PolarHBondContact NE2-OG1 2.94Å
193	T	85.7	Confident	86	Confident	93 Å²	93	43.2 Å²	43.2	57%	0.571	23%	0.231	S	C	*	.	H	α-helix	trans	-75.7	-37.2	-174.8	66.2	0	0	0	0	112.7	D191 A196 T197	D191-T193 PolarHBondContact O-N 3.47Å; D191-T193 WeakPolarHBondContact OD1-CB 3.37Å; D191-T193 PolarHBondContact OD1-N 2.86Å; D191-T193 PolarHBondContact OD1-OG1 2.96Å; D191-T193 PolarHBondContact OD2-OG1 3.48Å; T193-A196 WeakPolarHBondContact O-CB 3.49Å; T193-T197 WeakPolarHBondContact O-CG2 3.45Å; T193-T197 PolarHBondContact O-N 2.93Å; T193-T197 PolarHBondContact O-OG1 3.23Å; T193-T197 VanDerWaalsContact O-OG1 3.09Å
194	Q	87.1	Confident	85.8	Confident	53 Å²	53	43.9 Å²	43.9	25%	0.248	23%	0.234	C	C	.	.	H	α-helix	trans	-69.7	-38.6	173.3	-72.4	177.5	37.2	0	0	111.2	L182 D191 T197 G198	L182-Q194 HydrophobicContact CD2-CG 4.44Å; D191-Q194 HydrophobicContact CB-CB 4.44Å; D191-Q194 VanDerWaalsContact OD2-CD 3.29Å; D191-Q194 VanDerWaalsContact OD2-CG 3.3Å; D191-Q194 WeakPolarHBondContact OD2-CG 3.44Å; D191-Q194 PolarHBondContact OD2-NE2 2.94Å; Q194-T197 WeakPolarHBondContact CA-OG1 3.32Å; Q194-T197 PolarHBondContact O-N 3.14Å; Q194-T197 PolarHBondContact O-OG1 3.04Å; Q194-G198 PolarHBondContact O-N 3.45Å
195	L	88.2	Confident	85.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-47.8	174.5	-174.9	55.2	0	0	0	110.9	I183 S186 Y187 D191 T197 G198 L199 L292 L293 T296	I183-L195 HydrophobicContact CG1-CD1 4.15Å; I183-L195 HydrophobicContact CG2-CD1 4.28Å; S186-L195 WeakPolarHBondContact OG-CB 3.46Å; Y187-L195 HydrophobicContact CE1-CD2 4.26Å; D191-L195 PolarHBondContact O-N 2.95Å; L195-T197 PolarHBondContact O-N 2.92Å; L195-G198 PolarHBondContact O-N 3.03Å; L195-L199 HydrophobicContact CD1-CD1 3.98Å; L195-L199 HydrophobicContact CD1-CG 4.05Å; L195-L199 HydrophobicContact CG-CD1 3.8Å; L195-L199 HydrophobicContact CG-CG 4.32Å; L195-L199 WeakPolarHBondContact O-CB 3.35Å; L195-L199 WeakPolarHBondContact O-CG 3.46Å; L195-L199 PolarHBondContact O-N 3.38Å; L195-L292 HydrophobicContact CD2-CD2 4.14Å; L195-L292 HydrophobicContact CD2-CG 3.75Å; L195-L293 HydrophobicContact CD1-CD1 4.42Å; L195-T296 HydrophobicContact CB-CG2 4.27Å; L195-T296 HydrophobicContact CD2-CG2 4.35Å; L195-T296 HydrophobicContact CG-CG2 4.08Å
196	A	86.3	Confident	85.5	Confident	8 Å²	8	44.6 Å²	44.6	7%	0.066	24%	0.235	C	C	.	.	H	α-helix	trans	-49.8	-54.9	174.4	0	0	0	0	0	112.9	Q192 T193 L199 Q200 T296 Q300	Q192-A196 WeakPolarHBondContact O-CB 2.96Å; Q192-A196 PolarHBondContact O-N 2.76Å; T193-A196 WeakPolarHBondContact O-CB 3.49Å; A196-L199 PolarHBondContact O-N 2.87Å; A196-Q200 WeakPolarHBondContact O-CB 3.4Å; A196-Q200 PolarHBondContact O-N 3.42Å; A196-T296 HydrophobicContact CB-CG2 3.84Å; A196-Q300 VanDerWaalsContact CB-CD 3.49Å; A196-Q300 PolarHBondContact O-NE2 2.98Å
197	T	87.2	Confident	85.6	Confident	56 Å²	56	46.9 Å²	46.9	34%	0.344	25%	0.246	S	C	.	.	H	α-helix	trans	-64	-42.4	179.5	50.4	0	0	0	0	112.2	T193 Q194 L195 Q200 V201	T193-T197 WeakPolarHBondContact O-CG2 3.45Å; T193-T197 PolarHBondContact O-N 2.93Å; T193-T197 PolarHBondContact O-OG1 3.23Å; T193-T197 VanDerWaalsContact O-OG1 3.09Å; Q194-T197 WeakPolarHBondContact CA-OG1 3.32Å; Q194-T197 PolarHBondContact O-N 3.14Å; Q194-T197 PolarHBondContact O-OG1 3.04Å; L195-T197 PolarHBondContact O-N 2.92Å; T197-Q200 PolarHBondContact O-N 3.41Å; T197-V201 VanDerWaalsContact O-CG2 3.3Å; T197-V201 WeakPolarHBondContact O-CG2 3.4Å; T197-V201 PolarHBondContact O-N 3.06Å
198	G	87.9	Confident	85.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-46.3	175.3	0	0	0	0	0	112.8	Q194 L195 V201 F202	Q194-G198 PolarHBondContact O-N 3.45Å; L195-G198 PolarHBondContact O-N 3.03Å; G198-V201 PolarHBondContact O-N 3.37Å; G198-F202 WeakPolarHBondContact O-CD2 3.35Å; G198-F202 PolarHBondContact O-N 3.45Å; G198-F202 VanDerWaalsContact O-N 3.16Å
199	L	88.4	Confident	86	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-40.7	178.4	-68.5	169.9	0	0	0	112.2	I183 L195 A196 F202 Y203 L208 L293 T296 L297 L326	I183-L199 HydrophobicContact CD1-CD2 4.21Å; L195-L199 HydrophobicContact CD1-CD1 3.98Å; L195-L199 HydrophobicContact CD1-CG 4.05Å; L195-L199 HydrophobicContact CG-CD1 3.8Å; L195-L199 HydrophobicContact CG-CG 4.32Å; L195-L199 WeakPolarHBondContact O-CB 3.35Å; L195-L199 WeakPolarHBondContact O-CG 3.46Å; L195-L199 PolarHBondContact O-N 3.38Å; A196-L199 PolarHBondContact O-N 2.87Å; L199-F202 PolarHBondContact O-N 3.26Å; L199-Y203 PolarHBondContact O-N 2.91Å; L199-L208 HydrophobicContact CB-CD1 4.42Å; L199-L208 HydrophobicContact CD2-CD1 3.9Å; L199-L293 HydrophobicContact CD1-CD1 3.71Å; L199-L293 HydrophobicContact CD2-CD1 3.68Å; L199-L293 HydrophobicContact CG-CD1 4.29Å; L199-T296 HydrophobicContact CD1-CG2 3.96Å; L199-L297 HydrophobicContact CD1-CD2 4.01Å; L199-L297 HydrophobicContact CD1-CG 4.31Å; L199-L297 HydrophobicContact CD2-CD2 4.44Å; L199-L326 HydrophobicContact CB-CD2 4.06Å
200	Q	85.5	Confident	86.3	Confident	23 Å²	23	36.1 Å²	36.1	11%	0.107	20%	0.197	C	C	.	.	H	α-helix	trans	-67.7	-36.2	178.6	-169.2	168.7	14.1	0	0	112.2	A196 T197 F202 Y203 H204 Q300 E302	A196-Q200 WeakPolarHBondContact O-CB 3.4Å; A196-Q200 PolarHBondContact O-N 3.42Å; T197-Q200 PolarHBondContact O-N 3.41Å; Q200-F202 VanDerWaalsContact C-N 3.33Å; Q200-F202 PolarHBondContact O-N 3.32Å; Q200-Y203 PolarHBondContact O-N 3.48Å; Q200-H204 PolarHBondContact O-N 2.86Å; Q200-H204 PolarHBondContact O-ND1 3.07Å; Q200-Q300 HydrophobicContact CB-CG 4.46Å; Q200-E302 PolarHBondContact NE2-OE1 2.97Å
201	V	86.9	Confident	86.8	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-59.5	-45.4	170.4	171.3	0	0	0	0	110.6	L136 A140 M175 A179 T197 G198 Y203 H204 L205	L136-V201 HydrophobicContact CB-CG2 3.79Å; A140-V201 HydrophobicContact CB-CG1 4.16Å; M175-V201 HydrophobicContact CE-CG1 3.97Å; A179-V201 HydrophobicContact CB-CB 4.22Å; A179-V201 HydrophobicContact CB-CG1 3.88Å; T197-V201 VanDerWaalsContact O-CG2 3.3Å; T197-V201 WeakPolarHBondContact O-CG2 3.4Å; T197-V201 PolarHBondContact O-N 3.06Å; G198-V201 PolarHBondContact O-N 3.37Å; V201-Y203 VanDerWaalsContact C-N 3.35Å; V201-Y203 PolarHBondContact O-N 3.28Å; V201-H204 PolarHBondContact O-N 2.91Å; V201-L205 HydrophobicContact CG1-CD1 3.98Å; V201-L205 VanDerWaalsContact O-CG 3.31Å; V201-L205 WeakPolarHBondContact O-CG 3.31Å; V201-L205 PolarHBondContact O-N 2.9Å
202	F	89.3	Confident	87.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.6	-32.4	178.1	-75.9	-59	0	0	0	114	V176 A179 W180 I183 G198 L199 Q200 L205 N206 M207 L208 V211	V176-F202 HydrophobicContact CG1-CE1 4.2Å; V176-F202 HydrophobicContact CG2-CE1 4.42Å; A179-F202 HydrophobicContact CB-CD2 3.97Å; A179-F202 HydrophobicContact CB-CE1 4.05Å; A179-F202 HydrophobicContact CB-CE2 3.41Å; A179-F202 VanDerWaalsContact CB-CE2 3.41Å; A179-F202 HydrophobicContact CB-CG 4.49Å; A179-F202 HydrophobicContact CB-CZ 3.47Å; A179-F202 VanDerWaalsContact CB-CZ 3.47Å; W180-F202 AromaticContact CD1-CZ 3.7Å; W180-F202 HydrophobicContact CD2-CZ 4.2Å; W180-F202 AromaticContact CG-CZ 3.95Å; W180-F202 HydrophobicContact CG-CZ 3.95Å; W180-F202 AromaticContact NE1-CZ 3.78Å; I183-F202 HydrophobicContact CD1-CD2 3.7Å; I183-F202 HydrophobicContact CD1-CE2 3.46Å; I183-F202 VanDerWaalsContact CD1-CE2 3.46Å; I183-F202 HydrophobicContact CG1-CE2 4.31Å; G198-F202 WeakPolarHBondContact O-CD2 3.35Å; G198-F202 PolarHBondContact O-N 3.45Å; G198-F202 VanDerWaalsContact O-N 3.16Å; L199-F202 PolarHBondContact O-N 3.26Å; Q200-F202 VanDerWaalsContact C-N 3.33Å; Q200-F202 PolarHBondContact O-N 3.32Å; F202-L205 PolarHBondContact O-N 3.02Å; F202-N206 PolarHBondContact O-N 3.27Å; F202-M207 HydrophobicContact CD1-CB 4.22Å; F202-M207 PolarHBondContact O-N 2.84Å; F202-L208 HydrophobicContact CB-CD1 4.47Å; F202-L208 PolarHBondContact O-N 3.34Å; F202-V211 HydrophobicContact CB-CG2 4.36Å; F202-V211 HydrophobicContact CD1-CG2 3.59Å; F202-V211 HydrophobicContact CD2-CB 4.47Å; F202-V211 HydrophobicContact CD2-CG1 3.99Å; F202-V211 HydrophobicContact CD2-CG2 4.06Å; F202-V211 HydrophobicContact CE1-CG2 3.74Å; F202-V211 HydrophobicContact CE2-CG1 4.07Å; F202-V211 HydrophobicContact CE2-CG2 4.2Å; F202-V211 HydrophobicContact CG-CB 4.43Å; F202-V211 HydrophobicContact CG-CG1 4.44Å; F202-V211 HydrophobicContact CG-CG2 3.76Å; F202-V211 HydrophobicContact CZ-CG2 4.03Å
203	Y	85.8	Confident	87.5	Confident	62 Å²	62	28.9 Å²	28.9	24%	0.243	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-52.3	171.3	176.6	-106.7	0	0	0	111.4	L199 Q200 V201 L205 N206 L208 E302 L326 L329	L199-Y203 PolarHBondContact O-N 2.91Å; Q200-Y203 PolarHBondContact O-N 3.48Å; V201-Y203 VanDerWaalsContact C-N 3.35Å; V201-Y203 PolarHBondContact O-N 3.28Å; Y203-L205 PolarHBondContact O-N 3.24Å; Y203-N206 WeakPolarHBondContact O-CA 3.47Å; Y203-N206 PolarHBondContact O-N 3.13Å; Y203-L208 HydrophobicContact CD2-CD2 4.19Å; Y203-E302 WeakPolarHBondContact CD1-OE2 3.28Å; Y203-E302 HydrophobicContact CE1-CG 4.2Å; Y203-E302 WeakPolarHBondContact CE1-OE2 3.21Å; Y203-L326 HydrophobicContact CD1-CD1 4.17Å; Y203-L326 HydrophobicContact CD2-CD1 3.35Å; Y203-L326 HydrophobicContact CE2-CD1 4Å; Y203-L326 HydrophobicContact CG-CD1 3.43Å; Y203-L326 VanDerWaalsContact CG-CD1 3.43Å; Y203-L329 HydrophobicContact CE1-CD1 4.21Å; Y203-L329 HydrophobicContact CE2-CB 4.17Å; Y203-L329 HydrophobicContact CE2-CD1 4.05Å
204	H	84.4	Confident	87.8	Confident	13 Å²	13	29.7 Å²	29.7	6%	0.06	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-30.2	178.8	-68	146.5	0	0	0	112.9	C137 A140 M141 N144 Q200 V201 N206 E302	C137-H204 PolarHBondContact O-ND1 3.28Å; A140-H204 HydrophobicContact CB-CB 3.49Å; A140-H204 VanDerWaalsContact CB-CB 3.49Å; M141-H204 HydrophobicContact CG-CB 4.39Å; M141-H204 VanDerWaalsContact CG-CE1 3.47Å; M141-H204 WeakPolarHBondContact CG-CE1 3.47Å; M141-H204 WeakPolarHBondContact CG-NE2 3.46Å; N144-H204 WeakPolarHBondContact CB-O 3.47Å; N144-H204 PolarHBondContact ND2-O 3.41Å; Q200-H204 PolarHBondContact O-N 2.86Å; Q200-H204 PolarHBondContact O-ND1 3.07Å; V201-H204 PolarHBondContact O-N 2.91Å; H204-N206 PolarHBondContact O-N 3.18Å; H204-E302 IonicContact CD2-OE1 2.99Å; H204-E302 IonicContact CE1-OE1 3.65Å; H204-E302 IonicContact NE2-OE1 3.03Å; H204-E302 PolarHBondContact NE2-OE1 3.21Å
205	L	86.5	Confident	88	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.026	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	3.3	174.8	-65.1	176.1	0	0	0	114.1	A140 V143 R172 M175 V176 V201 F202 Y203 M207	A140-L205 HydrophobicContact CB-CD2 4.35Å; A140-L205 HydrophobicContact CB-CG 4.28Å; V143-L205 HydrophobicContact CB-CD2 4.19Å; V143-L205 HydrophobicContact CG1-CD2 3.8Å; R172-L205 HydrophobicContact CG-CD2 4.36Å; M175-L205 HydrophobicContact CB-CD1 4.41Å; V176-L205 HydrophobicContact CG2-CD1 3.97Å; V201-L205 HydrophobicContact CG1-CD1 3.98Å; V201-L205 VanDerWaalsContact O-CG 3.31Å; V201-L205 WeakPolarHBondContact O-CG 3.31Å; V201-L205 PolarHBondContact O-N 2.9Å; F202-L205 PolarHBondContact O-N 3.02Å; Y203-L205 PolarHBondContact O-N 3.24Å; L205-M207 VanDerWaalsContact C-N 3.29Å; L205-M207 HydrophobicContact CB-CG 4.42Å; L205-M207 PolarHBondContact O-N 3.27Å
206	N	85.3	Confident	88.2	Confident	111 Å²	111	27.2 Å²	27.2	59%	0.594	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	36.3	-173.7	-53.7	-43.4	0	0	0	113.7	N144 F202 Y203 H204	N144-N206 PolarHBondContact OD1-ND2 3.34Å; F202-N206 PolarHBondContact O-N 3.27Å; Y203-N206 WeakPolarHBondContact O-CA 3.47Å; Y203-N206 PolarHBondContact O-N 3.13Å; H204-N206 PolarHBondContact O-N 3.18Å
207	M	87.9	Confident	88.5	Confident	47 Å²	47	30 Å²	30	23%	0.232	15%	0.153	C	C	.	.			trans	-119.7	4.5	-177.4	-67.9	-176.1	65.4	0	0	113.7	V176 F202 L205 M209 D210 V211	V176-M207 HydrophobicContact CG2-SD 4.05Å; F202-M207 HydrophobicContact CD1-CB 4.22Å; F202-M207 PolarHBondContact O-N 2.84Å; L205-M207 VanDerWaalsContact C-N 3.29Å; L205-M207 HydrophobicContact CB-CG 4.42Å; L205-M207 PolarHBondContact O-N 3.27Å; M207-M209 PolarHBondContact O-N 2.91Å; M207-D210 PolarHBondContact O-N 3.32Å; M207-V211 WeakPolarHBondContact O-CG2 3Å; M207-V211 PolarHBondContact O-N 3.04Å
208	L	87.4	Confident	88.7	Confident	6 Å²	6	31.7 Å²	31.7	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-46.4	-171.2	-178.3	65.5	0	0	0	113.8	L199 F202 Y203 D210 V211 I212 L297 L326 L330	L199-L208 HydrophobicContact CB-CD1 4.42Å; L199-L208 HydrophobicContact CD2-CD1 3.9Å; F202-L208 HydrophobicContact CB-CD1 4.47Å; F202-L208 PolarHBondContact O-N 3.34Å; Y203-L208 HydrophobicContact CD2-CD2 4.19Å; L208-D210 VanDerWaalsContact C-N 3.29Å; L208-D210 PolarHBondContact O-N 3.36Å; L208-V211 PolarHBondContact O-N 3.48Å; L208-I212 HydrophobicContact CD1-CD1 4.14Å; L208-I212 HydrophobicContact CD1-CG1 4.33Å; L208-I212 HydrophobicContact CG-CD1 3.97Å; L208-I212 WeakPolarHBondContact O-CG1 3.34Å; L208-I212 PolarHBondContact O-N 2.9Å; L208-L297 HydrophobicContact CD1-CD2 4.34Å; L208-L297 HydrophobicContact CD2-CD2 4.39Å; L208-L326 HydrophobicContact CD1-CD2 4.26Å; L208-L326 HydrophobicContact CD2-CD1 3.5Å; L208-L326 VanDerWaalsContact CD2-CD1 3.5Å; L208-L326 HydrophobicContact CD2-CD2 3.61Å; L208-L326 HydrophobicContact CD2-CG 3.48Å; L208-L326 VanDerWaalsContact CD2-CG 3.48Å; L208-L330 HydrophobicContact CD2-CD1 3.84Å; L208-L330 HydrophobicContact CD2-CD2 3.82Å; L208-L330 HydrophobicContact CD2-CG 3.87Å; L208-L330 HydrophobicContact CG-CD1 4.4Å; L208-L330 HydrophobicContact CG-CD2 4.2Å
209	M	86.6	Confident	88.9	Confident	19 Å²	19	32.3 Å²	32.3	9%	0.094	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-38.8	179	-69.3	-165.3	-67.6	0	0	112.2	M207 H213 L330 E333 K346 Y347 I350	M207-M209 PolarHBondContact O-N 2.91Å; M209-H213 WeakPolarHBondContact O-CB 3.28Å; M209-H213 PolarHBondContact O-N 3.33Å; M209-H213 VanDerWaalsContact O-N 3.08Å; M209-L330 HydrophobicContact CG-CD2 3.63Å; M209-E333 HydrophobicContact CE-CG 4.11Å; M209-E333 WeakPolarHBondContact CE-OE1 3.38Å; M209-E333 WeakPolarHBondContact CE-OE2 3.38Å; M209-E333 HydrophobicContact SD-CG 4.16Å; M209-K346 HydrophobicContact CB-CD 4.38Å; M209-Y347 HydrophobicContact SD-CE1 3.99Å; M209-I350 HydrophobicContact CB-CD1 4.44Å; M209-I350 HydrophobicContact CG-CD1 3.92Å; M209-I350 HydrophobicContact SD-CD1 4.27Å
210	D	88.6	Confident	89.1	Confident	65 Å²	65	34.6 Å²	34.6	35%	0.348	17%	0.168	S	C	.	.	H	α-helix	trans	-64.8	-44.5	177.3	-67.6	-61.9	0	0	0	111	M207 L208 H213 E214 K346	M207-D210 PolarHBondContact O-N 3.32Å; L208-D210 VanDerWaalsContact C-N 3.29Å; L208-D210 PolarHBondContact O-N 3.36Å; D210-H213 PolarHBondContact O-N 2.9Å; D210-E214 WeakPolarHBondContact O-CB 3.47Å; D210-E214 PolarHBondContact O-N 3.03Å; D210-K346 WeakPolarHBondContact OD1-CE 3.49Å; D210-K346 IonicContact OD1-NZ 3.49Å; D210-K346 PolarHBondContact OD1-NZ 3.46Å; D210-K346 IonicContact OD2-NZ 2.64Å
211	V	90	Very high	89.5	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-65.9	-42.5	179.8	172.5	0	0	0	0	112	W180 I183 F202 M207 L208 H213 E214 L215	W180-V211 HydrophobicContact CH2-CG1 3.94Å; W180-V211 HydrophobicContact CZ2-CB 4.49Å; W180-V211 HydrophobicContact CZ2-CG1 4Å; W180-V211 HydrophobicContact CZ2-CG2 4.2Å; I183-V211 HydrophobicContact CD1-CG1 3.99Å; F202-V211 HydrophobicContact CB-CG2 4.36Å; F202-V211 HydrophobicContact CD1-CG2 3.59Å; F202-V211 HydrophobicContact CD2-CB 4.47Å; F202-V211 HydrophobicContact CD2-CG1 3.99Å; F202-V211 HydrophobicContact CD2-CG2 4.06Å; F202-V211 HydrophobicContact CE1-CG2 3.74Å; F202-V211 HydrophobicContact CE2-CG1 4.07Å; F202-V211 HydrophobicContact CE2-CG2 4.2Å; F202-V211 HydrophobicContact CG-CB 4.43Å; F202-V211 HydrophobicContact CG-CG1 4.44Å; F202-V211 HydrophobicContact CG-CG2 3.76Å; F202-V211 HydrophobicContact CZ-CG2 4.03Å; M207-V211 WeakPolarHBondContact O-CG2 3Å; M207-V211 PolarHBondContact O-N 3.04Å; L208-V211 PolarHBondContact O-N 3.48Å; V211-H213 VanDerWaalsContact C-N 3.31Å; V211-H213 PolarHBondContact O-N 3.49Å; V211-E214 PolarHBondContact O-N 3.11Å; V211-L215 HydrophobicContact CG1-CD1 4.14Å; V211-L215 WeakPolarHBondContact O-CB 3.27Å; V211-L215 WeakPolarHBondContact O-CG 2.97Å; V211-L215 PolarHBondContact O-N 3.34Å
212	I	90	Very high	89.7	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-44.7	175.1	-67.9	169.4	0	0	0	109.9	L208 L215 V216 L297 L330 I350 I353	L208-I212 HydrophobicContact CD1-CD1 4.14Å; L208-I212 HydrophobicContact CD1-CG1 4.33Å; L208-I212 HydrophobicContact CG-CD1 3.97Å; L208-I212 WeakPolarHBondContact O-CG1 3.34Å; L208-I212 PolarHBondContact O-N 2.9Å; I212-L215 PolarHBondContact O-N 3.39Å; I212-V216 HydrophobicContact CG2-CG2 4.46Å; I212-V216 WeakPolarHBondContact O-CB 3.17Å; I212-V216 WeakPolarHBondContact O-CG2 3.36Å; I212-V216 PolarHBondContact O-N 3.32Å; I212-L297 HydrophobicContact CD1-CD1 3.79Å; I212-L297 HydrophobicContact CD1-CD2 4.32Å; I212-L330 HydrophobicContact CD1-CD1 3.57Å; I212-I350 HydrophobicContact CD1-CG1 4.41Å; I212-I350 HydrophobicContact CG2-CG1 4.08Å; I212-I353 HydrophobicContact CG2-CG1 4.14Å
213	H	91.7	Very high	89.9	Confident	40 Å²	40	39.6 Å²	39.6	19%	0.185	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-41.1	178.1	178	77.3	0	0	0	112.2	M209 D210 V211 V216 T217 E345 K346 S349	M209-H213 WeakPolarHBondContact O-CB 3.28Å; M209-H213 PolarHBondContact O-N 3.33Å; M209-H213 VanDerWaalsContact O-N 3.08Å; D210-H213 PolarHBondContact O-N 2.9Å; V211-H213 VanDerWaalsContact C-N 3.31Å; V211-H213 PolarHBondContact O-N 3.49Å; H213-V216 PolarHBondContact O-N 3.2Å; H213-T217 VanDerWaalsContact O-CB 3.3Å; H213-T217 WeakPolarHBondContact O-CB 3.46Å; H213-T217 PolarHBondContact O-N 3.16Å; H213-T217 PolarHBondContact O-OG1 3.48Å; H213-E345 IonicContact CE1-OE2 3.95Å; H213-E345 PolarHBondContact ND1-O 3.36Å; H213-K346 HydrophobicContact CB-CB 4.43Å; H213-K346 HydrophobicContact CB-CG 4.06Å; H213-S349 PolarHBondContact ND1-OG 3.43Å
214	E	92.9	Very high	90.3	Very high	110 Å²	110	39.1 Å²	39.1	51%	0.514	20%	0.203	S	C	.	.	H	α-helix	trans	-63.4	-44.7	176.6	-170.6	174.9	171.7	0	0	111.9	W180 D210 V211 T217 K218	W180-E214 HydrophobicContact CH2-CB 4.37Å; W180-E214 HydrophobicContact CH2-CG 4.25Å; W180-E214 HydrophobicContact CZ2-CB 4.46Å; W180-E214 HydrophobicContact CZ2-CG 4.3Å; W180-E214 WeakPolarHBondContact CZ2-OE2 3.47Å; D210-E214 WeakPolarHBondContact O-CB 3.47Å; D210-E214 PolarHBondContact O-N 3.03Å; V211-E214 PolarHBondContact O-N 3.11Å; E214-T217 PolarHBondContact O-N 3.01Å; E214-K218 WeakPolarHBondContact O-CB 3.49Å; E214-K218 PolarHBondContact O-N 2.97Å
215	L	90.9	Very high	90.6	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-49.6	175.4	-79.7	169.1	0	0	0	112.2	W180 I183 Y187 V211 I212 T217 K218 W219 L293	W180-L215 HydrophobicContact CH2-CD2 4.19Å; W180-L215 HydrophobicContact CH2-CG 3.98Å; W180-L215 HydrophobicContact CZ3-CD2 3.74Å; W180-L215 HydrophobicContact CZ3-CG 3.98Å; I183-L215 HydrophobicContact CG2-CD1 4.18Å; I183-L215 HydrophobicContact CG2-CD2 4.2Å; Y187-L215 HydrophobicContact CE2-CD2 3.98Å; V211-L215 HydrophobicContact CG1-CD1 4.14Å; V211-L215 WeakPolarHBondContact O-CB 3.27Å; V211-L215 WeakPolarHBondContact O-CG 2.97Å; V211-L215 PolarHBondContact O-N 3.34Å; I212-L215 PolarHBondContact O-N 3.39Å; L215-T217 VanDerWaalsContact C-N 3.3Å; L215-T217 PolarHBondContact O-N 3.03Å; L215-K218 WeakPolarHBondContact O-CB 3.39Å; L215-K218 PolarHBondContact O-N 3.25Å; L215-W219 HydrophobicContact CB-CZ2 4.49Å; L215-W219 HydrophobicContact CD2-CZ2 4.32Å; L215-W219 VanDerWaalsContact O-CG 3.26Å; L215-W219 PolarHBondContact O-N 3.23Å; L215-L293 HydrophobicContact CD1-CD2 4.22Å
216	V	91.9	Very high	90.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-41	178.7	170.5	0	0	0	0	110.6	I212 H213 W219 K220 I353	I212-V216 HydrophobicContact CG2-CG2 4.46Å; I212-V216 WeakPolarHBondContact O-CB 3.17Å; I212-V216 WeakPolarHBondContact O-CG2 3.36Å; I212-V216 PolarHBondContact O-N 3.32Å; H213-V216 PolarHBondContact O-N 3.2Å; V216-W219 HydrophobicContact CG2-CE3 4.46Å; V216-W219 PolarHBondContact O-N 2.65Å; V216-K220 HydrophobicContact CG1-CD 3.95Å; V216-K220 HydrophobicContact CG1-CG 4.25Å; V216-K220 WeakPolarHBondContact O-CB 3.32Å; V216-K220 VanDerWaalsContact O-CG 3.22Å; V216-K220 WeakPolarHBondContact O-CG 3.47Å; V216-K220 PolarHBondContact O-N 3.24Å; V216-I353 HydrophobicContact CG2-CD1 3.71Å; V216-I353 HydrophobicContact CG2-CG1 3.83Å
217	T	92.9	Very high	91.1	Very high	65 Å²	65	39 Å²	39	40%	0.399	21%	0.21	S	C	.	.	H	α-helix	trans	-65.3	-42	178.3	-58.5	0	0	0	0	111.5	H213 E214 L215 K220 S221	H213-T217 VanDerWaalsContact O-CB 3.3Å; H213-T217 WeakPolarHBondContact O-CB 3.46Å; H213-T217 PolarHBondContact O-N 3.16Å; H213-T217 PolarHBondContact O-OG1 3.48Å; E214-T217 PolarHBondContact O-N 3.01Å; L215-T217 VanDerWaalsContact C-N 3.3Å; L215-T217 PolarHBondContact O-N 3.03Å; T217-K220 PolarHBondContact O-N 3.08Å; T217-S221 WeakPolarHBondContact O-CB 3.31Å; T217-S221 PolarHBondContact O-N 3.4Å; T217-S221 PolarHBondContact O-OG 3.43Å
218	K	92.7	Very high	91.1	Very high	93 Å²	93	38.6 Å²	38.6	40%	0.404	21%	0.212	S	C	.	.	H	α-helix	trans	-58.2	-52.3	172.9	-177.9	-178.8	174.3	-176.7	0	110.9	E214 L215 K220 S221 E222	E214-K218 WeakPolarHBondContact O-CB 3.49Å; E214-K218 PolarHBondContact O-N 2.97Å; L215-K218 WeakPolarHBondContact O-CB 3.39Å; L215-K218 PolarHBondContact O-N 3.25Å; K218-K220 PolarHBondContact O-N 3.47Å; K218-S221 PolarHBondContact O-N 3.26Å; K218-S221 VanDerWaalsContact O-N 3.16Å; K218-S221 PolarHBondContact O-OG 3.16Å; K218-E222 WeakPolarHBondContact CE-OE1 3.36Å; K218-E222 WeakPolarHBondContact O-CG 3.28Å; K218-E222 PolarHBondContact O-N 3.08Å
219	W	92.2	Very high	90.9	Very high	12 Å²	12	40.3 Å²	40.3	5%	0.045	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-41.8	178.8	-64.5	-22.8	0	0	0	113.2	Y187 L215 V216 S221 E222 F223 L286 C289 L293 I353 F402	Y187-W219 HydrophobicContact CE1-CH2 4.2Å; Y187-W219 AromaticContact CE1-CZ2 3.9Å; Y187-W219 HydrophobicContact CE1-CZ2 3.9Å; Y187-W219 AromaticContact CE2-CZ2 3.88Å; Y187-W219 HydrophobicContact CE2-CZ2 3.88Å; Y187-W219 AromaticContact CZ-CH2 3.93Å; Y187-W219 AromaticContact CZ-CZ2 3.52Å; L215-W219 HydrophobicContact CB-CZ2 4.49Å; L215-W219 HydrophobicContact CD2-CZ2 4.32Å; L215-W219 VanDerWaalsContact O-CG 3.26Å; L215-W219 PolarHBondContact O-N 3.23Å; V216-W219 HydrophobicContact CG2-CE3 4.46Å; V216-W219 PolarHBondContact O-N 2.65Å; W219-S221 PolarHBondContact O-N 3.02Å; W219-E222 PolarHBondContact O-N 3.28Å; W219-F223 WeakPolarHBondContact O-CB 3.34Å; W219-F223 PolarHBondContact O-N 3.23Å; W219-L286 HydrophobicContact CB-CD2 3.89Å; W219-L286 HydrophobicContact CG-CD2 3.73Å; W219-C289 HydrophobicContact CH2-CB 4Å; W219-C289 HydrophobicContact CZ2-CB 3.65Å; W219-L293 HydrophobicContact CH2-CB 4.25Å; W219-L293 HydrophobicContact CH2-CD2 3.83Å; W219-L293 HydrophobicContact CZ3-CD2 4.09Å; W219-I353 HydrophobicContact CZ3-CD1 3.83Å; W219-F402 HydrophobicContact CB-CE2 3.91Å; W219-F402 HydrophobicContact CB-CZ 4.13Å
220	K	92.4	Very high	90.7	Very high	48 Å²	48	39.6 Å²	39.6	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-47	174.4	-74.4	177.7	174.4	172.7	0	111.2	V216 T217 K218 F223 V224 F402 W405	V216-K220 HydrophobicContact CG1-CD 3.95Å; V216-K220 HydrophobicContact CG1-CG 4.25Å; V216-K220 WeakPolarHBondContact O-CB 3.32Å; V216-K220 VanDerWaalsContact O-CG 3.22Å; V216-K220 WeakPolarHBondContact O-CG 3.47Å; V216-K220 PolarHBondContact O-N 3.24Å; T217-K220 PolarHBondContact O-N 3.08Å; K218-K220 PolarHBondContact O-N 3.47Å; K220-F223 PolarHBondContact O-N 3.27Å; K220-V224 VanDerWaalsContact O-CG2 3.32Å; K220-V224 WeakPolarHBondContact O-CG2 3.47Å; K220-V224 PolarHBondContact O-N 2.97Å; K220-F402 HydrophobicContact CG-CE2 4.49Å; K220-W405 VanDerWaalsContact CA-CH2 3.44Å; K220-W405 HydrophobicContact CB-CH2 3.56Å; K220-W405 HydrophobicContact CB-CZ2 3.75Å; K220-W405 HydrophobicContact CB-CZ3 4.22Å; K220-W405 HydrophobicContact CD-CZ2 4.03Å; K220-W405 HydrophobicContact CG-CD2 4.23Å; K220-W405 HydrophobicContact CG-CE3 4.2Å; K220-W405 HydrophobicContact CG-CH2 3.55Å; K220-W405 HydrophobicContact CG-CZ2 3.54Å; K220-W405 HydrophobicContact CG-CZ3 3.88Å
221	S	93	Very high	90.2	Very high	71 Å²	71	36.8 Å²	36.8	50%	0.497	21%	0.206	S	C	.	.	H	α-helix	trans	-65.6	-40.6	179.5	74.6	0	0	0	0	112.9	T217 K218 W219 S225	T217-S221 WeakPolarHBondContact O-CB 3.31Å; T217-S221 PolarHBondContact O-N 3.4Å; T217-S221 PolarHBondContact O-OG 3.43Å; K218-S221 PolarHBondContact O-N 3.26Å; K218-S221 VanDerWaalsContact O-N 3.16Å; K218-S221 PolarHBondContact O-OG 3.16Å; W219-S221 PolarHBondContact O-N 3.02Å; S221-S225 VanDerWaalsContact O-CB 3.24Å; S221-S225 WeakPolarHBondContact O-CB 3.39Å; S221-S225 PolarHBondContact O-N 2.85Å
222	E	92.4	Very high	89.8	Confident	59 Å²	59	40.3 Å²	40.3	28%	0.276	23%	0.226	S	C	.	.	H	α-helix	trans	-62.1	-47.7	176.4	-76.4	-175.9	-160.6	0	0	111.1	K218 W219 S225 V226 K282	K218-E222 WeakPolarHBondContact CE-OE1 3.36Å; K218-E222 WeakPolarHBondContact O-CG 3.28Å; K218-E222 PolarHBondContact O-N 3.08Å; W219-E222 PolarHBondContact O-N 3.28Å; E222-S225 PolarHBondContact O-N 2.92Å; E222-V226 WeakPolarHBondContact O-CG2 3.34Å; E222-V226 PolarHBondContact O-N 3.26Å; E222-K282 WeakPolarHBondContact OE2-CE 3.39Å; E222-K282 IonicContact OE2-NZ 3.68Å; E222-K282 PolarHBondContact OE2-NZ 3.42Å
223	F	93.4	Very high	89	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-48.1	179.6	-175.2	-112.4	0	0	0	111.9	W219 K220 S225 V226 L227 M283 L286 W405 A406 Q409	W219-F223 WeakPolarHBondContact O-CB 3.34Å; W219-F223 PolarHBondContact O-N 3.23Å; K220-F223 PolarHBondContact O-N 3.27Å; F223-S225 VanDerWaalsContact C-N 3.29Å; F223-S225 PolarHBondContact O-N 2.75Å; F223-V226 PolarHBondContact O-N 3.21Å; F223-L227 HydrophobicContact CE1-CD2 4.05Å; F223-L227 HydrophobicContact CZ-CD2 4.4Å; F223-L227 WeakPolarHBondContact O-CB 3.42Å; F223-L227 PolarHBondContact O-N 3.32Å; F223-M283 HydrophobicContact CD2-CB 4.44Å; F223-M283 HydrophobicContact CE2-CB 3.75Å; F223-M283 HydrophobicContact CE2-CG 4.17Å; F223-M283 HydrophobicContact CE2-SD 4.33Å; F223-M283 HydrophobicContact CZ-CB 4.4Å; F223-M283 HydrophobicContact CZ-CG 4.41Å; F223-M283 HydrophobicContact CZ-SD 4.06Å; F223-L286 HydrophobicContact CB-CD1 3.72Å; F223-L286 HydrophobicContact CD2-CD1 4.36Å; F223-L286 HydrophobicContact CG-CD1 4.43Å; F223-W405 HydrophobicContact CB-CH2 4.5Å; F223-W405 HydrophobicContact CB-CZ3 4.19Å; F223-W405 HydrophobicContact CD1-CH2 4.16Å; F223-W405 AromaticContact CD1-CZ3 3.75Å; F223-W405 HydrophobicContact CD1-CZ3 3.75Å; F223-W405 HydrophobicContact CG-CZ3 4.32Å; F223-A406 HydrophobicContact CD1-CB 4.13Å; F223-A406 HydrophobicContact CE1-CB 3.73Å; F223-A406 WeakPolarHBondContact CE1-O 3.11Å; F223-A406 HydrophobicContact CZ-CB 3.99Å; F223-Q409 HydrophobicContact CD1-CB 4.45Å; F223-Q409 HydrophobicContact CE1-CB 4.06Å
224	V	92.8	Very high	88.3	Confident	52 Å²	52	46.9 Å²	46.9	32%	0.315	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-37	179.8	171	0	0	0	0	111.6	K220 S228 W405	K220-V224 VanDerWaalsContact O-CG2 3.32Å; K220-V224 WeakPolarHBondContact O-CG2 3.47Å; K220-V224 PolarHBondContact O-N 2.97Å; V224-S228 WeakPolarHBondContact O-CB 3.46Å; V224-S228 PolarHBondContact O-N 2.84Å; V224-S228 PolarHBondContact O-OG 3.49Å; V224-W405 HydrophobicContact CG2-CH2 3.9Å; V224-W405 HydrophobicContact CG2-CZ2 4.23Å
225	S	91.6	Very high	87.6	Confident	78 Å²	78	42.6 Å²	42.6	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-49.4	176	-178.3	0	0	0	0	111.4	S221 E222 F223 S228 S229	S221-S225 VanDerWaalsContact O-CB 3.24Å; S221-S225 WeakPolarHBondContact O-CB 3.39Å; S221-S225 PolarHBondContact O-N 2.85Å; E222-S225 PolarHBondContact O-N 2.92Å; F223-S225 VanDerWaalsContact C-N 3.29Å; F223-S225 PolarHBondContact O-N 2.75Å; S225-S228 PolarHBondContact O-N 3.03Å; S225-S229 WeakPolarHBondContact O-CB 3.27Å; S225-S229 PolarHBondContact O-N 3.46Å
226	V	90.9	Very high	86.9	Confident	45 Å²	45	42.6 Å²	42.6	27%	0.273	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-46.3	178.4	171.4	0	0	0	0	110.9	E222 F223 S228 S229 S230 T279 K282	E222-V226 WeakPolarHBondContact O-CG2 3.34Å; E222-V226 PolarHBondContact O-N 3.26Å; F223-V226 PolarHBondContact O-N 3.21Å; V226-S228 VanDerWaalsContact C-N 3.35Å; V226-S228 PolarHBondContact O-N 3.38Å; V226-S229 PolarHBondContact O-N 2.91Å; V226-S229 PolarHBondContact O-OG 3.5Å; V226-S230 PolarHBondContact O-N 3.09Å; V226-S230 PolarHBondContact O-OG 2.97Å; V226-T279 HydrophobicContact CG1-CG2 3.82Å; V226-K282 HydrophobicContact CG1-CB 4.41Å; V226-K282 HydrophobicContact CG2-CG 4.4Å
227	L	90.2	Very high	86.2	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-38.4	176.7	-178.5	63.8	0	0	0	112.5	F223 S230 V231 Q409 K413	F223-L227 HydrophobicContact CE1-CD2 4.05Å; F223-L227 HydrophobicContact CZ-CD2 4.4Å; F223-L227 WeakPolarHBondContact O-CB 3.42Å; F223-L227 PolarHBondContact O-N 3.32Å; L227-S230 PolarHBondContact O-OG 2.92Å; L227-V231 HydrophobicContact CD1-CG2 4.21Å; L227-V231 WeakPolarHBondContact O-CG2 3.32Å; L227-V231 PolarHBondContact O-N 2.91Å; L227-Q409 HydrophobicContact CD2-CB 4.31Å; L227-K413 HydrophobicContact CD2-CB 3.82Å; L227-K413 HydrophobicContact CD2-CG 4.25Å; L227-K413 HydrophobicContact CG-CB 4.17Å; L227-K413 HydrophobicContact CG-CG 4.1Å
228	S	88.1	Confident	85.5	Confident	39 Å²	39	47.4 Å²	47.4	27%	0.273	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-39.6	175.1	-63.8	0	0	0	0	111.1	V224 S225 V226 S230 D232 K413	V224-S228 WeakPolarHBondContact O-CB 3.46Å; V224-S228 PolarHBondContact O-N 2.84Å; V224-S228 PolarHBondContact O-OG 3.49Å; S225-S228 PolarHBondContact O-N 3.03Å; V226-S228 VanDerWaalsContact C-N 3.35Å; V226-S228 PolarHBondContact O-N 3.38Å; S228-S230 VanDerWaalsContact C-N 3.34Å; S228-S230 PolarHBondContact O-N 3.41Å; S228-D232 WeakPolarHBondContact O-CB 3.3Å; S228-D232 PolarHBondContact O-N 2.99Å; S228-K413 PolarHBondContact OG-NZ 3.41Å
229	S	84.9	Confident	84.7	Confident	43 Å²	43	48.5 Å²	48.5	30%	0.301	27%	0.266	S	S	.	.	H	α-helix	trans	-68.6	-30.6	179	82.2	0	0	0	0	113.5	S225 V226 S235	S225-S229 WeakPolarHBondContact O-CB 3.27Å; S225-S229 PolarHBondContact O-N 3.46Å; V226-S229 PolarHBondContact O-N 2.91Å; V226-S229 PolarHBondContact O-OG 3.5Å; S229-S235 PolarHBondContact O-OG 2.95Å
230	S	80.7	Confident	84	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-79	-27.3	-178	61.6	0	0	0	0	112.9	V226 L227 S228 L236 S275 T279	V226-S230 PolarHBondContact O-N 3.09Å; V226-S230 PolarHBondContact O-OG 2.97Å; L227-S230 PolarHBondContact O-OG 2.92Å; S228-S230 VanDerWaalsContact C-N 3.34Å; S228-S230 PolarHBondContact O-N 3.41Å; S230-L236 WeakPolarHBondContact O-CD1 3.45Å; S230-L236 WeakPolarHBondContact O-CD2 3.36Å; S230-L236 WeakPolarHBondContact O-CG 3.43Å; S230-S275 PolarHBondContact O-OG 3.5Å; S230-T279 WeakPolarHBondContact OG-CG2 3.4Å
231	V	78.6	Confident	83.2	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.036	29%	0.286	C	S	.	.	H	α-helix	trans	-102.3	-5.4	-176.7	-162.4	0	0	0	0	111.9	L227 I233 L276 L414 V417	L227-V231 HydrophobicContact CD1-CG2 4.21Å; L227-V231 WeakPolarHBondContact O-CG2 3.32Å; L227-V231 PolarHBondContact O-N 2.91Å; V231-I233 PolarHBondContact O-N 3.35Å; V231-L276 HydrophobicContact CG2-CD2 4.24Å; V231-L414 HydrophobicContact CG1-CD2 4.35Å; V231-L414 HydrophobicContact CG2-CD2 4.05Å; V231-V417 HydrophobicContact CB-CG2 4.27Å; V231-V417 HydrophobicContact CG1-CB 3.46Å; V231-V417 VanDerWaalsContact CG1-CB 3.46Å; V231-V417 HydrophobicContact CG1-CG1 3.38Å; V231-V417 HydrophobicContact CG1-CG2 3.52Å
232	D	80.9	Confident	82.2	Confident	77 Å²	77	54.3 Å²	54.3	41%	0.412	29%	0.285	S	S	.	.			trans	-68.7	123	175.9	-176.7	13.8	0	0	0	112.3	S228 D234 S235 L236	S228-D232 WeakPolarHBondContact O-CB 3.3Å; S228-D232 PolarHBondContact O-N 2.99Å; D232-D234 VanDerWaalsContact C-N 3.32Å; D232-D234 PolarHBondContact O-N 3.07Å; D232-D234 PolarHBondContact OD1-N 2.8Å; D232-S235 PolarHBondContact O-N 3.06Å; D232-S235 PolarHBondContact O-OG 2.94Å; D232-S235 VanDerWaalsContact O-OG 3.05Å; D232-L236 WeakPolarHBondContact O-CB 3.31Å; D232-L236 WeakPolarHBondContact O-CD1 3.37Å; D232-L236 VanDerWaalsContact O-CG 3.22Å; D232-L236 WeakPolarHBondContact O-CG 3.36Å; D232-L236 PolarHBondContact O-N 3.31Å
233	I	74.9	Confident	80.9	Confident	64 Å²	64	56.9 Å²	56.9	33%	0.328	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-40.1	-173.6	-60.3	163.3	0	0	0	110.9	V231 L236 T237 I424	V231-I233 PolarHBondContact O-N 3.35Å; I233-L236 PolarHBondContact O-N 3.41Å; I233-T237 VanDerWaalsContact O-CB 3.29Å; I233-T237 WeakPolarHBondContact O-CB 3.43Å; I233-T237 PolarHBondContact O-N 3.17Å; I233-T237 PolarHBondContact O-OG1 3.06Å; I233-I424 HydrophobicContact CG1-CD1 3.72Å
234	D	76.7	Confident	79.5	Confident	114 Å²	114	59.5 Å²	59.5	61%	0.61	31%	0.305	S	S	*	.	H	α-helix	trans	-70.9	-42.1	-177.5	-73.3	-33.6	0	0	0	110.9	D232 T237 Q238	D232-D234 VanDerWaalsContact C-N 3.32Å; D232-D234 PolarHBondContact O-N 3.07Å; D232-D234 PolarHBondContact OD1-N 2.8Å; D234-T237 PolarHBondContact O-N 3.31Å; D234-Q238 WeakPolarHBondContact O-CB 3.44Å; D234-Q238 VanDerWaalsContact O-CG 3.3Å; D234-Q238 WeakPolarHBondContact O-CG 3.23Å; D234-Q238 PolarHBondContact O-N 3.23Å
235	S	76.6	Confident	77.9	Confident	21 Å²	21	64.7 Å²	64.7	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-43.5	175.5	95.2	0	0	0	0	111.1	S229 D232 Q238 R239	S229-S235 PolarHBondContact O-OG 2.95Å; D232-S235 PolarHBondContact O-N 3.06Å; D232-S235 PolarHBondContact O-OG 2.94Å; D232-S235 VanDerWaalsContact O-OG 3.05Å; S235-Q238 PolarHBondContact O-N 3.45Å; S235-R239 WeakPolarHBondContact O-CB 3.29Å; S235-R239 VanDerWaalsContact O-CG 3.3Å; S235-R239 WeakPolarHBondContact O-CG 3.37Å; S235-R239 PolarHBondContact O-N 3.27Å
236	L	78	Confident	76.4	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-43.3	178.5	-76.6	169.2	0	0	0	111.6	S230 D232 I233 Q238 R239 M240 F268 T271 I272 I424	S230-L236 WeakPolarHBondContact O-CD1 3.45Å; S230-L236 WeakPolarHBondContact O-CD2 3.36Å; S230-L236 WeakPolarHBondContact O-CG 3.43Å; D232-L236 WeakPolarHBondContact O-CB 3.31Å; D232-L236 WeakPolarHBondContact O-CD1 3.37Å; D232-L236 VanDerWaalsContact O-CG 3.22Å; D232-L236 WeakPolarHBondContact O-CG 3.36Å; D232-L236 PolarHBondContact O-N 3.31Å; I233-L236 PolarHBondContact O-N 3.41Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; L236-R239 PolarHBondContact O-N 2.93Å; L236-M240 WeakPolarHBondContact O-CB 3.23Å; L236-M240 PolarHBondContact O-N 3.3Å; L236-F268 HydrophobicContact CB-CE2 3.89Å; L236-F268 HydrophobicContact CB-CZ 4.41Å; L236-T271 HydrophobicContact CD2-CG2 4.01Å; L236-I272 HydrophobicContact CD1-CG1 3.77Å; L236-I272 HydrophobicContact CD2-CG1 4.16Å; L236-I424 HydrophobicContact CD1-CD1 4.45Å
237	T	75.8	Confident	74.6	Confident	37 Å²	37	73 Å²	73	23%	0.227	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-39.9	177.8	-56.6	0	0	0	0	111.1	I233 D234 R241	I233-T237 VanDerWaalsContact O-CB 3.29Å; I233-T237 WeakPolarHBondContact O-CB 3.43Å; I233-T237 PolarHBondContact O-N 3.17Å; I233-T237 PolarHBondContact O-OG1 3.06Å; D234-T237 PolarHBondContact O-N 3.31Å; T237-R241 WeakPolarHBondContact O-CG 3.43Å; T237-R241 PolarHBondContact O-N 3.48Å
238	Q	78.8	Confident	72.7	Confident	130 Å²	130	80 Å²	80	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-65.5	-45.9	173.5	-74.8	-175.2	1.3	0	0	111.9	D234 S235 L236 M240 R241 T242	D234-Q238 WeakPolarHBondContact O-CB 3.44Å; D234-Q238 VanDerWaalsContact O-CG 3.3Å; D234-Q238 WeakPolarHBondContact O-CG 3.23Å; D234-Q238 PolarHBondContact O-N 3.23Å; S235-Q238 PolarHBondContact O-N 3.45Å; L236-Q238 VanDerWaalsContact C-N 3.35Å; Q238-M240 VanDerWaalsContact C-N 3.29Å; Q238-M240 PolarHBondContact O-N 2.89Å; Q238-R241 PolarHBondContact O-N 3.34Å; Q238-T242 PolarHBondContact O-N 2.97Å; Q238-T242 PolarHBondContact O-OG1 3.22Å
239	R	76.9	Confident	70.4	Confident	115 Å²	115	81.7 Å²	81.7	43%	0.434	41%	0.409	S	S	.	.	H	α-helix	trans	-59.3	-40.5	176.6	-75.3	177.8	-172.3	-171.6	6.4	111.8	S235 L236 T242 R243 T271	S235-R239 WeakPolarHBondContact O-CB 3.29Å; S235-R239 VanDerWaalsContact O-CG 3.3Å; S235-R239 WeakPolarHBondContact O-CG 3.37Å; S235-R239 PolarHBondContact O-N 3.27Å; L236-R239 PolarHBondContact O-N 2.93Å; R239-T242 PolarHBondContact O-N 3.39Å; R239-R243 PolarHBondContact O-N 2.88Å; R239-T271 HydrophobicContact CB-CG2 3.74Å
240	M	77.2	Confident	68.4	Low	15 Å²	15	83.2 Å²	83.2	7%	0.074	43%	0.431	C	S	.	.	H	α-helix	trans	-61.1	-48.9	174.3	178.8	-165.3	157.4	0	0	111.6	L236 Q238 T242 R243 Q244 Q264 A267 F268	L236-M240 WeakPolarHBondContact O-CB 3.23Å; L236-M240 PolarHBondContact O-N 3.3Å; Q238-M240 VanDerWaalsContact C-N 3.29Å; Q238-M240 PolarHBondContact O-N 2.89Å; M240-T242 VanDerWaalsContact C-N 3.33Å; M240-T242 PolarHBondContact O-N 2.79Å; M240-R243 PolarHBondContact O-N 3.33Å; M240-Q244 PolarHBondContact O-N 3.04Å; M240-Q264 VanDerWaalsContact CE-CA 3.5Å; M240-Q264 HydrophobicContact CE-CB 3.69Å; M240-Q264 HydrophobicContact CE-CG 3.87Å; M240-Q264 WeakPolarHBondContact CE-O 3.43Å; M240-A267 HydrophobicContact CE-CB 4.04Å; M240-A267 HydrophobicContact CG-CB 4.18Å; M240-F268 HydrophobicContact SD-CB 3.81Å; M240-F268 HydrophobicContact SD-CD2 4.1Å; M240-F268 HydrophobicContact SD-CG 4.47Å
241	R	75.2	Confident	66.4	Low	159 Å²	159	87.9 Å²	87.9	60%	0.6	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-40	178.5	-73.3	175.7	-178	172.7	3.2	112.1	T237 Q238 Q244 K245	T237-R241 WeakPolarHBondContact O-CG 3.43Å; T237-R241 PolarHBondContact O-N 3.48Å; Q238-R241 PolarHBondContact O-N 3.34Å; R241-Q244 PolarHBondContact O-N 3.46Å; R241-K245 WeakPolarHBondContact O-CG 3.43Å; R241-K245 PolarHBondContact O-N 3.42Å
242	T	72.6	Confident	64.7	Low	79 Å²	79	90.3 Å²	90.3	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-43.2	177	-56.1	0	0	0	0	111.2	Q238 R239 M240 Q244 K245 I246	Q238-T242 PolarHBondContact O-N 2.97Å; Q238-T242 PolarHBondContact O-OG1 3.22Å; R239-T242 PolarHBondContact O-N 3.39Å; M240-T242 VanDerWaalsContact C-N 3.33Å; M240-T242 PolarHBondContact O-N 2.79Å; T242-Q244 VanDerWaalsContact C-N 3.34Å; T242-Q244 PolarHBondContact O-N 2.94Å; T242-K245 PolarHBondContact O-N 3.39Å; T242-I246 HydrophobicContact CG2-CD1 4.15Å; T242-I246 WeakPolarHBondContact O-CG1 3.33Å; T242-I246 PolarHBondContact O-N 3.4Å; T242-I246 VanDerWaalsContact O-N 3.1Å
243	R	65.2	Low	62.6	Low	113 Å²	113	93.6 Å²	93.6	43%	0.426	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-41.7	173	-95.9	-174.4	172.5	164.7	1	112.6	R239 M240 I246 Q247 T274	R239-R243 PolarHBondContact O-N 2.88Å; M240-R243 PolarHBondContact O-N 3.33Å; R243-I246 PolarHBondContact O-N 2.9Å; R243-Q247 PolarHBondContact O-N 3.41Å; R243-T274 PolarHBondContact NH1-OG1 3.17Å
244	Q	63.3	Low	60.9	Low	56 Å²	56	94.1 Å²	94.1	26%	0.262	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-38.5	177.4	-76.3	-176.1	-21.5	0	0	112.4	M240 R241 T242 I246 Q247 Q248	M240-Q244 PolarHBondContact O-N 3.04Å; R241-Q244 PolarHBondContact O-N 3.46Å; T242-Q244 VanDerWaalsContact C-N 3.34Å; T242-Q244 PolarHBondContact O-N 2.94Å; Q244-I246 VanDerWaalsContact C-N 3.34Å; Q244-I246 PolarHBondContact O-N 3.16Å; Q244-Q247 PolarHBondContact O-N 3.32Å; Q244-Q248 WeakPolarHBondContact O-CB 3.3Å; Q244-Q248 WeakPolarHBondContact O-CG 3.49Å; Q244-Q248 PolarHBondContact O-N 3.02Å
245	K	59.6	Low	59.1	Low	161 Å²	161	99.7 Å²	99.7	70%	0.7	55%	0.55	S	S	*	.	H	α-helix	trans	-64.1	-37.3	174.4	-76.4	-177	179.2	-177	0	112.7	R241 T242 Q248 G249	R241-K245 WeakPolarHBondContact O-CG 3.43Å; R241-K245 PolarHBondContact O-N 3.42Å; T242-K245 PolarHBondContact O-N 3.39Å; K245-Q248 PolarHBondContact O-N 3.39Å; K245-G249 PolarHBondContact O-N 3.41Å
246	I	58.6	Low	57	Low	129 Å²	129	103.3 Å²	103.3	66%	0.662	58%	0.581	S	S	*	*	H	α-helix	trans	-69.6	-39	178.1	-64.7	163.5	0	0	0	110.8	T242 R243 Q244 Q248 G249	T242-I246 HydrophobicContact CG2-CD1 4.15Å; T242-I246 WeakPolarHBondContact O-CG1 3.33Å; T242-I246 PolarHBondContact O-N 3.4Å; T242-I246 VanDerWaalsContact O-N 3.1Å; R243-I246 PolarHBondContact O-N 2.9Å; Q244-I246 VanDerWaalsContact C-N 3.34Å; Q244-I246 PolarHBondContact O-N 3.16Å; I246-Q248 VanDerWaalsContact C-N 3.33Å; I246-G249 PolarHBondContact O-N 2.95Å
247	Q	53.5	Low	55.2	Low	167 Å²	167	108.3 Å²	108.3	78%	0.78	62%	0.616	S	S	*	*	H	α-helix	trans	-73.2	-22.4	174.7	-75.2	-178.7	-5	0	0	113.6	R243 Q244	R243-Q247 PolarHBondContact O-N 3.41Å; Q244-Q247 PolarHBondContact O-N 3.32Å
248	Q	50.3	Low	53.2	Low	151 Å²	151	114.5 Å²	114.5	71%	0.706	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	9.9	173.9	-73.2	-174.8	0.4	0	0	114.1	Q244 K245 I246 G250	Q244-Q248 WeakPolarHBondContact O-CB 3.3Å; Q244-Q248 WeakPolarHBondContact O-CG 3.49Å; Q244-Q248 PolarHBondContact O-N 3.02Å; K245-Q248 PolarHBondContact O-N 3.39Å; I246-Q248 VanDerWaalsContact C-N 3.33Å; Q248-G250 PolarHBondContact O-N 2.87Å
249	G	40.8	Very low	51.1	Low	74 Å²	74	114 Å²	114	76%	0.763	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	27.9	-178.9	0	0	0	0	0	116.8	K245 I246	K245-G249 PolarHBondContact O-N 3.41Å; I246-G249 PolarHBondContact O-N 2.95Å
250	G	42.1	Very low	49.4	Very low	75 Å²	75	110.7 Å²	110.7	77%	0.773	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.7	18.1	-177.3	0	0	0	0	0	117.1	Q248	Q248-G250 PolarHBondContact O-N 2.87Å
251	S	38	Very low	48	Very low	102 Å²	102	115.8 Å²	115.8	71%	0.713	69%	0.686	S	S	*	*			trans	-137.8	123.6	176.8	-139.9	0	0	0	0	113.4
252	G	42.9	Very low	47	Very low	57 Å²	57	111 Å²	111	59%	0.588	69%	0.687	S	S	*	*			trans	-64.6	169.3	-177.2	0	0	0	0	0	114.5	G254	G252-G254 PolarHBondContact O-N 3.31Å
253	P	38.6	Very low	46.5	Very low	146 Å²	146	109.5 Å²	109.5	95%	0.948	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	104.9	-174.7	29.6	-31.2	0	0	0	109.5
254	G	39.4	Very low	46.9	Very low	75 Å²	75	109.1 Å²	109.1	77%	0.773	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.3	-1.5	179.3	0	0	0	0	0	118.2	G252	G252-G254 PolarHBondContact O-N 3.31Å
255	R	38	Very low	47.5	Very low	230 Å²	230	108.8 Å²	108.8	87%	0.868	70%	0.697	S	S	*	*			trans	-109.4	105.1	174.5	-83.7	-174.6	155.8	-172.2	-5.9	111.6	S257	R255-S257 PolarHBondContact O-N 3.32Å
256	A	33.3	Very low	48.4	Very low	97 Å²	97	103.9 Å²	103.9	80%	0.802	69%	0.687	S	S	*	*			trans	-53.6	117.6	166.1	0	0	0	0	0	109.5	L258	A256-L258 PolarHBondContact O-N 3.2Å
257	S	38.4	Very low	49.5	Very low	106 Å²	106	99.1 Å²	99.1	74%	0.741	67%	0.667	S	S	*	*			trans	-69.3	108.8	176.2	53.1	0	0	0	0	109.8	R255	R255-S257 PolarHBondContact O-N 3.32Å
258	L	34.1	Very low	51.1	Low	167 Å²	167	92.1 Å²	92.1	87%	0.874	63%	0.634	S	S	*	*			trans	-58.6	133.7	161.8	-81.8	116.3	0	0	0	109.8	A256 A260	A256-L258 PolarHBondContact O-N 3.2Å; L258-A260 PolarHBondContact O-N 3.45Å; L258-A260 VanDerWaalsContact O-N 3.13Å
259	S	34.8	Very low	52.9	Low	120 Å²	120	86.7 Å²	86.7	84%	0.839	61%	0.608	S	S	*	*			trans	-2	88.4	175.2	-68.2	0	0	0	0	116.9	V261	S259-V261 PolarHBondContact O-N 3.41Å
260	A	42.6	Very low	55.1	Low	45 Å²	45	87.1 Å²	87.1	37%	0.372	60%	0.596	S	S	.	*			trans	-91.3	28	-178.9	0	0	0	0	0	114.3	L258 Q264	L258-A260 PolarHBondContact O-N 3.45Å; L258-A260 VanDerWaalsContact O-N 3.13Å; A260-Q264 WeakPolarHBondContact O-CG 3.39Å
261	V	47.2	Very low	57.2	Low	122 Å²	122	83.8 Å²	83.8	74%	0.739	56%	0.56	S	S	*	*	H	α-helix	trans	-72.6	-38	-177.5	-177.7	0	0	0	0	111.4	S259	S259-V261 PolarHBondContact O-N 3.41Å
262	G	53.4	Low	59.6	Low	59 Å²	59	79.1 Å²	79.1	61%	0.608	53%	0.528	S	S	*	.	H	α-helix	trans	-76.4	-35.1	178.6	0	0	0	0	0	114.7	Q264 A266	G262-Q264 VanDerWaalsContact C-N 3.32Å; G262-Q264 PolarHBondContact O-N 3.34Å; G262-A266 PolarHBondContact O-N 2.99Å
263	G	63.1	Low	61.8	Low	48 Å²	48	77.5 Å²	77.5	50%	0.495	50%	0.504	S	S	.	.	H	α-helix	trans	-70.7	-27.5	-178.8	0	0	0	0	0	113.6	A267	G263-A267 WeakPolarHBondContact O-CB 3.22Å; G263-A267 PolarHBondContact O-N 3.14Å
264	Q	73.2	Confident	64.3	Low	104 Å²	104	73.4 Å²	73.4	49%	0.486	48%	0.476	S	S	.	.	H	α-helix	trans	-70.4	-42.8	177.2	-75.8	-178.1	1.4	0	0	112	M240 A260 G262 A267 F268	M240-Q264 VanDerWaalsContact CE-CA 3.5Å; M240-Q264 HydrophobicContact CE-CB 3.69Å; M240-Q264 HydrophobicContact CE-CG 3.87Å; M240-Q264 WeakPolarHBondContact CE-O 3.43Å; A260-Q264 WeakPolarHBondContact O-CG 3.39Å; G262-Q264 VanDerWaalsContact C-N 3.32Å; G262-Q264 PolarHBondContact O-N 3.34Å; Q264-A267 PolarHBondContact O-N 3.35Å; Q264-F268 WeakPolarHBondContact O-CB 3.3Å; Q264-F268 PolarHBondContact O-N 3.41Å
265	A	75.4	Confident	66.6	Low	49 Å²	49	70.2 Å²	70.2	41%	0.405	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-46.3	176.9	0	0	0	0	0	112	A267 F268 H269	A265-A267 PolarHBondContact O-N 2.87Å; A265-F268 WeakPolarHBondContact O-CB 3.39Å; A265-F268 PolarHBondContact O-N 3.37Å; A265-F268 VanDerWaalsContact O-N 3.14Å; A265-H269 PolarHBondContact O-CD2 3.47Å; A265-H269 PolarHBondContact O-N 2.93Å
266	A	79.5	Confident	69.1	Low	59 Å²	59	59.5 Å²	59.5	49%	0.488	40%	0.402	S	S	.	.	H	α-helix	trans	-61.4	-42.8	177.9	0	0	0	0	0	112.6	G262 F268 H269 V270	G262-A266 PolarHBondContact O-N 2.99Å; A266-F268 VanDerWaalsContact C-N 3.3Å; A266-F268 PolarHBondContact O-N 3.28Å; A266-H269 PolarHBondContact O-N 3.45Å; A266-V270 WeakPolarHBondContact O-CG2 3.42Å; A266-V270 PolarHBondContact O-N 3.19Å; A266-V270 VanDerWaalsContact O-N 3.07Å
267	A	81.5	Confident	71.8	Confident	29 Å²	29	57.9 Å²	57.9	24%	0.24	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-31.7	176.2	0	0	0	0	0	112.9	M240 G263 Q264 A265 T271	M240-A267 HydrophobicContact CE-CB 4.04Å; M240-A267 HydrophobicContact CG-CB 4.18Å; G263-A267 WeakPolarHBondContact O-CB 3.22Å; G263-A267 PolarHBondContact O-N 3.14Å; Q264-A267 PolarHBondContact O-N 3.35Å; A265-A267 PolarHBondContact O-N 2.87Å; A267-T271 PolarHBondContact O-N 3.26Å; A267-T271 VanDerWaalsContact O-N 3.14Å; A267-T271 PolarHBondContact O-OG1 3.47Å
268	F	85.5	Confident	74.3	Confident	20 Å²	20	54.5 Å²	54.5	9%	0.088	36%	0.361	C	S	.	.	H	α-helix	trans	-66.4	-47.3	171.6	-171.5	-107.2	0	0	0	111.8	L236 M240 Q264 A265 A266 V270 T271 I272 V423 I424	L236-F268 HydrophobicContact CB-CE2 3.89Å; L236-F268 HydrophobicContact CB-CZ 4.41Å; M240-F268 HydrophobicContact SD-CB 3.81Å; M240-F268 HydrophobicContact SD-CD2 4.1Å; M240-F268 HydrophobicContact SD-CG 4.47Å; Q264-F268 WeakPolarHBondContact O-CB 3.3Å; Q264-F268 PolarHBondContact O-N 3.41Å; A265-F268 WeakPolarHBondContact O-CB 3.39Å; A265-F268 PolarHBondContact O-N 3.37Å; A265-F268 VanDerWaalsContact O-N 3.14Å; A266-F268 VanDerWaalsContact C-N 3.3Å; A266-F268 PolarHBondContact O-N 3.28Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3.07Å; F268-T271 WeakPolarHBondContact O-CB 3.38Å; F268-T271 PolarHBondContact O-N 2.98Å; F268-I272 HydrophobicContact CD1-CD1 3.61Å; F268-I272 HydrophobicContact CD1-CG1 4.44Å; F268-I272 HydrophobicContact CE1-CD1 3.27Å; F268-I272 HydrophobicContact CE1-CG1 4.17Å; F268-I272 HydrophobicContact CG-CD1 4.48Å; F268-I272 HydrophobicContact CZ-CD1 3.89Å; F268-I272 HydrophobicContact CZ-CG1 4.37Å; F268-I272 PolarHBondContact O-N 3.16Å; F268-V423 HydrophobicContact CD1-CG1 3.79Å; F268-V423 HydrophobicContact CE1-CB 4.42Å; F268-V423 HydrophobicContact CE1-CG1 3.63Å; F268-I424 HydrophobicContact CE1-CG1 4.39Å
269	H	88.6	Confident	77	Confident	37 Å²	37	46.6 Å²	46.6	17%	0.171	32%	0.32	C	S	.	.	H	α-helix	trans	-56.6	-45.2	176.6	-71.2	-151.4	0	0	0	111.4	A265 A266 T271 I272 W273 V427 E431	A265-H269 PolarHBondContact O-CD2 3.47Å; A265-H269 PolarHBondContact O-N 2.93Å; A266-H269 PolarHBondContact O-N 3.45Å; H269-T271 VanDerWaalsContact C-N 3.29Å; H269-T271 PolarHBondContact O-N 3.05Å; H269-I272 PolarHBondContact O-N 2.95Å; H269-W273 PolarHBondContact O-N 2.9Å; H269-V427 WeakPolarHBondContact CD2-CG2 3.5Å; H269-V427 VanDerWaalsContact NE2-CG2 3.31Å; H269-V427 WeakPolarHBondContact NE2-CG2 3.16Å; H269-E431 IonicContact CE1-OE1 3.18Å; H269-E431 IonicContact CG-OE1 2.82Å; H269-E431 IonicContact ND1-OE1 3.71Å; H269-E431 PolarHBondContact ND1-OE1 3.28Å
270	V	86.5	Confident	79.7	Confident	82 Å²	82	41 Å²	41	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-41.2	177.1	172.5	0	0	0	0	111	A266 F268 W273 T274	A266-V270 WeakPolarHBondContact O-CG2 3.42Å; A266-V270 PolarHBondContact O-N 3.19Å; A266-V270 VanDerWaalsContact O-N 3.07Å; F268-V270 VanDerWaalsContact C-N 3.32Å; F268-V270 PolarHBondContact O-N 3.07Å; V270-W273 PolarHBondContact O-N 2.73Å; V270-T274 HydrophobicContact CG1-CG2 4.36Å; V270-T274 WeakPolarHBondContact O-CG2 3.49Å; V270-T274 PolarHBondContact O-N 2.89Å; V270-T274 PolarHBondContact O-OG1 2.99Å
271	T	86.5	Confident	82	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-43	-179.6	-54.7	0	0	0	0	111.1	L236 R239 A267 F268 H269 T274 S275	L236-T271 HydrophobicContact CD2-CG2 4.01Å; R239-T271 HydrophobicContact CB-CG2 3.74Å; A267-T271 PolarHBondContact O-N 3.26Å; A267-T271 VanDerWaalsContact O-N 3.14Å; A267-T271 PolarHBondContact O-OG1 3.47Å; F268-T271 WeakPolarHBondContact O-CB 3.38Å; F268-T271 PolarHBondContact O-N 2.98Å; H269-T271 VanDerWaalsContact C-N 3.29Å; H269-T271 PolarHBondContact O-N 3.05Å; T271-T274 WeakPolarHBondContact CA-OG1 3.33Å; T271-T274 PolarHBondContact O-N 2.96Å; T271-T274 PolarHBondContact O-OG1 2.68Å; T271-S275 WeakPolarHBondContact O-CB 3.48Å; T271-S275 PolarHBondContact O-N 3.26Å; T271-S275 PolarHBondContact O-OG 2.86Å
272	I	88.7	Confident	84.1	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-55.1	173.5	-71.1	166.5	0	0	0	110.5	L236 F268 H269 T274 S275 L276 I424 V427	L236-I272 HydrophobicContact CD1-CG1 3.77Å; L236-I272 HydrophobicContact CD2-CG1 4.16Å; F268-I272 HydrophobicContact CD1-CD1 3.61Å; F268-I272 HydrophobicContact CD1-CG1 4.44Å; F268-I272 HydrophobicContact CE1-CD1 3.27Å; F268-I272 HydrophobicContact CE1-CG1 4.17Å; F268-I272 HydrophobicContact CG-CD1 4.48Å; F268-I272 HydrophobicContact CZ-CD1 3.89Å; F268-I272 HydrophobicContact CZ-CG1 4.37Å; F268-I272 PolarHBondContact O-N 3.16Å; H269-I272 PolarHBondContact O-N 2.95Å; I272-T274 VanDerWaalsContact C-N 3.34Å; I272-T274 PolarHBondContact O-N 3.49Å; I272-S275 WeakPolarHBondContact O-CB 3.22Å; I272-S275 PolarHBondContact O-N 3.4Å; I272-S275 PolarHBondContact O-OG 3.22Å; I272-L276 HydrophobicContact CG2-CD1 3.82Å; I272-L276 HydrophobicContact CG2-CG 4.33Å; I272-L276 PolarHBondContact O-N 3.41Å; I272-I424 HydrophobicContact CD1-CG1 4.11Å; I272-V427 HydrophobicContact CD1-CB 4.46Å; I272-V427 HydrophobicContact CD1-CG1 4.4Å; I272-V427 HydrophobicContact CD1-CG2 4.08Å; I272-V427 HydrophobicContact CG2-CG1 4.32Å
273	W	90.6	Very high	85.9	Confident	23 Å²	23	35.6 Å²	35.6	9%	0.087	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-40	-176.6	-69.6	118.7	0	0	0	112.6	H269 V270 S275 L276 D277 V427 L428 E431 K434 L435 L438	H269-W273 PolarHBondContact O-N 2.9Å; V270-W273 PolarHBondContact O-N 2.73Å; W273-S275 PolarHBondContact O-N 2.97Å; W273-L276 HydrophobicContact CE3-CD1 3.84Å; W273-L276 HydrophobicContact CZ3-CD1 3.75Å; W273-L276 PolarHBondContact O-N 3.3Å; W273-D277 WeakPolarHBondContact O-CB 3.32Å; W273-D277 PolarHBondContact O-N 3.5Å; W273-V427 HydrophobicContact CZ2-CG1 3.73Å; W273-L428 HydrophobicContact CH2-CD2 4.04Å; W273-E431 HydrophobicContact CZ2-CB 3.84Å; W273-E431 PolarHBondContact NE1-OE2 3.43Å; W273-K434 HydrophobicContact CD2-CB 4.33Å; W273-K434 HydrophobicContact CD2-CD 4.36Å; W273-K434 HydrophobicContact CE3-CB 4.39Å; W273-K434 HydrophobicContact CG-CD 4.39Å; W273-K434 HydrophobicContact CH2-CB 4.34Å; W273-K434 HydrophobicContact CZ2-CB 4.25Å; W273-K434 HydrophobicContact CZ3-CB 4.39Å; W273-L435 HydrophobicContact CH2-CB 3.81Å; W273-L435 HydrophobicContact CZ3-CB 3.82Å; W273-L435 HydrophobicContact CZ3-CD1 4.12Å; W273-L438 HydrophobicContact CE3-CD1 4.02Å; W273-L438 HydrophobicContact CZ3-CD1 4.35Å
274	T	89.5	Confident	87.2	Confident	59 Å²	59	35.5 Å²	35.5	36%	0.362	21%	0.212	S	C	.	.	H	α-helix	trans	-65.1	-29.1	174.6	53.5	0	0	0	0	113.2	R243 V270 T271 I272 G278	R243-T274 PolarHBondContact NH1-OG1 3.17Å; V270-T274 HydrophobicContact CG1-CG2 4.36Å; V270-T274 WeakPolarHBondContact O-CG2 3.49Å; V270-T274 PolarHBondContact O-N 2.89Å; V270-T274 PolarHBondContact O-OG1 2.99Å; T271-T274 WeakPolarHBondContact CA-OG1 3.33Å; T271-T274 PolarHBondContact O-N 2.96Å; T271-T274 PolarHBondContact O-OG1 2.68Å; I272-T274 VanDerWaalsContact C-N 3.34Å; I272-T274 PolarHBondContact O-N 3.49Å; T274-G278 PolarHBondContact O-N 2.71Å
275	S	88.5	Confident	87.9	Confident	8 Å²	8	35.3 Å²	35.3	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-76.9	-37.8	175.8	75.5	0	0	0	0	112.3	S230 T271 I272 W273 G278 T279	S230-S275 PolarHBondContact O-OG 3.5Å; T271-S275 WeakPolarHBondContact O-CB 3.48Å; T271-S275 PolarHBondContact O-N 3.26Å; T271-S275 PolarHBondContact O-OG 2.86Å; I272-S275 WeakPolarHBondContact O-CB 3.22Å; I272-S275 PolarHBondContact O-N 3.4Å; I272-S275 PolarHBondContact O-OG 3.22Å; W273-S275 PolarHBondContact O-N 2.97Å; S275-G278 PolarHBondContact O-N 3.2Å; S275-T279 VanDerWaalsContact O-CG2 3.22Å; S275-T279 WeakPolarHBondContact O-CG2 3.5Å; S275-T279 PolarHBondContact O-N 3.13Å; S275-T279 VanDerWaalsContact O-N 3.14Å
276	L	89.7	Confident	88.7	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-68.4	-41.2	176	-73	174.4	0	0	0	111.2	V231 I272 W273 G278 T279 I280 L414 L428 L438	V231-L276 HydrophobicContact CG2-CD2 4.24Å; I272-L276 HydrophobicContact CG2-CD1 3.82Å; I272-L276 HydrophobicContact CG2-CG 4.33Å; I272-L276 PolarHBondContact O-N 3.41Å; W273-L276 HydrophobicContact CE3-CD1 3.84Å; W273-L276 HydrophobicContact CZ3-CD1 3.75Å; W273-L276 PolarHBondContact O-N 3.3Å; L276-G278 VanDerWaalsContact C-N 3.33Å; L276-G278 PolarHBondContact O-N 2.9Å; L276-T279 WeakPolarHBondContact CA-OG1 3.38Å; L276-T279 WeakPolarHBondContact O-CA 3.47Å; L276-T279 WeakPolarHBondContact O-CB 3.46Å; L276-T279 PolarHBondContact O-N 3.41Å; L276-T279 PolarHBondContact O-OG1 2.92Å; L276-I280 WeakPolarHBondContact O-CG1 3.29Å; L276-I280 PolarHBondContact O-N 2.92Å; L276-L414 HydrophobicContact CD2-CD2 4.01Å; L276-L428 HydrophobicContact CD1-CD2 4.02Å; L276-L438 HydrophobicContact CB-CD1 4.35Å
277	D	90.1	Very high	89.1	Confident	64 Å²	64	30.8 Å²	30.8	34%	0.342	17%	0.172	S	C	.	.	H	α-helix	trans	-54	-50.4	172.8	-164.7	37.8	0	0	0	110.8	W273 T279 I280 D281 L438	W273-D277 WeakPolarHBondContact O-CB 3.32Å; W273-D277 PolarHBondContact O-N 3.5Å; D277-T279 PolarHBondContact O-N 3.21Å; D277-T279 VanDerWaalsContact O-N 3.17Å; D277-I280 WeakPolarHBondContact O-CB 3.24Å; D277-I280 PolarHBondContact O-N 3.29Å; D277-D281 PolarHBondContact O-N 3.02Å; D277-L438 HydrophobicContact CB-CD2 4.17Å; D277-L438 WeakPolarHBondContact OD1-CD2 3.42Å
278	G	91.2	Very high	89.3	Confident	34 Å²	34	31.6 Å²	31.6	35%	0.351	18%	0.176	S	C	.	.	H	α-helix	trans	-62	-25.8	174.9	0	0	0	0	0	114.7	T274 S275 L276 K282	T274-G278 PolarHBondContact O-N 2.71Å; S275-G278 PolarHBondContact O-N 3.2Å; L276-G278 VanDerWaalsContact C-N 3.33Å; L276-G278 PolarHBondContact O-N 2.9Å; G278-K282 PolarHBondContact O-N 3.2Å
279	T	91.4	Very high	89.5	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-76.2	-34.7	173	66.3	0	0	0	0	112.8	V226 S230 S275 L276 D277 K282 M283	V226-T279 HydrophobicContact CG1-CG2 3.82Å; S230-T279 WeakPolarHBondContact OG-CG2 3.4Å; S275-T279 VanDerWaalsContact O-CG2 3.22Å; S275-T279 WeakPolarHBondContact O-CG2 3.5Å; S275-T279 PolarHBondContact O-N 3.13Å; S275-T279 VanDerWaalsContact O-N 3.14Å; L276-T279 WeakPolarHBondContact CA-OG1 3.38Å; L276-T279 WeakPolarHBondContact O-CA 3.47Å; L276-T279 WeakPolarHBondContact O-CB 3.46Å; L276-T279 PolarHBondContact O-N 3.41Å; L276-T279 PolarHBondContact O-OG1 2.92Å; D277-T279 PolarHBondContact O-N 3.21Å; D277-T279 VanDerWaalsContact O-N 3.17Å; T279-K282 PolarHBondContact O-N 3.12Å; T279-M283 WeakPolarHBondContact O-CB 3.36Å; T279-M283 PolarHBondContact O-N 3.36Å
280	I	90.8	Very high	89.5	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-69.5	-39.6	174.9	-65.8	-62	0	0	0	110.1	L276 D277 K282 M283 E284 L410 L438 L442	L276-I280 WeakPolarHBondContact O-CG1 3.29Å; L276-I280 PolarHBondContact O-N 2.92Å; D277-I280 WeakPolarHBondContact O-CB 3.24Å; D277-I280 PolarHBondContact O-N 3.29Å; I280-K282 VanDerWaalsContact C-N 3.33Å; I280-K282 PolarHBondContact O-N 3.3Å; I280-M283 HydrophobicContact CD1-SD 4.46Å; I280-M283 VanDerWaalsContact O-CB 3.31Å; I280-M283 WeakPolarHBondContact O-CB 3.47Å; I280-M283 PolarHBondContact O-N 3.14Å; I280-M283 VanDerWaalsContact O-N 3.15Å; I280-E284 PolarHBondContact O-N 3.35Å; I280-L410 HydrophobicContact CD1-CD1 3.78Å; I280-L438 HydrophobicContact CG1-CB 4.47Å; I280-L442 HydrophobicContact CG2-CB 3.72Å; I280-L442 HydrophobicContact CG2-CD1 4.07Å; I280-L442 HydrophobicContact CG2-CD2 4.21Å; I280-L442 HydrophobicContact CG2-CG 4.2Å
281	D	90.8	Very high	89.4	Confident	71 Å²	71	26 Å²	26	38%	0.38	15%	0.145	S	C	.	.	H	α-helix	trans	-62.6	-40	173.6	-66.8	-20.1	0	0	0	111.9	D277 M283 E284 Q285 R445	D277-D281 PolarHBondContact O-N 3.02Å; D281-M283 VanDerWaalsContact C-N 3.35Å; D281-E284 WeakPolarHBondContact O-CB 3.33Å; D281-E284 PolarHBondContact O-N 3.25Å; D281-Q285 PolarHBondContact O-N 3.27Å; D281-R445 IonicContact OD1-CZ 3.38Å; D281-R445 IonicContact OD1-NH2 2.97Å; D281-R445 PolarHBondContact OD1-NH2 3.23Å
282	K	90.9	Very high	89.4	Confident	40 Å²	40	26.9 Å²	26.9	17%	0.174	15%	0.15	C	C	.	.	H	α-helix	trans	-67.7	-36.6	174	-173.4	59.5	177.4	176.7	0	111.8	E222 V226 G278 T279 I280 Q285 L286	E222-K282 WeakPolarHBondContact OE2-CE 3.39Å; E222-K282 IonicContact OE2-NZ 3.68Å; E222-K282 PolarHBondContact OE2-NZ 3.42Å; V226-K282 HydrophobicContact CG1-CB 4.41Å; V226-K282 HydrophobicContact CG2-CG 4.4Å; G278-K282 PolarHBondContact O-N 3.2Å; T279-K282 PolarHBondContact O-N 3.12Å; I280-K282 VanDerWaalsContact C-N 3.33Å; I280-K282 PolarHBondContact O-N 3.3Å; K282-Q285 VanDerWaalsContact CD-OE1 3.32Å; K282-Q285 VanDerWaalsContact NZ-OE1 3.13Å; K282-Q285 PolarHBondContact O-N 3.12Å; K282-L286 HydrophobicContact CD-CG 4.45Å; K282-L286 HydrophobicContact CG-CD1 4.3Å; K282-L286 VanDerWaalsContact O-CG 3.32Å; K282-L286 WeakPolarHBondContact O-CG 3.35Å; K282-L286 PolarHBondContact O-N 2.99Å; K282-L286 VanDerWaalsContact O-N 3.07Å
283	M	91.9	Very high	89.3	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-46.9	174.1	-174.1	164.7	167.3	0	0	110.9	F223 T279 I280 D281 L286 I287 L403 A406 S407 L442 L481	F223-M283 HydrophobicContact CD2-CB 4.44Å; F223-M283 HydrophobicContact CE2-CB 3.75Å; F223-M283 HydrophobicContact CE2-CG 4.17Å; F223-M283 HydrophobicContact CE2-SD 4.33Å; F223-M283 HydrophobicContact CZ-CB 4.4Å; F223-M283 HydrophobicContact CZ-CG 4.41Å; F223-M283 HydrophobicContact CZ-SD 4.06Å; T279-M283 WeakPolarHBondContact O-CB 3.36Å; T279-M283 PolarHBondContact O-N 3.36Å; I280-M283 HydrophobicContact CD1-SD 4.46Å; I280-M283 VanDerWaalsContact O-CB 3.31Å; I280-M283 WeakPolarHBondContact O-CB 3.47Å; I280-M283 PolarHBondContact O-N 3.14Å; I280-M283 VanDerWaalsContact O-N 3.15Å; D281-M283 VanDerWaalsContact C-N 3.35Å; M283-L286 PolarHBondContact O-N 3.48Å; M283-I287 HydrophobicContact CE-CD1 4.25Å; M283-I287 HydrophobicContact CG-CD1 3.8Å; M283-I287 WeakPolarHBondContact O-CD1 3.29Å; M283-I287 VanDerWaalsContact O-CG1 3.22Å; M283-I287 WeakPolarHBondContact O-CG1 3.4Å; M283-I287 PolarHBondContact O-N 3.45Å; M283-L403 HydrophobicContact CE-CD1 3.56Å; M283-A406 HydrophobicContact CE-CB 3.66Å; M283-A406 HydrophobicContact CG-CB 3.97Å; M283-A406 HydrophobicContact SD-CB 3.92Å; M283-S407 WeakPolarHBondContact CE-OG 3.36Å; M283-L442 HydrophobicContact CE-CD2 4.05Å; M283-L442 HydrophobicContact CG-CD2 4.37Å; M283-L442 HydrophobicContact SD-CD2 4.08Å; M283-L481 HydrophobicContact CE-CD2 4.5Å
284	E	89.5	Confident	89	Confident	45 Å²	45	25.6 Å²	25.6	21%	0.21	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-49.2	175.2	-177.6	-176.3	171.2	0	0	112.2	I280 D281 L286 I287 S288 L442 R445	I280-E284 PolarHBondContact O-N 3.35Å; D281-E284 WeakPolarHBondContact O-CB 3.33Å; D281-E284 PolarHBondContact O-N 3.25Å; E284-L286 VanDerWaalsContact C-N 3.29Å; E284-L286 PolarHBondContact O-N 3.26Å; E284-I287 PolarHBondContact O-N 2.86Å; E284-S288 PolarHBondContact O-N 3.46Å; E284-S288 PolarHBondContact O-OG 3.48Å; E284-L442 HydrophobicContact CB-CD1 3.63Å; E284-L442 HydrophobicContact CG-CD1 4.25Å; E284-R445 VanDerWaalsContact CD-NE 3.32Å; E284-R445 WeakPolarHBondContact OE1-CB 3.36Å; E284-R445 IonicContact OE1-NE 3.26Å; E284-R445 PolarHBondContact OE1-NE 2.81Å; E284-R445 IonicContact OE2-CZ 2.84Å; E284-R445 IonicContact OE2-NE 2.68Å; E284-R445 PolarHBondContact OE2-NE 2.88Å; E284-R445 IonicContact OE2-NH2 3.69Å; E284-R445 PolarHBondContact OE2-NH2 3.47Å
285	Q	89.9	Confident	88.7	Confident	101 Å²	101	24 Å²	24	47%	0.472	13%	0.133	S	C	.	.	H	α-helix	trans	-57	-43.2	178	-172.1	-169.2	14.1	0	0	111.7	D281 K282 S288 C289	D281-Q285 PolarHBondContact O-N 3.27Å; K282-Q285 VanDerWaalsContact CD-OE1 3.32Å; K282-Q285 VanDerWaalsContact NZ-OE1 3.13Å; K282-Q285 PolarHBondContact O-N 3.12Å; Q285-S288 PolarHBondContact O-OG 3.36Å; Q285-C289 PolarHBondContact O-N 3.05Å; Q285-C289 PolarHBondContact O-SG 3.49Å
286	L	90.7	Very high	88.4	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-73.5	-34.3	-179	-66	175.5	0	0	0	112.2	W219 F223 K282 M283 E284 C289 S290 F402	W219-L286 HydrophobicContact CB-CD2 3.89Å; W219-L286 HydrophobicContact CG-CD2 3.73Å; F223-L286 HydrophobicContact CB-CD1 3.72Å; F223-L286 HydrophobicContact CD2-CD1 4.36Å; F223-L286 HydrophobicContact CG-CD1 4.43Å; K282-L286 HydrophobicContact CD-CG 4.45Å; K282-L286 HydrophobicContact CG-CD1 4.3Å; K282-L286 VanDerWaalsContact O-CG 3.32Å; K282-L286 WeakPolarHBondContact O-CG 3.35Å; K282-L286 PolarHBondContact O-N 2.99Å; K282-L286 VanDerWaalsContact O-N 3.07Å; M283-L286 PolarHBondContact O-N 3.48Å; E284-L286 VanDerWaalsContact C-N 3.29Å; E284-L286 PolarHBondContact O-N 3.26Å; L286-C289 PolarHBondContact O-N 2.99Å; L286-S290 WeakPolarHBondContact O-CB 3.32Å; L286-S290 PolarHBondContact O-N 2.91Å; L286-S290 PolarHBondContact O-OG 3.09Å; L286-F402 HydrophobicContact CB-CD1 4.18Å; L286-F402 HydrophobicContact CB-CE1 3.45Å; L286-F402 VanDerWaalsContact CB-CE1 3.45Å; L286-F402 HydrophobicContact CB-CZ 3.8Å; L286-F402 HydrophobicContact CD1-CE1 4.1Å; L286-F402 HydrophobicContact CD1-CZ 3.92Å; L286-F402 HydrophobicContact CG-CE1 4.43Å; L286-F402 HydrophobicContact CG-CZ 4.45Å
287	I	88.2	Confident	88.1	Confident	11 Å²	11	23.4 Å²	23.4	6%	0.056	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-47.5	173	-69.7	162.6	0	0	0	109.8	M283 E284 C289 S290 R291 F402 L403 V446	M283-I287 HydrophobicContact CE-CD1 4.25Å; M283-I287 HydrophobicContact CG-CD1 3.8Å; M283-I287 WeakPolarHBondContact O-CD1 3.29Å; M283-I287 VanDerWaalsContact O-CG1 3.22Å; M283-I287 WeakPolarHBondContact O-CG1 3.4Å; M283-I287 PolarHBondContact O-N 3.45Å; E284-I287 PolarHBondContact O-N 2.86Å; I287-C289 PolarHBondContact O-N 3.14Å; I287-S290 PolarHBondContact O-N 3.04Å; I287-S290 PolarHBondContact O-OG 2.95Å; I287-R291 WeakPolarHBondContact O-CB 3.45Å; I287-R291 PolarHBondContact O-N 3.37Å; I287-F402 HydrophobicContact CG1-CD1 3.98Å; I287-L403 HydrophobicContact CD1-CB 4.13Å; I287-L403 HydrophobicContact CD1-CD1 3.52Å; I287-L403 HydrophobicContact CD1-CG 4.43Å; I287-L403 HydrophobicContact CG1-CB 4.45Å; I287-V446 HydrophobicContact CD1-CG2 4.35Å; I287-V446 HydrophobicContact CG2-CG1 4.07Å; I287-V446 HydrophobicContact CG2-CG2 4.35Å
288	S	86.9	Confident	87.4	Confident	46 Å²	46	22.6 Å²	22.6	32%	0.322	12%	0.124	S	C	.	.	H	α-helix	trans	-63	-42.8	178.7	67.9	0	0	0	0	112	E284 Q285 S290 R291 L292	E284-S288 PolarHBondContact O-N 3.46Å; E284-S288 PolarHBondContact O-OG 3.48Å; Q285-S288 PolarHBondContact O-OG 3.36Å; S288-S290 PolarHBondContact O-N 3.27Å; S288-R291 PolarHBondContact O-N 2.61Å; S288-L292 VanDerWaalsContact O-CB 3.32Å; S288-L292 WeakPolarHBondContact O-CB 3.46Å; S288-L292 PolarHBondContact O-N 3.15Å
289	C	89.1	Confident	86.8	Confident	10 Å²	10	25.6 Å²	25.6	7%	0.068	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-45.2	172.9	-67.2	0	0	0	0	112.3	Y187 W219 Q285 L286 I287 R291 L292 L293	Y187-C289 HydrophobicContact CD1-CB 3.85Å; Y187-C289 HydrophobicContact CE1-CB 3.99Å; W219-C289 HydrophobicContact CH2-CB 4Å; W219-C289 HydrophobicContact CZ2-CB 3.65Å; Q285-C289 PolarHBondContact O-N 3.05Å; Q285-C289 PolarHBondContact O-SG 3.49Å; L286-C289 PolarHBondContact O-N 2.99Å; I287-C289 PolarHBondContact O-N 3.14Å; C289-R291 VanDerWaalsContact C-N 3.33Å; C289-R291 PolarHBondContact O-N 2.98Å; C289-L292 PolarHBondContact O-N 3.08Å; C289-L293 WeakPolarHBondContact O-CB 3.28Å; C289-L293 PolarHBondContact O-N 3.46Å
290	S	88.1	Confident	86.1	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-37	-179.6	77.7	0	0	0	0	112.6	L286 I287 S288 G294 S356 F402	L286-S290 WeakPolarHBondContact O-CB 3.32Å; L286-S290 PolarHBondContact O-N 2.91Å; L286-S290 PolarHBondContact O-OG 3.09Å; I287-S290 PolarHBondContact O-N 3.04Å; I287-S290 PolarHBondContact O-OG 2.95Å; S288-S290 PolarHBondContact O-N 3.27Å; S290-G294 PolarHBondContact O-N 3Å; S290-S356 WeakPolarHBondContact OG-CB 3.32Å; S290-S356 PolarHBondContact OG-OG 3.37Å; S290-S356 VanDerWaalsContact OG-OG 3.08Å; S290-F402 WeakPolarHBondContact OG-CB 3.13Å
291	R	84.6	Confident	85.1	Confident	11 Å²	11	32.1 Å²	32.1	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-72.5	-45.5	177.7	-174.1	176	118.7	83.5	2.8	111.3	I287 S288 C289 L293 G294 L295 T449 E453	I287-R291 WeakPolarHBondContact O-CB 3.45Å; I287-R291 PolarHBondContact O-N 3.37Å; S288-R291 PolarHBondContact O-N 2.61Å; C289-R291 VanDerWaalsContact C-N 3.33Å; C289-R291 PolarHBondContact O-N 2.98Å; R291-L293 PolarHBondContact O-N 3.35Å; R291-G294 PolarHBondContact O-N 2.6Å; R291-G294 VanDerWaalsContact O-N 3.14Å; R291-L295 HydrophobicContact CG-CD1 3.99Å; R291-L295 HydrophobicContact CG-CG 4.31Å; R291-L295 WeakPolarHBondContact O-CB 3.38Å; R291-L295 WeakPolarHBondContact O-CG 3.48Å; R291-L295 PolarHBondContact O-N 2.99Å; R291-T449 PolarHBondContact NH2-O 2.91Å; R291-T449 VanDerWaalsContact NH2-O 3.15Å; R291-E453 IonicContact CZ-OE1 3.02Å; R291-E453 IonicContact CZ-OE2 3.92Å; R291-E453 IonicContact NH2-OE1 3.99Å; R291-E453 PolarHBondContact NH2-OE1 3.41Å; R291-E453 VanDerWaalsContact NH2-OE1 3.08Å; R291-E453 IonicContact NH2-OE2 3.58Å; R291-E453 PolarHBondContact NH2-OE2 3.2Å
292	L	86.2	Confident	83.8	Confident	24 Å²	24	28.9 Å²	28.9	13%	0.126	14%	0.136	C	C	.	.	H	α-helix	trans	-56.1	-43.4	175	-179.5	62.9	0	0	0	110.7	Y187 Q192 L195 S288 C289 T296	Y187-L292 HydrophobicContact CD1-CD2 4.37Å; Q192-L292 HydrophobicContact CB-CD1 4.28Å; L195-L292 HydrophobicContact CD2-CD2 4.14Å; L195-L292 HydrophobicContact CD2-CG 3.75Å; S288-L292 VanDerWaalsContact O-CB 3.32Å; S288-L292 WeakPolarHBondContact O-CB 3.46Å; S288-L292 PolarHBondContact O-N 3.15Å; C289-L292 PolarHBondContact O-N 3.08Å; L292-T296 VanDerWaalsContact O-CB 3.29Å; L292-T296 WeakPolarHBondContact O-CB 3.43Å; L292-T296 PolarHBondContact O-N 2.98Å; L292-T296 PolarHBondContact O-OG1 2.82Å
293	L	87.4	Confident	82.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-52.7	173.7	179.1	60.7	0	0	0	111.9	L195 L199 L215 W219 C289 R291 L295 T296 L297 I353	L195-L293 HydrophobicContact CD1-CD1 4.42Å; L199-L293 HydrophobicContact CD1-CD1 3.71Å; L199-L293 HydrophobicContact CD2-CD1 3.68Å; L199-L293 HydrophobicContact CG-CD1 4.29Å; L215-L293 HydrophobicContact CD1-CD2 4.22Å; W219-L293 HydrophobicContact CH2-CB 4.25Å; W219-L293 HydrophobicContact CH2-CD2 3.83Å; W219-L293 HydrophobicContact CZ3-CD2 4.09Å; C289-L293 WeakPolarHBondContact O-CB 3.28Å; C289-L293 PolarHBondContact O-N 3.46Å; R291-L293 PolarHBondContact O-N 3.35Å; L293-L295 PolarHBondContact O-N 3.3Å; L293-T296 PolarHBondContact O-N 2.74Å; L293-L297 HydrophobicContact CD1-CD1 4.37Å; L293-L297 HydrophobicContact CD1-CG 4.41Å; L293-L297 HydrophobicContact CG-CD1 4.29Å; L293-L297 WeakPolarHBondContact O-CG 3.47Å; L293-L297 PolarHBondContact O-N 3.46Å; L293-I353 HydrophobicContact CB-CG2 4.48Å; L293-I353 HydrophobicContact CD2-CD1 3.95Å; L293-I353 HydrophobicContact CD2-CG1 4.1Å; L293-I353 HydrophobicContact CD2-CG2 4.33Å; L293-I353 HydrophobicContact CG-CG2 4.12Å
294	G	84.1	Confident	80.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-43.3	-178.7	0	0	0	0	0	113.5	S290 R291 T296 L297 M298	S290-G294 PolarHBondContact O-N 3Å; R291-G294 PolarHBondContact O-N 2.6Å; R291-G294 VanDerWaalsContact O-N 3.14Å; G294-T296 PolarHBondContact O-N 3.34Å; G294-L297 PolarHBondContact O-N 3.3Å; G294-M298 WeakPolarHBondContact O-CG 3.47Å; G294-M298 PolarHBondContact O-N 3.04Å; G294-M298 VanDerWaalsContact O-N 3.12Å
295	L	82	Confident	78.9	Confident	26 Å²	26	35.7 Å²	35.7	14%	0.136	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-38.3	176.5	-69.6	174.1	0	0	0	112.5	R291 L293 M298 K299 A357 E453	R291-L295 HydrophobicContact CG-CD1 3.99Å; R291-L295 HydrophobicContact CG-CG 4.31Å; R291-L295 WeakPolarHBondContact O-CB 3.38Å; R291-L295 WeakPolarHBondContact O-CG 3.48Å; R291-L295 PolarHBondContact O-N 2.99Å; L293-L295 PolarHBondContact O-N 3.3Å; L295-M298 PolarHBondContact O-N 3.44Å; L295-K299 WeakPolarHBondContact O-CG 3.44Å; L295-K299 PolarHBondContact O-N 3.37Å; L295-A357 HydrophobicContact CD2-CB 4.35Å; L295-A357 HydrophobicContact CG-CB 4.4Å; L295-E453 WeakPolarHBondContact CD1-OE2 3.37Å
296	T	82.8	Confident	76.8	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-39.4	178	-53.8	0	0	0	0	111	Q192 L195 A196 L199 L292 L293 G294 M298 K299 Q300	Q192-T296 HydrophobicContact CG-CG2 4.16Å; Q192-T296 PolarHBondContact NE2-OG1 2.94Å; L195-T296 HydrophobicContact CB-CG2 4.27Å; L195-T296 HydrophobicContact CD2-CG2 4.35Å; L195-T296 HydrophobicContact CG-CG2 4.08Å; A196-T296 HydrophobicContact CB-CG2 3.84Å; L199-T296 HydrophobicContact CD1-CG2 3.96Å; L292-T296 VanDerWaalsContact O-CB 3.29Å; L292-T296 WeakPolarHBondContact O-CB 3.43Å; L292-T296 PolarHBondContact O-N 2.98Å; L292-T296 PolarHBondContact O-OG1 2.82Å; L293-T296 PolarHBondContact O-N 2.74Å; G294-T296 PolarHBondContact O-N 3.34Å; T296-M298 VanDerWaalsContact C-N 3.26Å; T296-M298 PolarHBondContact O-N 3.48Å; T296-K299 PolarHBondContact O-N 3.34Å; T296-Q300 WeakPolarHBondContact O-CB 3.42Å; T296-Q300 PolarHBondContact O-N 3.49Å
297	L	82.7	Confident	74.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-36.1	172.1	-68.6	170.9	0	0	0	112.3	L199 L208 I212 L293 G294 L326 A327 L330 I353 F354	L199-L297 HydrophobicContact CD1-CD2 4.01Å; L199-L297 HydrophobicContact CD1-CG 4.31Å; L199-L297 HydrophobicContact CD2-CD2 4.44Å; L208-L297 HydrophobicContact CD1-CD2 4.34Å; L208-L297 HydrophobicContact CD2-CD2 4.39Å; I212-L297 HydrophobicContact CD1-CD1 3.79Å; I212-L297 HydrophobicContact CD1-CD2 4.32Å; L293-L297 HydrophobicContact CD1-CD1 4.37Å; L293-L297 HydrophobicContact CD1-CG 4.41Å; L293-L297 HydrophobicContact CG-CD1 4.29Å; L293-L297 WeakPolarHBondContact O-CG 3.47Å; L293-L297 PolarHBondContact O-N 3.46Å; G294-L297 PolarHBondContact O-N 3.3Å; L297-L326 HydrophobicContact CD2-CB 4.4Å; L297-L326 HydrophobicContact CD2-CD2 3.58Å; L297-L326 HydrophobicContact CD2-CG 3.9Å; L297-L326 PolarHBondContact O-N 2.92Å; L297-A327 HydrophobicContact CB-CB 4.31Å; L297-A327 PolarHBondContact O-N 3.39Å; L297-L330 HydrophobicContact CD1-CD1 4.25Å; L297-L330 HydrophobicContact CD2-CD1 4.22Å; L297-I353 HydrophobicContact CD1-CG2 4.17Å; L297-F354 HydrophobicContact CB-CE1 4.5Å; L297-F354 HydrophobicContact CD1-CE1 4.2Å
298	M	77.2	Confident	71.8	Confident	46 Å²	46	47.5 Å²	47.5	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-74	-37.1	177.3	-67.7	175.5	70.6	0	0	112.9	G294 L295 T296 S325 A327 A357 F359 T362	G294-M298 WeakPolarHBondContact O-CG 3.47Å; G294-M298 PolarHBondContact O-N 3.04Å; G294-M298 VanDerWaalsContact O-N 3.12Å; L295-M298 PolarHBondContact O-N 3.44Å; T296-M298 VanDerWaalsContact C-N 3.26Å; T296-M298 PolarHBondContact O-N 3.48Å; M298-S325 VanDerWaalsContact O-CB 3.23Å; M298-S325 WeakPolarHBondContact O-CB 3.45Å; M298-A327 HydrophobicContact CG-CB 4.03Å; M298-A357 HydrophobicContact SD-CB 4.16Å; M298-F359 HydrophobicContact CE-CD2 3.62Å; M298-F359 HydrophobicContact CE-CE2 4.04Å; M298-F359 HydrophobicContact CG-CD2 4.26Å; M298-F359 HydrophobicContact SD-CD2 3.81Å; M298-T362 HydrophobicContact CE-CG2 4.15Å
299	K	77.8	Confident	69.5	Low	98 Å²	98	53.6 Å²	53.6	43%	0.426	28%	0.278	S	S	.	.	H	α-helix	trans	-81	-31.6	-178.1	-70.5	-164.7	-176.6	-169.4	0	113.4	L295 T296 R301 D457	L295-K299 WeakPolarHBondContact O-CG 3.44Å; L295-K299 PolarHBondContact O-N 3.37Å; T296-K299 PolarHBondContact O-N 3.34Å; K299-R301 PolarHBondContact O-N 3.41Å; K299-D457 IonicContact NZ-OD2 2.75Å; K299-D457 PolarHBondContact NZ-OD2 3.11Å
300	Q	77.4	Confident	67.3	Low	33 Å²	33	57.9 Å²	57.9	15%	0.154	30%	0.304	C	S	.	.			trans	-68.3	113.8	-177.9	-159.7	78.4	1.9	0	0	110.5	A196 Q200 T296 S325 L326	A196-Q300 VanDerWaalsContact CB-CD 3.49Å; A196-Q300 PolarHBondContact O-NE2 2.98Å; Q200-Q300 HydrophobicContact CB-CG 4.46Å; T296-Q300 WeakPolarHBondContact O-CB 3.42Å; T296-Q300 PolarHBondContact O-N 3.49Å; Q300-S325 CarbonylContact O-C 3.53Å; Q300-S325 VanDerWaalsContact O-CA 3.29Å; Q300-S325 WeakPolarHBondContact O-CA 3.36Å; Q300-L326 HydrophobicContact CB-CB 4.26Å; Q300-L326 PolarHBondContact O-N 3.38Å
301	R	68.6	Low	65.5	Low	108 Å²	108	63.5 Å²	63.5	41%	0.408	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-104.8	140.4	177.2	-62.9	-169.6	-174.3	-170.4	-1.9	111.8	K299 T303 E321	K299-R301 PolarHBondContact O-N 3.41Å; R301-T303 PolarHBondContact O-N 3.33Å; R301-E321 IonicContact CZ-OE1 2.7Å; R301-E321 IonicContact CZ-OE2 3.78Å; R301-E321 VanDerWaalsContact CZ-OE2 3.26Å; R301-E321 IonicContact NH1-OE1 2.83Å; R301-E321 PolarHBondContact NH1-OE1 3.41Å; R301-E321 IonicContact NH1-OE2 3.93Å; R301-E321 PolarHBondContact NH1-OE2 3.4Å; R301-E321 IonicContact NH2-OE1 3.96Å; R301-E321 PolarHBondContact NH2-OE1 2.87Å; R301-E321 IonicContact NH2-OE2 2.83Å; R301-E321 PolarHBondContact NH2-OE2 2.95Å
302	E	64.2	Low	64.1	Low	4 Å²	4	65 Å²	65	2%	0.019	35%	0.352	C	S	.	.			trans	-86.5	105.5	178.8	-148.3	80.2	-116	0	0	110.4	Q200 Y203 H204 H304 I305 Y323 P324 L329	Q200-E302 PolarHBondContact NE2-OE1 2.97Å; Y203-E302 WeakPolarHBondContact CD1-OE2 3.28Å; Y203-E302 HydrophobicContact CE1-CG 4.2Å; Y203-E302 WeakPolarHBondContact CE1-OE2 3.21Å; H204-E302 IonicContact CD2-OE1 2.99Å; H204-E302 IonicContact CE1-OE1 3.65Å; H204-E302 IonicContact NE2-OE1 3.03Å; H204-E302 PolarHBondContact NE2-OE1 3.21Å; E302-H304 VanDerWaalsContact C-N 3.3Å; E302-H304 PolarHBondContact O-N 3.41Å; E302-I305 HydrophobicContact CB-CD1 3.67Å; E302-I305 HydrophobicContact CB-CG1 4.02Å; E302-I305 HydrophobicContact CG-CD1 3.88Å; E302-I305 HydrophobicContact CG-CG1 3.81Å; E302-Y323 VanDerWaalsContact O-CD1 3.31Å; E302-Y323 WeakPolarHBondContact O-CD1 3.3Å; E302-P324 PolarHBondContact N-O 2.93Å; E302-L329 HydrophobicContact CB-CD1 4.21Å
303	T	58.9	Low	62.7	Low	82 Å²	82	65 Å²	65	50%	0.503	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.2	-177.5	52.8	0	0	0	0	114.2	R301	R301-T303 PolarHBondContact O-N 3.33Å
304	H	55.1	Low	61.5	Low	108 Å²	108	67.3 Å²	67.3	50%	0.5	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	12.4	-169.2	-68.8	-67.2	0	0	0	115.2	M141 E302 D306	M141-H304 HydrophobicContact CE-CB 3.51Å; M141-H304 HydrophobicContact SD-CB 4.32Å; E302-H304 VanDerWaalsContact C-N 3.3Å; E302-H304 PolarHBondContact O-N 3.41Å; H304-D306 PolarHBondContact O-N 2.9Å
305	I	55	Low	60.2	Low	38 Å²	38	67.8 Å²	67.8	20%	0.195	37%	0.365	C	S	.	.	S	Bend	trans	-75.1	119.5	171.1	-61.9	169.2	0	0	0	107.5	E302 V307 P324 L329	E302-I305 HydrophobicContact CB-CD1 3.67Å; E302-I305 HydrophobicContact CB-CG1 4.02Å; E302-I305 HydrophobicContact CG-CD1 3.88Å; E302-I305 HydrophobicContact CG-CG1 3.81Å; I305-V307 WeakPolarHBondContact O-CG2 3.4Å; I305-V307 PolarHBondContact O-N 3.11Å; I305-P324 HydrophobicContact CD1-CG 3.42Å; I305-P324 VanDerWaalsContact CD1-CG 3.42Å; I305-L329 HydrophobicContact CD1-CD1 4.22Å; I305-L329 HydrophobicContact CD1-CD2 4.08Å
306	D	46	Very low	58.8	Low	148 Å²	148	68.8 Å²	68.8	79%	0.791	37%	0.37	S	S	*	.			trans	-60.6	104.3	169.9	-103	-22.4	0	0	0	108.1	H304 C308	H304-D306 PolarHBondContact O-N 2.9Å; D306-C308 PolarHBondContact O-N 3.05Å
307	V	38.9	Very low	57.3	Low	93 Å²	93	75.8 Å²	75.8	56%	0.564	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-1.7	-169.9	178.3	0	0	0	0	113.6	I305 Y323	I305-V307 WeakPolarHBondContact O-CG2 3.4Å; I305-V307 PolarHBondContact O-N 3.11Å; V307-Y323 HydrophobicContact CG2-CD1 4.47Å; V307-Y323 HydrophobicContact CG2-CE1 3.88Å
308	C	35.5	Very low	55.3	Low	122 Å²	122	85.3 Å²	85.3	82%	0.824	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-8	-172.6	-100.7	0	0	0	0	117.2	D306	D306-C308 PolarHBondContact O-N 3.05Å
309	M	38.7	Very low	54.1	Low	173 Å²	173	85.8 Å²	85.8	85%	0.852	44%	0.443	S	S	*	.	S	Bend	trans	-134.1	1.5	-165.4	-75.8	-67.4	-105	0	0	119.2
310	T	42.6	Very low	52.5	Low	101 Å²	101	87.3 Å²	87.3	62%	0.62	47%	0.466	S	S	*	.			trans	-136.9	113.3	176.3	24.5	0	0	0	0	112.8	I312	T310-I312 PolarHBondContact O-N 2.73Å
311	S	50.4	Low	51.2	Low	117 Å²	117	90 Å²	90	82%	0.818	48%	0.479	S	S	*	.			trans	-68.5	96.6	169.8	-38.6	0	0	0	0	108.9	C313	S311-C313 PolarHBondContact O-N 2.91Å
312	I	55.6	Low	50.5	Low	42 Å²	42	91.5 Å²	91.5	22%	0.215	49%	0.494	C	S	.	.			trans	-73.1	116.2	179.4	-58.5	173.5	0	0	0	108.9	T310 R314 P324 L329 H332	T310-I312 PolarHBondContact O-N 2.73Å; I312-R314 HydrophobicContact CG2-CG 4.32Å; I312-R314 PolarHBondContact O-N 3.46Å; I312-R314 VanDerWaalsContact O-N 3.14Å; I312-P324 HydrophobicContact CD1-CB 3.67Å; I312-P324 HydrophobicContact CD1-CG 3.45Å; I312-P324 VanDerWaalsContact CD1-CG 3.45Å; I312-L329 HydrophobicContact CD1-CD2 4.27Å; I312-H332 HydrophobicContact CG2-CB 3.99Å
313	C	56.4	Low	50.4	Low	25 Å²	25	95.8 Å²	95.8	17%	0.169	51%	0.511	C	S	.	.			trans	-66.6	105.9	168.2	-60	0	0	0	0	110.2	S311 H332 L335 I385	S311-C313 PolarHBondContact O-N 2.91Å; C313-H332 PolarHBondContact N-CD2 3.49Å; C313-L335 HydrophobicContact CB-CD1 3.97Å; C313-L335 VanDerWaalsContact O-CD1 3.32Å; C313-L335 WeakPolarHBondContact O-CD1 3.36Å; C313-I385 HydrophobicContact CB-CG2 4.25Å
314	R	60.9	Low	50.9	Low	49 Å²	49	92.2 Å²	92.2	19%	0.185	49%	0.489	C	S	.	.			trans	-92.5	157.8	174.8	-69.3	177.6	165.7	158	-4.5	111.6	I312 D316 I319 E321 E328 R389	I312-R314 HydrophobicContact CG2-CG 4.32Å; I312-R314 PolarHBondContact O-N 3.46Å; I312-R314 VanDerWaalsContact O-N 3.14Å; R314-D316 VanDerWaalsContact C-N 3.26Å; R314-D316 VanDerWaalsContact CB-O 3.31Å; R314-D316 WeakPolarHBondContact CB-O 3.35Å; R314-I319 PolarHBondContact NH1-O 3.35Å; R314-E321 PolarHBondContact NH2-O 2.89Å; R314-E328 IonicContact CZ-OE2 3.9Å; R314-E328 VanDerWaalsContact CZ-OE2 3.27Å; R314-E328 IonicContact NE-OE2 3.09Å; R314-E328 PolarHBondContact NE-OE2 3.46Å; R314-E328 IonicContact NH2-OE2 3.09Å; R314-E328 PolarHBondContact NH2-OE2 3.35Å; R314-R389 VanDerWaalsContact O-CZ 3.23Å; R314-R389 PolarHBondContact O-NE 2.92Å; R314-R389 PolarHBondContact O-NH2 3.39Å
315	L	56.8	Low	52	Low	10 Å²	10	87.4 Å²	87.4	5%	0.052	47%	0.467	C	S	.	.	S	Bend	trans	-68.9	-25	172.8	-91.6	160.2	0	0	0	112.5	I331 F359 L363 R389 I392 L396	L315-I331 HydrophobicContact CB-CG2 4.4Å; L315-I331 HydrophobicContact CD1-CB 4.4Å; L315-I331 HydrophobicContact CD1-CD1 3.78Å; L315-I331 HydrophobicContact CD1-CG1 3.94Å; L315-I331 HydrophobicContact CD1-CG2 3.54Å; L315-I331 HydrophobicContact CG-CG2 3.62Å; L315-F359 HydrophobicContact CD1-CE1 3.85Å; L315-L363 HydrophobicContact CB-CD2 4.14Å; L315-R389 HydrophobicContact CD2-CG 3.81Å; L315-I392 HydrophobicContact CD2-CG2 4.36Å; L315-L396 HydrophobicContact CD1-CD1 4.08Å
316	D	52.8	Low	53.2	Low	47 Å²	47	85.6 Å²	85.6	25%	0.251	46%	0.458	S	S	.	.	S	Bend	trans	-131.6	144	176.3	-135.6	-34.7	0	0	0	111.1	R314 Y318 R393	R314-D316 VanDerWaalsContact C-N 3.26Å; R314-D316 VanDerWaalsContact CB-O 3.31Å; R314-D316 WeakPolarHBondContact CB-O 3.35Å; D316-Y318 VanDerWaalsContact C-N 3.33Å; D316-R393 IonicContact OD2-NH2 3.67Å
317	Q	51.3	Low	54.7	Low	147 Å²	147	78.6 Å²	78.6	69%	0.687	42%	0.421	S	S	*	.	S	Bend	trans	-78.6	-17.5	-175.7	-101.1	175	-15.6	0	0	112.9
318	Y	41.7	Very low	56.5	Low	201 Å²	201	75.4 Å²	75.4	79%	0.788	40%	0.399	S	S	*	.			trans	-107.1	73	-176.7	-82.7	-89.9	0	0	0	112.3	D316	D316-Y318 VanDerWaalsContact C-N 3.33Å
319	I	51.2	Low	58.5	Low	56 Å²	56	70.4 Å²	70.4	29%	0.287	36%	0.364	S	S	.	.			trans	-120.3	105.3	158.7	-59.6	178	0	0	0	106.8	R314 E321	R314-I319 PolarHBondContact NH1-O 3.35Å; I319-E321 HydrophobicContact CG2-CB 4.12Å; I319-E321 HydrophobicContact CG2-CG 4.43Å; I319-E321 PolarHBondContact O-N 2.99Å
320	S	43.6	Very low	60.5	Low	129 Å²	129	62.3 Å²	62.3	90%	0.902	33%	0.325	S	S	*	.			trans	-75.8	15.3	-174	-163.3	0	0	0	0	113.8
321	E	50.6	Low	62.2	Low	91 Å²	91	57.7 Å²	57.7	43%	0.425	30%	0.296	S	S	.	.			trans	-109.1	135.4	-168.9	-60.8	-173	113.1	0	0	112.6	R301 R314 I319 Y323	R301-E321 IonicContact CZ-OE1 2.7Å; R301-E321 IonicContact CZ-OE2 3.78Å; R301-E321 VanDerWaalsContact CZ-OE2 3.26Å; R301-E321 IonicContact NH1-OE1 2.83Å; R301-E321 PolarHBondContact NH1-OE1 3.41Å; R301-E321 IonicContact NH1-OE2 3.93Å; R301-E321 PolarHBondContact NH1-OE2 3.4Å; R301-E321 IonicContact NH2-OE1 3.96Å; R301-E321 PolarHBondContact NH2-OE1 2.87Å; R301-E321 IonicContact NH2-OE2 2.83Å; R301-E321 PolarHBondContact NH2-OE2 2.95Å; R314-E321 PolarHBondContact NH2-O 2.89Å; I319-E321 HydrophobicContact CG2-CB 4.12Å; I319-E321 HydrophobicContact CG2-CG 4.43Å; I319-E321 PolarHBondContact O-N 2.99Å; E321-Y323 PolarHBondContact O-N 3.46Å
322	L	53.3	Low	63.5	Low	138 Å²	138	54 Å²	54	72%	0.723	27%	0.266	S	S	*	.	S	Bend	trans	-69.1	-20.8	-165	-79	142.4	0	0	0	115.5
323	Y	62.1	Low	64.5	Low	95 Å²	95	55.7 Å²	55.7	37%	0.373	27%	0.273	S	S	.	.	S	Bend	trans	-128.4	128.8	-176.3	-61.5	-76.3	0	0	0	110.9	E302 V307 E321	E302-Y323 VanDerWaalsContact O-CD1 3.31Å; E302-Y323 WeakPolarHBondContact O-CD1 3.3Å; V307-Y323 HydrophobicContact CG2-CD1 4.47Å; V307-Y323 HydrophobicContact CG2-CE1 3.88Å; E321-Y323 PolarHBondContact O-N 3.46Å
324	P	70.1	Confident	65.5	Low	6 Å²	6	54.6 Å²	54.6	4%	0.039	27%	0.265	C	S	.	.			trans	-69.7	145.3	179.3	33.6	-39.1	0	0	0	111.2	E302 I305 I312 E328 L329	E302-P324 PolarHBondContact N-O 2.93Å; I305-P324 HydrophobicContact CD1-CG 3.42Å; I305-P324 VanDerWaalsContact CD1-CG 3.42Å; I312-P324 HydrophobicContact CD1-CB 3.67Å; I312-P324 HydrophobicContact CD1-CG 3.45Å; I312-P324 VanDerWaalsContact CD1-CG 3.45Å; P324-E328 WeakPolarHBondContact CA-OE2 3.27Å; P324-E328 HydrophobicContact CB-CB 4.1Å; P324-L329 HydrophobicContact CB-CD2 4.3Å; P324-L329 HydrophobicContact CB-CG 4.18Å; P324-L329 HydrophobicContact CG-CD1 4.31Å; P324-L329 HydrophobicContact CG-CD2 3.97Å; P324-L329 HydrophobicContact CG-CG 4.14Å
325	S	78.5	Confident	66.3	Low	8 Å²	8	52.2 Å²	52.2	6%	0.056	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-73.4	161.6	167.1	61.4	0	0	0	0	111.5	M298 Q300 A327 E328 L329	M298-S325 VanDerWaalsContact O-CB 3.23Å; M298-S325 WeakPolarHBondContact O-CB 3.45Å; Q300-S325 CarbonylContact O-C 3.53Å; Q300-S325 VanDerWaalsContact O-CA 3.29Å; Q300-S325 WeakPolarHBondContact O-CA 3.36Å; S325-A327 PolarHBondContact O-N 3.49Å; S325-E328 WeakPolarHBondContact O-CB 3.37Å; S325-E328 PolarHBondContact O-N 2.9Å; S325-E328 WeakPolarHBondContact OG-CG 3.12Å; S325-E328 PolarHBondContact OG-N 3.01Å; S325-E328 PolarHBondContact OG-OE1 2.85Å; S325-L329 WeakPolarHBondContact O-CG 3.26Å; S325-L329 PolarHBondContact O-N 2.85Å
326	L	79.1	Confident	67.3	Low	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-33	174.6	-168.1	56.9	0	0	0	112.1	L199 Y203 L208 L297 Q300 L329 L330	L199-L326 HydrophobicContact CB-CD2 4.06Å; Y203-L326 HydrophobicContact CD1-CD1 4.17Å; Y203-L326 HydrophobicContact CD2-CD1 3.35Å; Y203-L326 HydrophobicContact CE2-CD1 4Å; Y203-L326 HydrophobicContact CG-CD1 3.43Å; Y203-L326 VanDerWaalsContact CG-CD1 3.43Å; L208-L326 HydrophobicContact CD1-CD2 4.26Å; L208-L326 HydrophobicContact CD2-CD1 3.5Å; L208-L326 VanDerWaalsContact CD2-CD1 3.5Å; L208-L326 HydrophobicContact CD2-CD2 3.61Å; L208-L326 HydrophobicContact CD2-CG 3.48Å; L208-L326 VanDerWaalsContact CD2-CG 3.48Å; L297-L326 HydrophobicContact CD2-CB 4.4Å; L297-L326 HydrophobicContact CD2-CD2 3.58Å; L297-L326 HydrophobicContact CD2-CG 3.9Å; L297-L326 PolarHBondContact O-N 2.92Å; Q300-L326 HydrophobicContact CB-CB 4.26Å; Q300-L326 PolarHBondContact O-N 3.38Å; L326-L329 HydrophobicContact CD1-CD1 4.33Å; L326-L329 PolarHBondContact O-N 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.5Å; L326-L330 PolarHBondContact O-N 3.14Å
327	A	79.1	Confident	68.5	Low	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-44.6	170.6	0	0	0	0	0	112.4	L297 M298 S325 L329 L330 I331 F354	L297-A327 HydrophobicContact CB-CB 4.31Å; L297-A327 PolarHBondContact O-N 3.39Å; M298-A327 HydrophobicContact CG-CB 4.03Å; S325-A327 PolarHBondContact O-N 3.49Å; A327-L329 VanDerWaalsContact C-N 3.3Å; A327-L329 PolarHBondContact O-N 2.99Å; A327-L330 PolarHBondContact O-N 3.19Å; A327-I331 WeakPolarHBondContact O-CD1 3.21Å; A327-I331 VanDerWaalsContact O-CG1 3.28Å; A327-I331 WeakPolarHBondContact O-CG1 3.22Å; A327-I331 PolarHBondContact O-N 3.03Å; A327-F354 HydrophobicContact CB-CE1 3.8Å; A327-F354 HydrophobicContact CB-CZ 3.92Å
328	E	75.1	Confident	69.7	Low	26 Å²	26	53 Å²	53	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-37.7	176.1	-78.6	169.3	-136.4	0	0	112.4	R314 P324 S325 I331 H332	R314-E328 IonicContact CZ-OE2 3.9Å; R314-E328 VanDerWaalsContact CZ-OE2 3.27Å; R314-E328 IonicContact NE-OE2 3.09Å; R314-E328 PolarHBondContact NE-OE2 3.46Å; R314-E328 IonicContact NH2-OE2 3.09Å; R314-E328 PolarHBondContact NH2-OE2 3.35Å; P324-E328 WeakPolarHBondContact CA-OE2 3.27Å; P324-E328 HydrophobicContact CB-CB 4.1Å; S325-E328 WeakPolarHBondContact O-CB 3.37Å; S325-E328 PolarHBondContact O-N 2.9Å; S325-E328 WeakPolarHBondContact OG-CG 3.12Å; S325-E328 PolarHBondContact OG-N 3.01Å; S325-E328 PolarHBondContact OG-OE1 2.85Å; E328-I331 PolarHBondContact O-N 2.79Å; E328-H332 WeakPolarHBondContact O-CB 3.35Å; E328-H332 PolarHBondContact O-N 3.36Å
329	L	78.4	Confident	71.2	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-39.8	177.2	-67.8	163.2	0	0	0	111.6	Y203 E302 I305 I312 P324 S325 L326 A327 H332 E333	Y203-L329 HydrophobicContact CE1-CD1 4.21Å; Y203-L329 HydrophobicContact CE2-CB 4.17Å; Y203-L329 HydrophobicContact CE2-CD1 4.05Å; E302-L329 HydrophobicContact CB-CD1 4.21Å; I305-L329 HydrophobicContact CD1-CD1 4.22Å; I305-L329 HydrophobicContact CD1-CD2 4.08Å; I312-L329 HydrophobicContact CD1-CD2 4.27Å; P324-L329 HydrophobicContact CB-CD2 4.3Å; P324-L329 HydrophobicContact CB-CG 4.18Å; P324-L329 HydrophobicContact CG-CD1 4.31Å; P324-L329 HydrophobicContact CG-CD2 3.97Å; P324-L329 HydrophobicContact CG-CG 4.14Å; S325-L329 WeakPolarHBondContact O-CG 3.26Å; S325-L329 PolarHBondContact O-N 2.85Å; L326-L329 HydrophobicContact CD1-CD1 4.33Å; L326-L329 PolarHBondContact O-N 3.3Å; A327-L329 VanDerWaalsContact C-N 3.3Å; A327-L329 PolarHBondContact O-N 2.99Å; L329-H332 WeakPolarHBondContact O-CB 3.35Å; L329-H332 PolarHBondContact O-N 3.08Å; L329-E333 PolarHBondContact O-N 3.43Å
330	L	79.7	Confident	72.4	Confident	3 Å²	3	50 Å²	50	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-42.2	172.5	-73.9	172	0	0	0	112.1	L208 M209 I212 L297 L326 A327 H332 E333 M334 I350 F354	L208-L330 HydrophobicContact CD2-CD1 3.84Å; L208-L330 HydrophobicContact CD2-CD2 3.82Å; L208-L330 HydrophobicContact CD2-CG 3.87Å; L208-L330 HydrophobicContact CG-CD1 4.4Å; L208-L330 HydrophobicContact CG-CD2 4.2Å; M209-L330 HydrophobicContact CG-CD2 3.63Å; I212-L330 HydrophobicContact CD1-CD1 3.57Å; L297-L330 HydrophobicContact CD1-CD1 4.25Å; L297-L330 HydrophobicContact CD2-CD1 4.22Å; L326-L330 WeakPolarHBondContact O-CG 3.5Å; L326-L330 PolarHBondContact O-N 3.14Å; A327-L330 PolarHBondContact O-N 3.19Å; L330-H332 VanDerWaalsContact C-N 3.29Å; L330-H332 PolarHBondContact O-N 3.34Å; L330-E333 PolarHBondContact O-N 3.47Å; L330-M334 VanDerWaalsContact O-CG 3.27Å; L330-M334 WeakPolarHBondContact O-CG 3.27Å; L330-M334 PolarHBondContact O-N 2.99Å; L330-I350 HydrophobicContact CD2-CD1 4.26Å; L330-F354 HydrophobicContact CB-CZ 4.15Å; L330-F354 HydrophobicContact CD1-CZ 4.18Å
331	I	78.9	Confident	73.7	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-41.5	175.6	-72.7	157.4	0	0	0	110.6	L315 A327 E328 E333 M334 L335 F354 F359	L315-I331 HydrophobicContact CB-CG2 4.4Å; L315-I331 HydrophobicContact CD1-CB 4.4Å; L315-I331 HydrophobicContact CD1-CD1 3.78Å; L315-I331 HydrophobicContact CD1-CG1 3.94Å; L315-I331 HydrophobicContact CD1-CG2 3.54Å; L315-I331 HydrophobicContact CG-CG2 3.62Å; A327-I331 WeakPolarHBondContact O-CD1 3.21Å; A327-I331 VanDerWaalsContact O-CG1 3.28Å; A327-I331 WeakPolarHBondContact O-CG1 3.22Å; A327-I331 PolarHBondContact O-N 3.03Å; E328-I331 PolarHBondContact O-N 2.79Å; I331-E333 VanDerWaalsContact C-N 3.35Å; I331-M334 WeakPolarHBondContact O-CB 3.43Å; I331-M334 PolarHBondContact O-N 3.5Å; I331-L335 HydrophobicContact CG2-CD1 3.88Å; I331-L335 HydrophobicContact CG2-CG 4.37Å; I331-L335 WeakPolarHBondContact O-CB 3.45Å; I331-L335 WeakPolarHBondContact O-CG 2.96Å; I331-L335 PolarHBondContact O-N 3.19Å; I331-F354 HydrophobicContact CD1-CE2 4.2Å; I331-F354 HydrophobicContact CG1-CD2 4.48Å; I331-F354 HydrophobicContact CG1-CE2 3.77Å; I331-F354 HydrophobicContact CG1-CZ 4.42Å; I331-F359 HydrophobicContact CD1-CE1 3.97Å; I331-F359 HydrophobicContact CD1-CE2 4.14Å; I331-F359 HydrophobicContact CD1-CZ 3.52Å
332	H	77.3	Confident	75	Confident	39 Å²	39	55 Å²	55	18%	0.181	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-46.7	175.8	179.8	-108.8	0	0	0	111.6	I312 C313 E328 L329 L330 M334 L335 I336	I312-H332 HydrophobicContact CG2-CB 3.99Å; C313-H332 PolarHBondContact N-CD2 3.49Å; E328-H332 WeakPolarHBondContact O-CB 3.35Å; E328-H332 PolarHBondContact O-N 3.36Å; L329-H332 WeakPolarHBondContact O-CB 3.35Å; L329-H332 PolarHBondContact O-N 3.08Å; L330-H332 VanDerWaalsContact C-N 3.29Å; L330-H332 PolarHBondContact O-N 3.34Å; H332-M334 VanDerWaalsContact C-N 3.31Å; H332-M334 PolarHBondContact O-N 2.9Å; H332-L335 PolarHBondContact O-N 3.47Å; H332-I336 WeakPolarHBondContact CE1-CD1 3.49Å; H332-I336 WeakPolarHBondContact O-CG1 3.47Å; H332-I336 PolarHBondContact O-N 3.29Å
333	E	77.1	Confident	76.3	Confident	79 Å²	79	49.7 Å²	49.7	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-36.2	177.2	-168.7	168.8	-166.3	0	0	112.4	M209 L329 L330 I331 N337	M209-E333 HydrophobicContact CE-CG 4.11Å; M209-E333 WeakPolarHBondContact CE-OE1 3.38Å; M209-E333 WeakPolarHBondContact CE-OE2 3.38Å; M209-E333 HydrophobicContact SD-CG 4.16Å; L329-E333 PolarHBondContact O-N 3.43Å; L330-E333 PolarHBondContact O-N 3.47Å; I331-E333 VanDerWaalsContact C-N 3.35Å; E333-N337 PolarHBondContact O-N 3.13Å
334	M	78.7	Confident	77.3	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-43.5	172.4	-70.3	171.6	73	0	0	112.1	L330 I331 H332 I336 N337 W338 Y347 I350 L351 I392	L330-M334 VanDerWaalsContact O-CG 3.27Å; L330-M334 WeakPolarHBondContact O-CG 3.27Å; L330-M334 PolarHBondContact O-N 2.99Å; I331-M334 WeakPolarHBondContact O-CB 3.43Å; I331-M334 PolarHBondContact O-N 3.5Å; H332-M334 VanDerWaalsContact C-N 3.31Å; H332-M334 PolarHBondContact O-N 2.9Å; M334-I336 VanDerWaalsContact C-N 3.34Å; M334-I336 PolarHBondContact O-N 3.46Å; M334-N337 PolarHBondContact O-N 3.38Å; M334-W338 HydrophobicContact CB-CE3 4.48Å; M334-W338 HydrophobicContact CE-CE3 4.22Å; M334-W338 HydrophobicContact CE-CH2 4.46Å; M334-W338 HydrophobicContact CE-CZ3 3.53Å; M334-W338 VanDerWaalsContact O-CA 3.26Å; M334-W338 WeakPolarHBondContact O-CA 3.41Å; M334-W338 VanDerWaalsContact O-CB 3.28Å; M334-W338 WeakPolarHBondContact O-CB 3.32Å; M334-W338 PolarHBondContact O-N 2.64Å; M334-Y347 HydrophobicContact CB-CE1 4.46Å; M334-Y347 HydrophobicContact CG-CD1 3.57Å; M334-Y347 HydrophobicContact CG-CE1 3.77Å; M334-Y347 HydrophobicContact CG-CG 4.32Å; M334-I350 HydrophobicContact CE-CG2 4.49Å; M334-I350 HydrophobicContact SD-CB 4.19Å; M334-I350 HydrophobicContact SD-CD1 4.42Å; M334-I350 HydrophobicContact SD-CG2 3.6Å; M334-L351 HydrophobicContact CE-CD2 4.01Å; M334-L351 HydrophobicContact CE-CG 3.93Å; M334-I392 HydrophobicContact CB-CD1 4.05Å
335	L	77	Confident	78	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-37.4	-178	-79	166.7	0	0	0	112.8	C313 I331 H332 N388 R389 I392	C313-L335 HydrophobicContact CB-CD1 3.97Å; C313-L335 VanDerWaalsContact O-CD1 3.32Å; C313-L335 WeakPolarHBondContact O-CD1 3.36Å; I331-L335 HydrophobicContact CG2-CD1 3.88Å; I331-L335 HydrophobicContact CG2-CG 4.37Å; I331-L335 WeakPolarHBondContact O-CB 3.45Å; I331-L335 WeakPolarHBondContact O-CG 2.96Å; I331-L335 PolarHBondContact O-N 3.19Å; H332-L335 PolarHBondContact O-N 3.47Å; L335-N388 HydrophobicContact CD2-CB 4.34Å; L335-N388 PolarHBondContact O-ND2 3.17Å; L335-R389 HydrophobicContact CD2-CB 3.79Å; L335-R389 HydrophobicContact CD2-CG 4.3Å; L335-I392 HydrophobicContact CD2-CD1 3.92Å; L335-I392 HydrophobicContact CG-CD1 4.21Å
336	I	76.7	Confident	78.4	Confident	84 Å²	84	55.8 Å²	55.8	43%	0.431	27%	0.274	S	S	.	.	H	α-helix	trans	-69.6	-41.1	-179.7	-66.4	169.1	0	0	0	111.1	H332 M334	H332-I336 WeakPolarHBondContact CE1-CD1 3.49Å; H332-I336 WeakPolarHBondContact O-CG1 3.47Å; H332-I336 PolarHBondContact O-N 3.29Å; M334-I336 VanDerWaalsContact C-N 3.34Å; M334-I336 PolarHBondContact O-N 3.46Å
337	N	78.8	Confident	78.8	Confident	77 Å²	77	56 Å²	56	41%	0.412	28%	0.275	S	S	.	.	H	α-helix	trans	-123	22.7	-167.1	-75.2	-36.5	0	0	0	114.6	E333 M334 Q339 N340 Y347	E333-N337 PolarHBondContact O-N 3.13Å; M334-N337 PolarHBondContact O-N 3.38Å; N337-Q339 VanDerWaalsContact C-N 3.25Å; N337-Q339 PolarHBondContact O-N 3.34Å; N337-Q339 VanDerWaalsContact O-N 3.13Å; N337-N340 VanDerWaalsContact O-CB 3.3Å; N337-N340 WeakPolarHBondContact O-CB 3.3Å; N337-N340 PolarHBondContact O-N 2.92Å; N337-Y347 WeakPolarHBondContact CB-OH 3.39Å; N337-Y347 PolarHBondContact O-OH 3.06Å
338	W	76.4	Confident	79.1	Confident	60 Å²	60	58.6 Å²	58.6	23%	0.227	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-40.9	-175.4	-175.7	-118.1	0	0	0	114.1	M334 N340 Y347 L351 N388 I392	M334-W338 HydrophobicContact CB-CE3 4.48Å; M334-W338 HydrophobicContact CE-CE3 4.22Å; M334-W338 HydrophobicContact CE-CH2 4.46Å; M334-W338 HydrophobicContact CE-CZ3 3.53Å; M334-W338 VanDerWaalsContact O-CA 3.26Å; M334-W338 WeakPolarHBondContact O-CA 3.41Å; M334-W338 VanDerWaalsContact O-CB 3.28Å; M334-W338 WeakPolarHBondContact O-CB 3.32Å; M334-W338 PolarHBondContact O-N 2.64Å; W338-N340 PolarHBondContact O-N 3.28Å; W338-Y347 HydrophobicContact CE3-CD2 4.01Å; W338-Y347 HydrophobicContact CE3-CG 4.32Å; W338-Y347 HydrophobicContact CZ3-CD2 4.18Å; W338-Y347 HydrophobicContact CZ3-CG 4.13Å; W338-L351 HydrophobicContact CH2-CD1 3.76Å; W338-L351 HydrophobicContact CZ3-CD1 4.41Å; W338-N388 HydrophobicContact CB-CB 4.06Å; W338-N388 HydrophobicContact CG-CB 4.4Å; W338-I392 HydrophobicContact CD2-CD1 3.95Å; W338-I392 HydrophobicContact CD2-CG1 3.65Å; W338-I392 HydrophobicContact CE3-CD1 3.71Å; W338-I392 HydrophobicContact CE3-CG1 3.57Å; W338-I392 HydrophobicContact CG-CD1 4.31Å; W338-I392 HydrophobicContact CG-CG1 4.29Å; W338-I392 HydrophobicContact CH2-CG1 4.09Å; W338-I392 HydrophobicContact CZ2-CG1 4.12Å; W338-I392 HydrophobicContact CZ3-CD1 4.28Å; W338-I392 HydrophobicContact CZ3-CG1 3.79Å
339	Q	73.4	Confident	79.8	Confident	126 Å²	126	57.4 Å²	57.4	59%	0.589	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-3.2	-177.2	-65.4	-177.6	-13.1	0	0	114.1	N337 N341	N337-Q339 VanDerWaalsContact C-N 3.25Å; N337-Q339 PolarHBondContact O-N 3.34Å; N337-Q339 VanDerWaalsContact O-N 3.13Å; Q339-N341 PolarHBondContact O-N 3.29Å
340	N	75.9	Confident	80.1	Confident	67 Å²	67	56.6 Å²	56.6	36%	0.358	28%	0.284	S	S	.	.			trans	-80.5	101.4	-179.6	-169.4	-2.7	0	0	0	111.2	N337 W338 K342 N343	N337-N340 VanDerWaalsContact O-CB 3.3Å; N337-N340 WeakPolarHBondContact O-CB 3.3Å; N337-N340 PolarHBondContact O-N 2.92Å; W338-N340 PolarHBondContact O-N 3.28Å; N340-K342 PolarHBondContact O-N 3.45Å; N340-K342 PolarHBondContact OD1-N 2.66Å; N340-N343 PolarHBondContact O-N 3.5Å
341	N	70.9	Confident	80.4	Confident	139 Å²	139	56.9 Å²	56.9	74%	0.743	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-52.8	-24.6	180	-77.4	-9.8	0	0	0	114.5	Q339 N343 S344	Q339-N341 PolarHBondContact O-N 3.29Å; N341-N343 PolarHBondContact O-N 3.42Å; N341-S344 PolarHBondContact O-N 3.14Å; N341-S344 PolarHBondContact O-OG 3.39Å
342	K	78.6	Confident	80.8	Confident	185 Å²	185	57 Å²	57	80%	0.804	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-64.6	-25.3	178.7	-67.4	-174.5	179	-179.1	0	113.4	N340	N340-K342 PolarHBondContact O-N 3.45Å; N340-K342 PolarHBondContact OD1-N 2.66Å
343	N	81.3	Confident	81.2	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.15	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-106	5.6	-178	-71.4	-16.8	0	0	0	113.1	N340 N341 E345 K346 Y347	N340-N343 PolarHBondContact O-N 3.5Å; N341-N343 PolarHBondContact O-N 3.42Å; N343-E345 VanDerWaalsContact C-N 3.3Å; N343-E345 PolarHBondContact O-N 3.45Å; N343-K346 WeakPolarHBondContact O-CB 3.28Å; N343-K346 PolarHBondContact O-N 3.23Å; N343-Y347 HydrophobicContact CB-CD1 4.38Å; N343-Y347 HydrophobicContact CB-CD2 3.99Å; N343-Y347 HydrophobicContact CB-CE1 3.92Å; N343-Y347 HydrophobicContact CB-CE2 3.45Å; N343-Y347 VanDerWaalsContact CB-CE2 3.45Å; N343-Y347 HydrophobicContact CB-CG 4.42Å; N343-Y347 VanDerWaalsContact CB-CZ 3.42Å; N343-Y347 PolarHBondContact ND2-OH 2.91Å; N343-Y347 WeakPolarHBondContact O-CD2 3.45Å; N343-Y347 VanDerWaalsContact O-CG 3.25Å; N343-Y347 PolarHBondContact O-N 2.88Å
344	S	82.8	Confident	81.5	Confident	63 Å²	63	51.5 Å²	51.5	44%	0.441	26%	0.26	S	S	.	.	H	α-helix	trans	-57.4	-41.1	-174.2	67.5	0	0	0	0	112.9	N341 Y347 S348	N341-S344 PolarHBondContact O-N 3.14Å; N341-S344 PolarHBondContact O-OG 3.39Å; S344-Y347 PolarHBondContact O-N 3.46Å; S344-S348 WeakPolarHBondContact O-CB 3.42Å; S344-S348 PolarHBondContact O-N 2.93Å
345	E	84.5	Confident	81.6	Confident	132 Å²	132	52 Å²	52	62%	0.617	27%	0.265	S	S	*	.	H	α-helix	trans	-69.7	-34.1	179.4	-61.3	-171.6	169.4	0	0	112.3	H213 N343 S349	H213-E345 IonicContact CE1-OE2 3.95Å; H213-E345 PolarHBondContact ND1-O 3.36Å; N343-E345 VanDerWaalsContact C-N 3.3Å; N343-E345 PolarHBondContact O-N 3.45Å; E345-S349 PolarHBondContact O-N 3.32Å; E345-S349 VanDerWaalsContact O-N 3.08Å; E345-S349 PolarHBondContact O-OG 3.5Å
346	K	87.5	Confident	81.8	Confident	42 Å²	42	52.6 Å²	52.6	18%	0.183	27%	0.269	C	S	.	.	H	α-helix	trans	-68.2	-46.3	174.7	-60.4	178.3	179.8	-177.5	0	110.4	M209 D210 H213 N343 S348 S349 I350	M209-K346 HydrophobicContact CB-CD 4.38Å; D210-K346 WeakPolarHBondContact OD1-CE 3.49Å; D210-K346 IonicContact OD1-NZ 3.49Å; D210-K346 PolarHBondContact OD1-NZ 3.46Å; D210-K346 IonicContact OD2-NZ 2.64Å; H213-K346 HydrophobicContact CB-CB 4.43Å; H213-K346 HydrophobicContact CB-CG 4.06Å; N343-K346 WeakPolarHBondContact O-CB 3.28Å; N343-K346 PolarHBondContact O-N 3.23Å; K346-S348 VanDerWaalsContact C-N 3.32Å; K346-S348 PolarHBondContact O-N 2.81Å; K346-S349 WeakPolarHBondContact O-CB 3.12Å; K346-S349 PolarHBondContact O-N 2.98Å; K346-S349 VanDerWaalsContact O-N 3.16Å; K346-I350 WeakPolarHBondContact O-CG1 3.34Å; K346-I350 PolarHBondContact O-N 3.46Å
347	Y	87.2	Confident	81.8	Confident	3 Å²	3	49 Å²	49	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-39.6	176.3	-63.9	-24.3	0	0	0	112.1	M209 M334 N337 W338 N343 S344 I350 L351	M209-Y347 HydrophobicContact SD-CE1 3.99Å; M334-Y347 HydrophobicContact CB-CE1 4.46Å; M334-Y347 HydrophobicContact CG-CD1 3.57Å; M334-Y347 HydrophobicContact CG-CE1 3.77Å; M334-Y347 HydrophobicContact CG-CG 4.32Å; N337-Y347 WeakPolarHBondContact CB-OH 3.39Å; N337-Y347 PolarHBondContact O-OH 3.06Å; W338-Y347 HydrophobicContact CE3-CD2 4.01Å; W338-Y347 HydrophobicContact CE3-CG 4.32Å; W338-Y347 HydrophobicContact CZ3-CD2 4.18Å; W338-Y347 HydrophobicContact CZ3-CG 4.13Å; N343-Y347 HydrophobicContact CB-CD1 4.38Å; N343-Y347 HydrophobicContact CB-CD2 3.99Å; N343-Y347 HydrophobicContact CB-CE1 3.92Å; N343-Y347 HydrophobicContact CB-CE2 3.45Å; N343-Y347 VanDerWaalsContact CB-CE2 3.45Å; N343-Y347 HydrophobicContact CB-CG 4.42Å; N343-Y347 VanDerWaalsContact CB-CZ 3.42Å; N343-Y347 PolarHBondContact ND2-OH 2.91Å; N343-Y347 WeakPolarHBondContact O-CD2 3.45Å; N343-Y347 VanDerWaalsContact O-CG 3.25Å; N343-Y347 PolarHBondContact O-N 2.88Å; S344-Y347 PolarHBondContact O-N 3.46Å; Y347-I350 HydrophobicContact CD1-CD1 4.48Å; Y347-I350 PolarHBondContact O-N 3.47Å; Y347-L351 WeakPolarHBondContact O-CB 3.48Å; Y347-L351 WeakPolarHBondContact O-CG 3.22Å; Y347-L351 PolarHBondContact O-N 2.91Å
348	S	85.3	Confident	81.4	Confident	55 Å²	55	48.7 Å²	48.7	39%	0.385	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-43	173.1	-179.8	0	0	0	0	112.3	S344 K346 L351 L352	S344-S348 WeakPolarHBondContact O-CB 3.42Å; S344-S348 PolarHBondContact O-N 2.93Å; K346-S348 VanDerWaalsContact C-N 3.32Å; K346-S348 PolarHBondContact O-N 2.81Å; S348-L351 PolarHBondContact O-N 2.94Å; S348-L352 WeakPolarHBondContact O-CB 3.42Å; S348-L352 PolarHBondContact O-N 3.39Å
349	S	88.7	Confident	80.7	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-42.8	174.9	-69.2	0	0	0	0	112	H213 E345 K346 L352 I353	H213-S349 PolarHBondContact ND1-OG 3.43Å; E345-S349 PolarHBondContact O-N 3.32Å; E345-S349 VanDerWaalsContact O-N 3.08Å; E345-S349 PolarHBondContact O-OG 3.5Å; K346-S349 WeakPolarHBondContact O-CB 3.12Å; K346-S349 PolarHBondContact O-N 2.98Å; K346-S349 VanDerWaalsContact O-N 3.16Å; S349-L352 PolarHBondContact O-N 2.93Å; S349-I353 WeakPolarHBondContact O-CG1 3.44Å; S349-I353 PolarHBondContact O-N 3.23Å; S349-I353 VanDerWaalsContact O-N 3.14Å
350	I	86.2	Confident	79.9	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-46.4	178.2	-66	163.4	0	0	0	111.2	M209 I212 L330 M334 K346 Y347 L352 I353 F354	M209-I350 HydrophobicContact CB-CD1 4.44Å; M209-I350 HydrophobicContact CG-CD1 3.92Å; M209-I350 HydrophobicContact SD-CD1 4.27Å; I212-I350 HydrophobicContact CD1-CG1 4.41Å; I212-I350 HydrophobicContact CG2-CG1 4.08Å; L330-I350 HydrophobicContact CD2-CD1 4.26Å; M334-I350 HydrophobicContact CE-CG2 4.49Å; M334-I350 HydrophobicContact SD-CB 4.19Å; M334-I350 HydrophobicContact SD-CD1 4.42Å; M334-I350 HydrophobicContact SD-CG2 3.6Å; K346-I350 WeakPolarHBondContact O-CG1 3.34Å; K346-I350 PolarHBondContact O-N 3.46Å; Y347-I350 HydrophobicContact CD1-CD1 4.48Å; Y347-I350 PolarHBondContact O-N 3.47Å; I350-L352 VanDerWaalsContact C-N 3.26Å; I350-L352 PolarHBondContact O-N 2.99Å; I350-I353 PolarHBondContact O-N 3.18Å; I350-I353 VanDerWaalsContact O-N 3.16Å; I350-F354 HydrophobicContact CG2-CD2 3.67Å; I350-F354 HydrophobicContact CG2-CE1 4.33Å; I350-F354 HydrophobicContact CG2-CE2 3.22Å; I350-F354 HydrophobicContact CG2-CG 4.39Å; I350-F354 HydrophobicContact CG2-CZ 3.6Å; I350-F354 WeakPolarHBondContact O-CG 3.31Å; I350-F354 PolarHBondContact O-N 3.48Å
351	L	85.1	Confident	78.7	Confident	8 Å²	8	50 Å²	50	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-41.7	175.3	-76.7	175.8	0	0	0	112.2	M334 W338 Y347 S348 F354 A355 I392 A395 L396	M334-L351 HydrophobicContact CE-CD2 4.01Å; M334-L351 HydrophobicContact CE-CG 3.93Å; W338-L351 HydrophobicContact CH2-CD1 3.76Å; W338-L351 HydrophobicContact CZ3-CD1 4.41Å; Y347-L351 WeakPolarHBondContact O-CB 3.48Å; Y347-L351 WeakPolarHBondContact O-CG 3.22Å; Y347-L351 PolarHBondContact O-N 2.91Å; S348-L351 PolarHBondContact O-N 2.94Å; L351-F354 PolarHBondContact O-N 2.85Å; L351-A355 VanDerWaalsContact O-CB 3.3Å; L351-A355 WeakPolarHBondContact O-CB 3.45Å; L351-A355 PolarHBondContact O-N 2.94Å; L351-I392 HydrophobicContact CD2-CG2 4.36Å; L351-A395 HydrophobicContact CD1-CB 3.85Å; L351-A395 HydrophobicContact CD2-CB 4.41Å; L351-L396 HydrophobicContact CD2-CD1 4.43Å; L351-L396 HydrophobicContact CD2-CD2 3.7Å; L351-L396 HydrophobicContact CD2-CG 3.56Å
352	L	86.7	Confident	77.7	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-41	179.4	-170.9	151.4	0	0	0	111.5	S348 S349 I350 S356 F402 W405	S348-L352 WeakPolarHBondContact O-CB 3.42Å; S348-L352 PolarHBondContact O-N 3.39Å; S349-L352 PolarHBondContact O-N 2.93Å; I350-L352 VanDerWaalsContact C-N 3.26Å; I350-L352 PolarHBondContact O-N 2.99Å; L352-S356 PolarHBondContact O-N 2.86Å; L352-S356 PolarHBondContact O-OG 3.44Å; L352-F402 HydrophobicContact CD2-CB 3.67Å; L352-F402 HydrophobicContact CD2-CD2 3.67Å; L352-F402 HydrophobicContact CD2-CG 4.15Å; L352-W405 HydrophobicContact CD1-CB 4.05Å; L352-W405 HydrophobicContact CD1-CG 4.3Å
353	I	87.6	Confident	76.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-44.4	175.7	-64.6	-54.5	0	0	0	111.8	I212 V216 W219 L293 L297 S349 I350 A355 S356 A357	I212-I353 HydrophobicContact CG2-CG1 4.14Å; V216-I353 HydrophobicContact CG2-CD1 3.71Å; V216-I353 HydrophobicContact CG2-CG1 3.83Å; W219-I353 HydrophobicContact CZ3-CD1 3.83Å; L293-I353 HydrophobicContact CB-CG2 4.48Å; L293-I353 HydrophobicContact CD2-CD1 3.95Å; L293-I353 HydrophobicContact CD2-CG1 4.1Å; L293-I353 HydrophobicContact CD2-CG2 4.33Å; L293-I353 HydrophobicContact CG-CG2 4.12Å; L297-I353 HydrophobicContact CD1-CG2 4.17Å; S349-I353 WeakPolarHBondContact O-CG1 3.44Å; S349-I353 PolarHBondContact O-N 3.23Å; S349-I353 VanDerWaalsContact O-N 3.14Å; I350-I353 PolarHBondContact O-N 3.18Å; I350-I353 VanDerWaalsContact O-N 3.16Å; I353-A355 VanDerWaalsContact C-N 3.34Å; I353-A355 PolarHBondContact O-N 3.07Å; I353-S356 WeakPolarHBondContact O-CB 3.47Å; I353-S356 PolarHBondContact O-N 3.28Å; I353-A357 PolarHBondContact O-N 3.31Å; I353-A357 VanDerWaalsContact O-N 3.12Å
354	F	83	Confident	74.1	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-37.2	178.4	-68.3	-21.1	0	0	0	112.5	L297 A327 L330 I331 I350 L351 A357 N358 F359 L396	L297-F354 HydrophobicContact CB-CE1 4.5Å; L297-F354 HydrophobicContact CD1-CE1 4.2Å; A327-F354 HydrophobicContact CB-CE1 3.8Å; A327-F354 HydrophobicContact CB-CZ 3.92Å; L330-F354 HydrophobicContact CB-CZ 4.15Å; L330-F354 HydrophobicContact CD1-CZ 4.18Å; I331-F354 HydrophobicContact CD1-CE2 4.2Å; I331-F354 HydrophobicContact CG1-CD2 4.48Å; I331-F354 HydrophobicContact CG1-CE2 3.77Å; I331-F354 HydrophobicContact CG1-CZ 4.42Å; I350-F354 HydrophobicContact CG2-CD2 3.67Å; I350-F354 HydrophobicContact CG2-CE1 4.33Å; I350-F354 HydrophobicContact CG2-CE2 3.22Å; I350-F354 HydrophobicContact CG2-CG 4.39Å; I350-F354 HydrophobicContact CG2-CZ 3.6Å; I350-F354 WeakPolarHBondContact O-CG 3.31Å; I350-F354 PolarHBondContact O-N 3.48Å; L351-F354 PolarHBondContact O-N 2.85Å; F354-A357 PolarHBondContact O-N 3.28Å; F354-N358 PolarHBondContact O-N 3.35Å; F354-F359 HydrophobicContact CB-CB 4.1Å; F354-F359 HydrophobicContact CB-CG 4.49Å; F354-F359 VanDerWaalsContact O-CB 3.29Å; F354-F359 WeakPolarHBondContact O-CB 3.22Å; F354-F359 PolarHBondContact O-N 2.84Å; F354-F359 VanDerWaalsContact O-N 3.13Å; F354-L396 HydrophobicContact CB-CD2 3.74Å
355	A	80.7	Confident	71.8	Confident	13 Å²	13	45.4 Å²	45.4	11%	0.107	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-40.2	171.7	0	0	0	0	0	112	L351 I353 A357 N358 N399	L351-A355 VanDerWaalsContact O-CB 3.3Å; L351-A355 WeakPolarHBondContact O-CB 3.45Å; L351-A355 PolarHBondContact O-N 2.94Å; I353-A355 VanDerWaalsContact C-N 3.34Å; I353-A355 PolarHBondContact O-N 3.07Å; A355-A357 PolarHBondContact O-N 3.2Å; A355-N358 PolarHBondContact O-N 3.05Å; A355-N358 VanDerWaalsContact O-N 3.14Å; A355-N399 HydrophobicContact CB-CB 3.82Å; A355-N399 WeakPolarHBondContact CB-O 3.29Å
356	S	80.1	Confident	69.4	Low	12 Å²	12	46.9 Å²	46.9	8%	0.084	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-27	173.3	-70.5	0	0	0	0	114	S290 L352 I353 F402	S290-S356 WeakPolarHBondContact OG-CB 3.32Å; S290-S356 PolarHBondContact OG-OG 3.37Å; S290-S356 VanDerWaalsContact OG-OG 3.08Å; L352-S356 PolarHBondContact O-N 2.86Å; L352-S356 PolarHBondContact O-OG 3.44Å; I353-S356 WeakPolarHBondContact O-CB 3.47Å; I353-S356 PolarHBondContact O-N 3.28Å; S356-F402 WeakPolarHBondContact OG-CB 3.22Å; S356-F402 PolarHBondContact OG-N 3.41Å
357	A	77.6	Confident	66.6	Low	7 Å²	7	53.6 Å²	53.6	6%	0.058	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	6.4	178.7	0	0	0	0	0	114	L295 M298 I353 F354 A355 F359	L295-A357 HydrophobicContact CD2-CB 4.35Å; L295-A357 HydrophobicContact CG-CB 4.4Å; M298-A357 HydrophobicContact SD-CB 4.16Å; I353-A357 PolarHBondContact O-N 3.31Å; I353-A357 VanDerWaalsContact O-N 3.12Å; F354-A357 PolarHBondContact O-N 3.28Å; A355-A357 PolarHBondContact O-N 3.2Å; A357-F359 VanDerWaalsContact C-N 3.3Å; A357-F359 PolarHBondContact O-N 3.37Å
358	N	69.8	Low	63.8	Low	71 Å²	71	61.2 Å²	61.2	38%	0.38	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	38.9	-174.4	-69.7	-14	0	0	0	114	F354 A355 K360 E361 F450	F354-N358 PolarHBondContact O-N 3.35Å; A355-N358 PolarHBondContact O-N 3.05Å; A355-N358 VanDerWaalsContact O-N 3.14Å; N358-K360 PolarHBondContact O-N 2.98Å; N358-E361 PolarHBondContact O-N 2.84Å; N358-F450 WeakPolarHBondContact ND2-CE1 3.29Å
359	F	62.2	Low	61	Low	22 Å²	22	66 Å²	66	10%	0.096	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.6	174.9	-166	-93.8	0	0	0	113.5	M298 L315 I331 F354 A357 T362 L363 L396	M298-F359 HydrophobicContact CE-CD2 3.62Å; M298-F359 HydrophobicContact CE-CE2 4.04Å; M298-F359 HydrophobicContact CG-CD2 4.26Å; M298-F359 HydrophobicContact SD-CD2 3.81Å; L315-F359 HydrophobicContact CD1-CE1 3.85Å; I331-F359 HydrophobicContact CD1-CE1 3.97Å; I331-F359 HydrophobicContact CD1-CE2 4.14Å; I331-F359 HydrophobicContact CD1-CZ 3.52Å; F354-F359 HydrophobicContact CB-CB 4.1Å; F354-F359 HydrophobicContact CB-CG 4.49Å; F354-F359 VanDerWaalsContact O-CB 3.29Å; F354-F359 WeakPolarHBondContact O-CB 3.22Å; F354-F359 PolarHBondContact O-N 2.84Å; F354-F359 VanDerWaalsContact O-N 3.13Å; A357-F359 VanDerWaalsContact C-N 3.3Å; A357-F359 PolarHBondContact O-N 3.37Å; F359-T362 PolarHBondContact O-OG1 2.9Å; F359-L363 HydrophobicContact CD1-CD1 3.93Å; F359-L363 HydrophobicContact CD1-CG 4.36Å; F359-L363 HydrophobicContact CE1-CD1 4Å; F359-L363 HydrophobicContact CE1-CD2 4.29Å; F359-L363 HydrophobicContact CE1-CG 4.18Å; F359-L396 HydrophobicContact CD1-CD1 4.24Å
360	K	56.9	Low	58.5	Low	120 Å²	120	72.4 Å²	72.4	52%	0.522	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-36.5	174.8	-172.7	178.5	176.5	180	0	113.3	N358 T362 L363 I397	N358-K360 PolarHBondContact O-N 2.98Å; K360-T362 VanDerWaalsContact C-N 3.32Å; K360-T362 PolarHBondContact O-N 3.42Å; K360-L363 PolarHBondContact O-N 3.15Å; K360-I397 HydrophobicContact CD-CG1 4.37Å; K360-I397 HydrophobicContact CG-CG1 4.41Å
361	E	50.3	Low	55.7	Low	139 Å²	139	79.6 Å²	79.6	65%	0.65	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-24.8	-178.2	-78.5	-178.9	162.6	0	0	112.8	N358 L363	N358-E361 PolarHBondContact O-N 2.84Å; E361-L363 PolarHBondContact O-N 3.47Å
362	T	50.8	Low	53	Low	85 Å²	85	85.1 Å²	85.1	52%	0.521	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-7	172.1	40.5	0	0	0	0	113.7	M298 F359 K360	M298-T362 HydrophobicContact CE-CG2 4.15Å; F359-T362 PolarHBondContact O-OG1 2.9Å; K360-T362 VanDerWaalsContact C-N 3.32Å; K360-T362 PolarHBondContact O-N 3.42Å
363	L	47.5	Very low	50.1	Low	21 Å²	21	89.2 Å²	89.2	11%	0.11	49%	0.487	C	S	.	.	S	Bend	trans	-105.9	72.4	-179.1	-67.7	167.8	0	0	0	109.9	L315 F359 K360 E361	L315-L363 HydrophobicContact CB-CD2 4.14Å; F359-L363 HydrophobicContact CD1-CD1 3.93Å; F359-L363 HydrophobicContact CD1-CG 4.36Å; F359-L363 HydrophobicContact CE1-CD1 4Å; F359-L363 HydrophobicContact CE1-CD2 4.29Å; F359-L363 HydrophobicContact CE1-CG 4.18Å; K360-L363 PolarHBondContact O-N 3.15Å; E361-L363 PolarHBondContact O-N 3.47Å
364	T	36.1	Very low	47.3	Very low	92 Å²	92	94.5 Å²	94.5	56%	0.564	52%	0.524	S	S	*	.			trans	-55.7	135.6	174	44.6	0	0	0	0	110.6	Q366	T364-Q366 PolarHBondContact O-N 2.87Å
365	P	33.5	Very low	44.7	Very low	120 Å²	120	100.1 Å²	100.1	78%	0.779	56%	0.564	S	S	*	*			trans	-76.9	102.8	172.1	29.9	-28	0	0	0	107.9
366	Q	34.9	Very low	42.3	Very low	163 Å²	163	107.1 Å²	107.1	76%	0.762	60%	0.597	S	S	*	*			trans	-95.8	126.5	157.8	-81.9	-153.3	-29.1	0	0	109.5	T364	T364-Q366 PolarHBondContact O-N 2.87Å
367	E	28.3	Very low	40	Very low	184 Å²	184	113.6 Å²	113.6	86%	0.86	63%	0.631	S	S	*	*			trans	-50.8	139.7	175.4	-67.1	174.2	146.2	0	0	111	N369	E367-N369 PolarHBondContact O-N 3.39Å
368	N	29.2	Very low	38.1	Very low	163 Å²	163	119 Å²	119	87%	0.872	66%	0.659	S	S	*	*			trans	-47.8	102.1	174.1	-62.5	-41	0	0	0	111.3
369	N	26.3	Very low	36.7	Very low	156 Å²	156	119 Å²	119	83%	0.834	67%	0.669	S	S	*	*			trans	-141	83.8	158.4	-93	-23	0	0	0	107.6	E367	E367-N369 PolarHBondContact O-N 3.39Å
370	I	34.7	Very low	36	Very low	134 Å²	134	125.2 Å²	125.2	69%	0.687	70%	0.702	S	S	*	*			trans	-117.9	104.3	161.2	-63.4	177	0	0	0	106.3	S372	I370-S372 PolarHBondContact O-N 3.03Å
371	D	27.5	Very low	35.8	Very low	152 Å²	152	122.4 Å²	122.4	81%	0.813	70%	0.697	S	S	*	*			trans	-54.4	115.5	160.9	-81.8	-41.2	0	0	0	108.8	S373	D371-S373 PolarHBondContact O-N 2.96Å
372	S	28.4	Very low	36	Very low	124 Å²	124	120.8 Å²	120.8	87%	0.867	69%	0.689	S	S	*	*			trans	-70	90.6	167.4	55.5	0	0	0	0	109.2	I370	I370-S372 PolarHBondContact O-N 3.03Å
373	S	27	Very low	36.5	Very low	94 Å²	94	121.6 Å²	121.6	66%	0.657	69%	0.691	S	S	*	*			trans	-129.9	112.7	164.7	64.4	0	0	0	0	112.2	D371	D371-S373 PolarHBondContact O-N 2.96Å
374	S	27.6	Very low	37.7	Very low	110 Å²	110	125 Å²	125	77%	0.769	71%	0.706	S	S	*	*			trans	63.4	99	148.8	63.2	0	0	0	0	119.7
375	S	29.5	Very low	39.3	Very low	121 Å²	121	122 Å²	122	85%	0.846	69%	0.686	S	S	*	*				-169.4	123.1	104.6	40.2	0	0	0	0	110.1	D377	S375-D377 PolarHBondContact O-N 3.39Å
376	I	30.5	Very low	41.1	Very low	159 Å²	159	119.8 Å²	119.8	82%	0.815	67%	0.668	S	S	*	*			trans	-77.1	113.6	176.8	-65.9	162	0	0	0	105.7
377	D	31.8	Very low	42.9	Very low	148 Å²	148	117 Å²	117	79%	0.791	66%	0.658	S	S	*	*	S	Bend	trans	172	0.9	144.9	-84.7	-16.8	0	0	0	115.5	S375	S375-D377 PolarHBondContact O-N 3.39Å
378	N	36.7	Very low	45.4	Very low	121 Å²	121	108.5 Å²	108.5	65%	0.647	62%	0.618	S	S	*	*			trans	-128.6	37.5	176	-82.3	-23.1	0	0	0	115	I380	N378-I380 PolarHBondContact O-N 2.96Å
379	A	39.9	Very low	47.6	Very low	71 Å²	71	103.3 Å²	103.3	59%	0.587	59%	0.587	S	S	*	*	H	α-helix	trans	-72.4	-18.2	-165	0	0	0	0	0	116.9	N383	A379-N383 PolarHBondContact O-ND2 3.4Å
380	I	47.9	Very low	49.9	Very low	152 Å²	152	98.2 Å²	98.2	78%	0.779	57%	0.566	S	S	*	*	H	α-helix	trans	-87.1	-36.6	-173	-56.6	174.6	0	0	0	112.2	N378	N378-I380 PolarHBondContact O-N 2.96Å
381	S	52.6	Low	52.1	Low	61 Å²	61	95.7 Å²	95.7	43%	0.427	55%	0.554	S	S	.	*	H	α-helix	trans	-76.9	-35.3	179.9	54.7	0	0	0	0	113	N383 I385	S381-N383 PolarHBondContact O-N 3.27Å; S381-I385 WeakPolarHBondContact O-CG1 3.04Å; S381-I385 PolarHBondContact O-N 2.76Å
382	H	56.2	Low	54.6	Low	105 Å²	105	88.6 Å²	88.6	49%	0.486	52%	0.516	S	S	.	.	H	α-helix	trans	-68.4	-33.5	-178.6	-90.6	-68	0	0	0	113.7	N386	H382-N386 WeakPolarHBondContact O-CB 3.5Å; H382-N386 PolarHBondContact O-N 2.97Å; H382-N386 VanDerWaalsContact O-N 3.08Å
383	N	60.8	Low	56.8	Low	103 Å²	103	85.6 Å²	85.6	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-67.5	-46.1	177.7	-74.7	-11.3	0	0	0	111.5	A379 S381 I385 N386 D387	A379-N383 PolarHBondContact O-ND2 3.4Å; S381-N383 PolarHBondContact O-N 3.27Å; N383-I385 VanDerWaalsContact C-N 3.33Å; N383-I385 PolarHBondContact O-N 3.29Å; N383-N386 PolarHBondContact O-N 2.88Å; N383-N386 VanDerWaalsContact O-N 3.16Å; N383-D387 PolarHBondContact O-N 3.41Å
384	Q	71.8	Confident	59.3	Low	93 Å²	93	85.7 Å²	85.7	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-64.2	-36.7	179.3	-165.4	171.9	10.3	0	0	112.4	N388	Q384-N388 WeakPolarHBondContact O-CB 2.88Å; Q384-N388 PolarHBondContact O-N 3.39Å; Q384-N388 PolarHBondContact O-ND2 2.96Å
385	I	69.2	Low	61.8	Low	28 Å²	28	81.4 Å²	81.4	14%	0.144	45%	0.451	C	S	.	.	H	α-helix	trans	-67.8	-37.6	175.2	-67.6	168.3	0	0	0	111.3	C313 S381 N383 R389	C313-I385 HydrophobicContact CB-CG2 4.25Å; S381-I385 WeakPolarHBondContact O-CG1 3.04Å; S381-I385 PolarHBondContact O-N 2.76Å; N383-I385 VanDerWaalsContact C-N 3.33Å; N383-I385 PolarHBondContact O-N 3.29Å; I385-R389 WeakPolarHBondContact O-CB 3.44Å; I385-R389 PolarHBondContact O-N 2.87Å
386	N	71.4	Confident	64	Low	74 Å²	74	76 Å²	76	40%	0.396	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-40.5	176.4	-81.6	-11.4	0	0	0	112.4	H382 N383 R389 A390	H382-N386 WeakPolarHBondContact O-CB 3.5Å; H382-N386 PolarHBondContact O-N 2.97Å; H382-N386 VanDerWaalsContact O-N 3.08Å; N383-N386 PolarHBondContact O-N 2.88Å; N383-N386 VanDerWaalsContact O-N 3.16Å; N386-R389 WeakPolarHBondContact O-CB 3.45Å; N386-R389 PolarHBondContact O-N 3.38Å; N386-R389 PolarHBondContact OD1-NH1 3.42Å; N386-A390 PolarHBondContact O-N 3.05Å; N386-A390 VanDerWaalsContact O-N 3.11Å
387	D	73.8	Confident	66.1	Low	105 Å²	105	72.2 Å²	72.2	56%	0.561	39%	0.392	S	S	*	.	H	α-helix	trans	-62.6	-48.3	174.2	-67.1	-21	0	0	0	110.6	N383 R389 A390 D391	N383-D387 PolarHBondContact O-N 3.41Å; D387-R389 PolarHBondContact O-N 2.7Å; D387-A390 PolarHBondContact O-N 2.69Å; D387-A390 VanDerWaalsContact O-N 3.13Å; D387-D391 PolarHBondContact O-N 2.91Å
388	N	80	Confident	68.3	Low	4 Å²	4	69.3 Å²	69.3	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-58.1	-35.6	174.2	-69.2	-16.3	0	0	0	111.8	L335 W338 Q384 D391 I392	L335-N388 HydrophobicContact CD2-CB 4.34Å; L335-N388 PolarHBondContact O-ND2 3.17Å; W338-N388 HydrophobicContact CB-CB 4.06Å; W338-N388 HydrophobicContact CG-CB 4.4Å; Q384-N388 WeakPolarHBondContact O-CB 2.88Å; Q384-N388 PolarHBondContact O-N 3.39Å; Q384-N388 PolarHBondContact O-ND2 2.96Å; N388-D391 PolarHBondContact O-N 2.93Å; N388-I392 WeakPolarHBondContact O-CB 3.29Å; N388-I392 WeakPolarHBondContact O-CD1 3.41Å; N388-I392 WeakPolarHBondContact O-CG1 3.43Å; N388-I392 PolarHBondContact O-N 3.49Å
389	R	76	Confident	70.3	Confident	54 Å²	54	66.2 Å²	66.2	20%	0.204	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-44.4	177.3	-169	-173	-84.8	130.9	-2.7	111.5	R314 L315 L335 I385 N386 D387 R393	R314-R389 VanDerWaalsContact O-CZ 3.23Å; R314-R389 PolarHBondContact O-NE 2.92Å; R314-R389 PolarHBondContact O-NH2 3.39Å; L315-R389 HydrophobicContact CD2-CG 3.81Å; L335-R389 HydrophobicContact CD2-CB 3.79Å; L335-R389 HydrophobicContact CD2-CG 4.3Å; I385-R389 WeakPolarHBondContact O-CB 3.44Å; I385-R389 PolarHBondContact O-N 2.87Å; N386-R389 WeakPolarHBondContact O-CB 3.45Å; N386-R389 PolarHBondContact O-N 3.38Å; N386-R389 PolarHBondContact OD1-NH1 3.42Å; D387-R389 PolarHBondContact O-N 2.7Å; R389-R393 WeakPolarHBondContact O-CB 3.38Å; R389-R393 PolarHBondContact O-N 3.37Å
390	A	74.5	Confident	72.1	Confident	49 Å²	49	66.1 Å²	66.1	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-45	176.8	0	0	0	0	0	111.4	N386 D387 R393 N394	N386-A390 PolarHBondContact O-N 3.05Å; N386-A390 VanDerWaalsContact O-N 3.11Å; D387-A390 PolarHBondContact O-N 2.69Å; D387-A390 VanDerWaalsContact O-N 3.13Å; A390-R393 PolarHBondContact O-N 2.8Å; A390-N394 WeakPolarHBondContact O-CB 3.45Å; A390-N394 VanDerWaalsContact O-CG 3.25Å; A390-N394 PolarHBondContact O-N 2.66Å; A390-N394 PolarHBondContact O-ND2 3.22Å
391	D	80.6	Confident	73.9	Confident	82 Å²	82	59.1 Å²	59.1	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-46.4	178.9	-74.9	-15.5	0	0	0	112.4	D387 N388 R393 N394 A395	D387-D391 PolarHBondContact O-N 2.91Å; N388-D391 PolarHBondContact O-N 2.93Å; D391-R393 VanDerWaalsContact C-N 3.34Å; D391-R393 PolarHBondContact O-N 3.15Å; D391-N394 PolarHBondContact O-N 3.08Å; D391-A395 WeakPolarHBondContact O-CB 3.11Å; D391-A395 PolarHBondContact O-N 3.48Å
392	I	79.9	Confident	75.5	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-40.5	177.2	-68.9	168.2	0	0	0	110.7	L315 M334 L335 W338 L351 N388 A395 L396	L315-I392 HydrophobicContact CD2-CG2 4.36Å; M334-I392 HydrophobicContact CB-CD1 4.05Å; L335-I392 HydrophobicContact CD2-CD1 3.92Å; L335-I392 HydrophobicContact CG-CD1 4.21Å; W338-I392 HydrophobicContact CD2-CD1 3.95Å; W338-I392 HydrophobicContact CD2-CG1 3.65Å; W338-I392 HydrophobicContact CE3-CD1 3.71Å; W338-I392 HydrophobicContact CE3-CG1 3.57Å; W338-I392 HydrophobicContact CG-CD1 4.31Å; W338-I392 HydrophobicContact CG-CG1 4.29Å; W338-I392 HydrophobicContact CH2-CG1 4.09Å; W338-I392 HydrophobicContact CZ2-CG1 4.12Å; W338-I392 HydrophobicContact CZ3-CD1 4.28Å; W338-I392 HydrophobicContact CZ3-CG1 3.79Å; L351-I392 HydrophobicContact CD2-CG2 4.36Å; N388-I392 WeakPolarHBondContact O-CB 3.29Å; N388-I392 WeakPolarHBondContact O-CD1 3.41Å; N388-I392 WeakPolarHBondContact O-CG1 3.43Å; N388-I392 PolarHBondContact O-N 3.49Å; I392-A395 PolarHBondContact O-N 3.3Å; I392-L396 HydrophobicContact CG2-CD1 4.01Å; I392-L396 WeakPolarHBondContact O-CB 3.35Å; I392-L396 WeakPolarHBondContact O-CG 3.38Å; I392-L396 PolarHBondContact O-N 3.21Å
393	R	75.6	Confident	77	Confident	61 Å²	61	52.8 Å²	52.8	23%	0.23	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-45.1	177	-163	-178.8	-161.6	122.1	-2.7	111	D316 R389 A390 D391 L396 I397	D316-R393 IonicContact OD2-NH2 3.67Å; R389-R393 WeakPolarHBondContact O-CB 3.38Å; R389-R393 PolarHBondContact O-N 3.37Å; A390-R393 PolarHBondContact O-N 2.8Å; D391-R393 VanDerWaalsContact C-N 3.34Å; D391-R393 PolarHBondContact O-N 3.15Å; R393-L396 PolarHBondContact O-N 3.06Å; R393-I397 HydrophobicContact CG-CD1 4.12Å; R393-I397 VanDerWaalsContact O-CG1 3.23Å; R393-I397 WeakPolarHBondContact O-CG1 3.22Å; R393-I397 PolarHBondContact O-N 3.05Å
394	N	78.1	Confident	78.2	Confident	96 Å²	96	48 Å²	48	51%	0.513	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-43.1	176	-69.9	-25.9	0	0	0	111.4	A390 D391 L396 I397 S398	A390-N394 WeakPolarHBondContact O-CB 3.45Å; A390-N394 VanDerWaalsContact O-CG 3.25Å; A390-N394 PolarHBondContact O-N 2.66Å; A390-N394 PolarHBondContact O-ND2 3.22Å; D391-N394 PolarHBondContact O-N 3.08Å; N394-L396 PolarHBondContact O-N 3.09Å; N394-I397 PolarHBondContact O-N 3.41Å; N394-S398 WeakPolarHBondContact O-CB 3.49Å; N394-S398 PolarHBondContact O-N 3.13Å; N394-S398 PolarHBondContact O-OG 2.94Å
395	A	80.5	Confident	79.2	Confident	21 Å²	21	46.1 Å²	46.1	17%	0.174	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-44.2	175.6	0	0	0	0	0	111.6	L351 D391 I392 S398 N399	L351-A395 HydrophobicContact CD1-CB 3.85Å; L351-A395 HydrophobicContact CD2-CB 4.41Å; D391-A395 WeakPolarHBondContact O-CB 3.11Å; D391-A395 PolarHBondContact O-N 3.48Å; I392-A395 PolarHBondContact O-N 3.3Å; A395-S398 PolarHBondContact O-N 3.46Å; A395-S398 PolarHBondContact O-OG 2.97Å; A395-N399 WeakPolarHBondContact O-CB 3.36Å; A395-N399 PolarHBondContact O-N 3.02Å; A395-N399 PolarHBondContact O-ND2 3.39Å
396	L	76.3	Confident	80.2	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-44	174.7	-80.8	162.6	0	0	0	112.2	L315 L351 F354 F359 I392 R393 N394 S398 N399	L315-L396 HydrophobicContact CD1-CD1 4.08Å; L351-L396 HydrophobicContact CD2-CD1 4.43Å; L351-L396 HydrophobicContact CD2-CD2 3.7Å; L351-L396 HydrophobicContact CD2-CG 3.56Å; F354-L396 HydrophobicContact CB-CD2 3.74Å; F359-L396 HydrophobicContact CD1-CD1 4.24Å; I392-L396 HydrophobicContact CG2-CD1 4.01Å; I392-L396 WeakPolarHBondContact O-CB 3.35Å; I392-L396 WeakPolarHBondContact O-CG 3.38Å; I392-L396 PolarHBondContact O-N 3.21Å; R393-L396 PolarHBondContact O-N 3.06Å; N394-L396 PolarHBondContact O-N 3.09Å; L396-S398 VanDerWaalsContact C-N 3.29Å; L396-S398 PolarHBondContact O-N 2.95Å; L396-N399 PolarHBondContact O-N 3.39Å
397	I	73.7	Confident	81.1	Confident	79 Å²	79	41.2 Å²	41.2	41%	0.405	22%	0.223	S	C	.	.	H	α-helix	trans	-64.7	-36.3	-179.7	-71.1	166.8	0	0	0	111.6	K360 R393 N394	K360-I397 HydrophobicContact CD-CG1 4.37Å; K360-I397 HydrophobicContact CG-CG1 4.41Å; R393-I397 HydrophobicContact CG-CD1 4.12Å; R393-I397 VanDerWaalsContact O-CG1 3.23Å; R393-I397 WeakPolarHBondContact O-CG1 3.22Å; R393-I397 PolarHBondContact O-N 3.05Å; N394-I397 PolarHBondContact O-N 3.41Å
398	S	78	Confident	81.8	Confident	87 Å²	87	38.7 Å²	38.7	61%	0.608	21%	0.209	S	C	*	.	H	α-helix	trans	-79.8	-21.5	179.4	69.6	0	0	0	0	114	N394 A395 L396	N394-S398 WeakPolarHBondContact O-CB 3.49Å; N394-S398 PolarHBondContact O-N 3.13Å; N394-S398 PolarHBondContact O-OG 2.94Å; A395-S398 PolarHBondContact O-N 3.46Å; A395-S398 PolarHBondContact O-OG 2.97Å; L396-S398 VanDerWaalsContact C-N 3.29Å; L396-S398 PolarHBondContact O-N 2.95Å
399	N	79.6	Confident	82.3	Confident	56 Å²	56	41.5 Å²	41.5	30%	0.299	22%	0.222	S	C	.	.			trans	-81.4	121.7	-179.8	-89.4	-67.7	0	0	0	110.5	A355 A395 L396 G401	A355-N399 HydrophobicContact CB-CB 3.82Å; A355-N399 WeakPolarHBondContact CB-O 3.29Å; A395-N399 WeakPolarHBondContact O-CB 3.36Å; A395-N399 PolarHBondContact O-N 3.02Å; A395-N399 PolarHBondContact O-ND2 3.39Å; L396-N399 PolarHBondContact O-N 3.39Å; N399-G401 PolarHBondContact O-N 3.02Å
400	E	78.1	Confident	83	Confident	70 Å²	70	39.2 Å²	39.2	33%	0.327	21%	0.214	S	C	.	.			trans	-88.8	20	176	-66.4	172.1	138.2	0	0	112.1	G404 S479 C480 R483	E400-G404 PolarHBondContact O-N 3.18Å; E400-S479 PolarHBondContact OE1-OG 3.03Å; E400-C480 PolarHBondContact OE1-N 2.91Å; E400-C480 VanDerWaalsContact OE2-CB 3.28Å; E400-C480 WeakPolarHBondContact OE2-CB 3.42Å; E400-R483 IonicContact OE2-NH2 3.89Å
401	G	84.6	Confident	83.7	Confident	4 Å²	4	37.9 Å²	37.9	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	65.8	-161.6	179.1	0	0	0	0	0	114.7	N399 L403 G404 W405	N399-G401 PolarHBondContact O-N 3.02Å; G401-L403 PolarHBondContact O-N 2.9Å; G401-G404 PolarHBondContact O-N 2.97Å; G401-W405 PolarHBondContact O-N 3.44Å
402	F	87.4	Confident	84.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-32.8	176.2	-164.2	-85.9	0	0	0	111.7	W219 K220 L286 I287 S290 L352 S356 W405 A406	W219-F402 HydrophobicContact CB-CE2 3.91Å; W219-F402 HydrophobicContact CB-CZ 4.13Å; K220-F402 HydrophobicContact CG-CE2 4.49Å; L286-F402 HydrophobicContact CB-CD1 4.18Å; L286-F402 HydrophobicContact CB-CE1 3.45Å; L286-F402 VanDerWaalsContact CB-CE1 3.45Å; L286-F402 HydrophobicContact CB-CZ 3.8Å; L286-F402 HydrophobicContact CD1-CE1 4.1Å; L286-F402 HydrophobicContact CD1-CZ 3.92Å; L286-F402 HydrophobicContact CG-CE1 4.43Å; L286-F402 HydrophobicContact CG-CZ 4.45Å; I287-F402 HydrophobicContact CG1-CD1 3.98Å; S290-F402 WeakPolarHBondContact OG-CB 3.13Å; L352-F402 HydrophobicContact CD2-CB 3.67Å; L352-F402 HydrophobicContact CD2-CD2 3.67Å; L352-F402 HydrophobicContact CD2-CG 4.15Å; S356-F402 WeakPolarHBondContact OG-CB 3.22Å; S356-F402 PolarHBondContact OG-N 3.41Å; F402-W405 HydrophobicContact CE1-CE3 4.44Å; F402-W405 HydrophobicContact CE1-CZ3 4.48Å; F402-W405 HydrophobicContact CE2-CE3 4.08Å; F402-W405 HydrophobicContact CE2-CZ3 4.17Å; F402-W405 HydrophobicContact CZ-CE3 4.02Å; F402-W405 AromaticContact CZ-CZ3 3.85Å; F402-W405 HydrophobicContact CZ-CZ3 3.85Å; F402-W405 PolarHBondContact O-N 3Å; F402-A406 HydrophobicContact CD1-CB 4.27Å; F402-A406 HydrophobicContact CE1-CB 4.09Å; F402-A406 VanDerWaalsContact O-CB 3.28Å; F402-A406 WeakPolarHBondContact O-CB 3.3Å; F402-A406 PolarHBondContact O-N 3.24Å
403	L	87.5	Confident	84.6	Confident	33 Å²	33	40.6 Å²	40.6	17%	0.173	22%	0.217	C	C	.	.	H	α-helix	trans	-58.1	-53.7	174.7	177.4	68.2	0	0	0	110.4	M283 I287 G401 W405 A406 S407 L442 P478 L481	M283-L403 HydrophobicContact CE-CD1 3.56Å; I287-L403 HydrophobicContact CD1-CB 4.13Å; I287-L403 HydrophobicContact CD1-CD1 3.52Å; I287-L403 HydrophobicContact CD1-CG 4.43Å; I287-L403 HydrophobicContact CG1-CB 4.45Å; G401-L403 PolarHBondContact O-N 2.9Å; L403-W405 PolarHBondContact O-N 3.46Å; L403-A406 PolarHBondContact O-N 2.91Å; L403-S407 WeakPolarHBondContact O-CB 3.49Å; L403-S407 PolarHBondContact O-N 3.02Å; L403-S407 PolarHBondContact O-OG 2.97Å; L403-L442 HydrophobicContact CD1-CD2 4.43Å; L403-P478 HydrophobicContact CD2-CB 4.2Å; L403-P478 HydrophobicContact CD2-CG 4.14Å; L403-L481 HydrophobicContact CD1-CD1 4.29Å
404	G	86.4	Confident	85.2	Confident	3 Å²	3	37.8 Å²	37.8	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-47.5	178.6	0	0	0	0	0	113.4	E400 G401 A406 S407 D408	E400-G404 PolarHBondContact O-N 3.18Å; G401-G404 PolarHBondContact O-N 2.97Å; G404-A406 PolarHBondContact O-N 3.39Å; G404-S407 PolarHBondContact O-N 3.38Å; G404-D408 PolarHBondContact O-N 2.64Å
405	W	91.5	Very high	85.6	Confident	53 Å²	53	35.7 Å²	35.7	20%	0.201	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-46.4	177.7	176.8	83.9	0	0	0	112.3	K220 F223 V224 L352 G401 F402 L403 D408 Q409	K220-W405 VanDerWaalsContact CA-CH2 3.44Å; K220-W405 HydrophobicContact CB-CH2 3.56Å; K220-W405 HydrophobicContact CB-CZ2 3.75Å; K220-W405 HydrophobicContact CB-CZ3 4.22Å; K220-W405 HydrophobicContact CD-CZ2 4.03Å; K220-W405 HydrophobicContact CG-CD2 4.23Å; K220-W405 HydrophobicContact CG-CE3 4.2Å; K220-W405 HydrophobicContact CG-CH2 3.55Å; K220-W405 HydrophobicContact CG-CZ2 3.54Å; K220-W405 HydrophobicContact CG-CZ3 3.88Å; F223-W405 HydrophobicContact CB-CH2 4.5Å; F223-W405 HydrophobicContact CB-CZ3 4.19Å; F223-W405 HydrophobicContact CD1-CH2 4.16Å; F223-W405 AromaticContact CD1-CZ3 3.75Å; F223-W405 HydrophobicContact CD1-CZ3 3.75Å; F223-W405 HydrophobicContact CG-CZ3 4.32Å; V224-W405 HydrophobicContact CG2-CH2 3.9Å; V224-W405 HydrophobicContact CG2-CZ2 4.23Å; L352-W405 HydrophobicContact CD1-CB 4.05Å; L352-W405 HydrophobicContact CD1-CG 4.3Å; G401-W405 PolarHBondContact O-N 3.44Å; F402-W405 HydrophobicContact CE1-CE3 4.44Å; F402-W405 HydrophobicContact CE1-CZ3 4.48Å; F402-W405 HydrophobicContact CE2-CE3 4.08Å; F402-W405 HydrophobicContact CE2-CZ3 4.17Å; F402-W405 HydrophobicContact CZ-CE3 4.02Å; F402-W405 AromaticContact CZ-CZ3 3.85Å; F402-W405 HydrophobicContact CZ-CZ3 3.85Å; F402-W405 PolarHBondContact O-N 3Å; L403-W405 PolarHBondContact O-N 3.46Å; W405-D408 PolarHBondContact O-N 3.17Å; W405-Q409 HydrophobicContact CD2-CG 4.19Å; W405-Q409 HydrophobicContact CH2-CG 3.96Å; W405-Q409 HydrophobicContact CZ2-CG 3.62Å; W405-Q409 HydrophobicContact CZ3-CG 4.4Å; W405-Q409 WeakPolarHBondContact O-CG 3.45Å; W405-Q409 PolarHBondContact O-N 3.49Å
406	A	91.1	Very high	86	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-38.2	179.7	0	0	0	0	0	111.8	F223 M283 F402 L403 G404 Q409 L410	F223-A406 HydrophobicContact CD1-CB 4.13Å; F223-A406 HydrophobicContact CE1-CB 3.73Å; F223-A406 WeakPolarHBondContact CE1-O 3.11Å; F223-A406 HydrophobicContact CZ-CB 3.99Å; M283-A406 HydrophobicContact CE-CB 3.66Å; M283-A406 HydrophobicContact CG-CB 3.97Å; M283-A406 HydrophobicContact SD-CB 3.92Å; F402-A406 HydrophobicContact CD1-CB 4.27Å; F402-A406 HydrophobicContact CE1-CB 4.09Å; F402-A406 VanDerWaalsContact O-CB 3.28Å; F402-A406 WeakPolarHBondContact O-CB 3.3Å; F402-A406 PolarHBondContact O-N 3.24Å; L403-A406 PolarHBondContact O-N 2.91Å; G404-A406 PolarHBondContact O-N 3.39Å; A406-Q409 PolarHBondContact O-N 3.14Å; A406-L410 WeakPolarHBondContact O-CB 3.33Å; A406-L410 PolarHBondContact O-N 3.43Å
407	S	89.7	Confident	86.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-42.3	173.2	-65.3	0	0	0	0	112	M283 L403 G404 L410 A411 L481	M283-S407 WeakPolarHBondContact CE-OG 3.36Å; L403-S407 WeakPolarHBondContact O-CB 3.49Å; L403-S407 PolarHBondContact O-N 3.02Å; L403-S407 PolarHBondContact O-OG 2.97Å; G404-S407 PolarHBondContact O-N 3.38Å; S407-L410 PolarHBondContact O-N 3.36Å; S407-A411 WeakPolarHBondContact O-CB 3.48Å; S407-A411 PolarHBondContact O-N 3.45Å; S407-L481 WeakPolarHBondContact OG-CD2 3.15Å
408	D	88.8	Confident	87	Confident	51 Å²	51	34.9 Å²	34.9	27%	0.273	19%	0.193	S	C	.	.	H	α-helix	trans	-68	-38.2	177.8	-74.2	-17.2	0	0	0	112.1	G404 W405 A411 T412 R483	G404-D408 PolarHBondContact O-N 2.64Å; W405-D408 PolarHBondContact O-N 3.17Å; D408-A411 PolarHBondContact O-N 2.99Å; D408-T412 VanDerWaalsContact O-CB 3.3Å; D408-T412 WeakPolarHBondContact O-CB 3.38Å; D408-T412 PolarHBondContact O-N 2.89Å; D408-T412 PolarHBondContact O-OG1 2.92Å; D408-R483 IonicContact OD1-CZ 2.58Å; D408-R483 IonicContact OD1-NE 2.63Å; D408-R483 PolarHBondContact OD1-NE 2.78Å; D408-R483 IonicContact OD1-NH2 3.83Å; D408-R483 PolarHBondContact OD1-NH2 3.39Å; D408-R483 IonicContact OD2-CZ 2.77Å; D408-R483 IonicContact OD2-NH2 3.72Å; D408-R483 PolarHBondContact OD2-NH2 3.04Å
409	Q	91.3	Very high	87.4	Confident	64 Å²	64	36.4 Å²	36.4	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-64.5	-43.1	172.9	-70.4	-54.8	-45.6	0	0	111.7	F223 L227 W405 A406 T412 K413	F223-Q409 HydrophobicContact CD1-CB 4.45Å; F223-Q409 HydrophobicContact CE1-CB 4.06Å; L227-Q409 HydrophobicContact CD2-CB 4.31Å; W405-Q409 HydrophobicContact CD2-CG 4.19Å; W405-Q409 HydrophobicContact CH2-CG 3.96Å; W405-Q409 HydrophobicContact CZ2-CG 3.62Å; W405-Q409 HydrophobicContact CZ3-CG 4.4Å; W405-Q409 WeakPolarHBondContact O-CG 3.45Å; W405-Q409 PolarHBondContact O-N 3.49Å; A406-Q409 PolarHBondContact O-N 3.14Å; Q409-T412 PolarHBondContact O-N 2.65Å; Q409-K413 VanDerWaalsContact O-CB 3.27Å; Q409-K413 WeakPolarHBondContact O-CB 3.41Å; Q409-K413 PolarHBondContact O-N 3.48Å
410	L	90.6	Very high	87.7	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-47.7	175.4	-175.5	139.5	0	0	0	110.9	I280 A406 S407 T412 K413 L414	I280-L410 HydrophobicContact CD1-CD1 3.78Å; A406-L410 WeakPolarHBondContact O-CB 3.33Å; A406-L410 PolarHBondContact O-N 3.43Å; S407-L410 PolarHBondContact O-N 3.36Å; L410-T412 PolarHBondContact O-N 3.48Å; L410-K413 PolarHBondContact O-N 3.21Å; L410-L414 HydrophobicContact CD2-CD1 3.52Å; L410-L414 HydrophobicContact CD2-CG 4.44Å; L410-L414 HydrophobicContact CG-CD1 3.9Å; L410-L414 HydrophobicContact CG-CG 4.4Å; L410-L414 VanDerWaalsContact O-CB 3.29Å; L410-L414 WeakPolarHBondContact O-CB 3.47Å; L410-L414 WeakPolarHBondContact O-CG 3.4Å; L410-L414 PolarHBondContact O-N 2.66Å
411	A	89.4	Confident	88.1	Confident	21 Å²	21	37.4 Å²	37.4	17%	0.174	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-50.1	176.9	0	0	0	0	0	112.2	S407 D408 S415 A484	S407-A411 WeakPolarHBondContact O-CB 3.48Å; S407-A411 PolarHBondContact O-N 3.45Å; D408-A411 PolarHBondContact O-N 2.99Å; A411-S415 VanDerWaalsContact O-CB 3.27Å; A411-S415 WeakPolarHBondContact O-CB 3.44Å; A411-S415 PolarHBondContact O-N 3.5Å; A411-A484 HydrophobicContact CB-CB 3.7Å
412	T	89.3	Confident	88.1	Confident	75 Å²	75	42.2 Å²	42.2	46%	0.46	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-47.4	-177.7	-56	0	0	0	0	110.6	D408 Q409 L410 S415 I416	D408-T412 VanDerWaalsContact O-CB 3.3Å; D408-T412 WeakPolarHBondContact O-CB 3.38Å; D408-T412 PolarHBondContact O-N 2.89Å; D408-T412 PolarHBondContact O-OG1 2.92Å; Q409-T412 PolarHBondContact O-N 2.65Å; L410-T412 PolarHBondContact O-N 3.48Å; T412-S415 PolarHBondContact O-N 3.36Å; T412-I416 HydrophobicContact CG2-CD1 3.89Å; T412-I416 WeakPolarHBondContact O-CD1 3.48Å; T412-I416 VanDerWaalsContact O-CG1 3.26Å; T412-I416 WeakPolarHBondContact O-CG1 3.31Å; T412-I416 PolarHBondContact O-N 2.99Å
413	K	88.5	Confident	88	Confident	66 Å²	66	45.2 Å²	45.2	29%	0.287	25%	0.247	S	C	.	.	H	α-helix	trans	-67.4	-44.5	-178.3	-168.1	69.5	175.6	-168.9	0	111.9	L227 S228 Q409 L410 S415 I416 V417	L227-K413 HydrophobicContact CD2-CB 3.82Å; L227-K413 HydrophobicContact CD2-CG 4.25Å; L227-K413 HydrophobicContact CG-CB 4.17Å; L227-K413 HydrophobicContact CG-CG 4.1Å; S228-K413 PolarHBondContact OG-NZ 3.41Å; Q409-K413 VanDerWaalsContact O-CB 3.27Å; Q409-K413 WeakPolarHBondContact O-CB 3.41Å; Q409-K413 PolarHBondContact O-N 3.48Å; L410-K413 PolarHBondContact O-N 3.21Å; K413-S415 VanDerWaalsContact C-N 3.32Å; K413-S415 PolarHBondContact O-N 2.9Å; K413-I416 PolarHBondContact O-N 3Å; K413-V417 WeakPolarHBondContact O-CG2 3.37Å; K413-V417 PolarHBondContact O-N 3.11Å
414	L	88.1	Confident	87.9	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-63.8	-38.3	177.3	-69.7	179.4	0	0	0	111.6	V231 L276 L410 S418 L428 F488	V231-L414 HydrophobicContact CG1-CD2 4.35Å; V231-L414 HydrophobicContact CG2-CD2 4.05Å; L276-L414 HydrophobicContact CD2-CD2 4.01Å; L410-L414 HydrophobicContact CD2-CD1 3.52Å; L410-L414 HydrophobicContact CD2-CG 4.44Å; L410-L414 HydrophobicContact CG-CD1 3.9Å; L410-L414 HydrophobicContact CG-CG 4.4Å; L410-L414 VanDerWaalsContact O-CB 3.29Å; L410-L414 WeakPolarHBondContact O-CB 3.47Å; L410-L414 WeakPolarHBondContact O-CG 3.4Å; L410-L414 PolarHBondContact O-N 2.66Å; L414-S418 WeakPolarHBondContact O-CB 3.5Å; L414-S418 PolarHBondContact O-N 3.31Å; L414-L428 HydrophobicContact CB-CD1 4.4Å; L414-L428 HydrophobicContact CD2-CD1 4.05Å; L414-L428 HydrophobicContact CD2-CD2 4.47Å; L414-F488 HydrophobicContact CB-CE2 4.04Å; L414-F488 HydrophobicContact CB-CZ 3.68Å; L414-F488 HydrophobicContact CD1-CE2 4.36Å
415	S	87.7	Confident	88	Confident	53 Å²	53	47.1 Å²	47.1	37%	0.371	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-47.1	175.1	-175.3	0	0	0	0	112	A411 T412 K413 V417 S418 N419	A411-S415 VanDerWaalsContact O-CB 3.27Å; A411-S415 WeakPolarHBondContact O-CB 3.44Å; A411-S415 PolarHBondContact O-N 3.5Å; T412-S415 PolarHBondContact O-N 3.36Å; K413-S415 VanDerWaalsContact C-N 3.32Å; K413-S415 PolarHBondContact O-N 2.9Å; S415-V417 PolarHBondContact O-N 3.01Å; S415-S418 PolarHBondContact O-N 3.3Å; S415-N419 VanDerWaalsContact O-CG 3.3Å; S415-N419 PolarHBondContact O-N 3.48Å; S415-N419 PolarHBondContact O-ND2 3.33Å; S415-N419 VanDerWaalsContact O-ND2 3.14Å
416	I	87.6	Confident	87.8	Confident	76 Å²	76	50 Å²	50	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-60.2	-48.4	178.4	-69.2	165.2	0	0	0	110.7	T412 K413 N419 Q420	T412-I416 HydrophobicContact CG2-CD1 3.89Å; T412-I416 WeakPolarHBondContact O-CD1 3.48Å; T412-I416 VanDerWaalsContact O-CG1 3.26Å; T412-I416 WeakPolarHBondContact O-CG1 3.31Å; T412-I416 PolarHBondContact O-N 2.99Å; K413-I416 PolarHBondContact O-N 3Å; I416-N419 PolarHBondContact O-N 3.38Å; I416-Q420 WeakPolarHBondContact O-CG 3.49Å; I416-Q420 PolarHBondContact O-N 3.34Å; I416-Q420 VanDerWaalsContact O-N 3.08Å
417	V	86.1	Confident	87.6	Confident	9 Å²	9	50 Å²	50	6%	0.055	27%	0.269	C	S	.	.	H	α-helix	trans	-72.7	-34.5	-176.3	179.2	0	0	0	0	111.6	V231 K413 S415 N419 Q420 S421 I424	V231-V417 HydrophobicContact CB-CG2 4.27Å; V231-V417 HydrophobicContact CG1-CB 3.46Å; V231-V417 VanDerWaalsContact CG1-CB 3.46Å; V231-V417 HydrophobicContact CG1-CG1 3.38Å; V231-V417 HydrophobicContact CG1-CG2 3.52Å; K413-V417 WeakPolarHBondContact O-CG2 3.37Å; K413-V417 PolarHBondContact O-N 3.11Å; S415-V417 PolarHBondContact O-N 3.01Å; V417-N419 VanDerWaalsContact C-N 3.26Å; V417-N419 PolarHBondContact O-N 2.89Å; V417-Q420 PolarHBondContact O-N 2.91Å; V417-Q420 VanDerWaalsContact O-N 3.13Å; V417-S421 PolarHBondContact O-N 3.18Å; V417-I424 HydrophobicContact CG1-CB 4.45Å; V417-I424 HydrophobicContact CG1-CD1 3.48Å; V417-I424 VanDerWaalsContact CG1-CD1 3.48Å; V417-I424 HydrophobicContact CG1-CG2 4.2Å
418	S	85.9	Confident	87.5	Confident	5 Å²	5	50.1 Å²	50.1	4%	0.035	27%	0.269	C	S	.	.	H	α-helix	trans	-57	-40.8	169.6	-177.3	0	0	0	0	111.5	L414 S415 Q420 K425	L414-S418 WeakPolarHBondContact O-CB 3.5Å; L414-S418 PolarHBondContact O-N 3.31Å; S415-S418 PolarHBondContact O-N 3.3Å; S418-Q420 VanDerWaalsContact C-N 3.34Å; S418-Q420 PolarHBondContact O-N 2.9Å; S418-K425 WeakPolarHBondContact O-CB 3.48Å; S418-K425 WeakPolarHBondContact OG-CB 3.48Å; S418-K425 VanDerWaalsContact OG-CG 3.29Å; S418-K425 WeakPolarHBondContact OG-CG 3.3Å
419	N	86.4	Confident	87.5	Confident	118 Å²	118	48.9 Å²	48.9	63%	0.631	26%	0.262	S	S	*	.	H	α-helix	trans	-72.1	-26.6	177.4	-68.7	-31.9	0	0	0	113.7	S415 I416 V417	S415-N419 VanDerWaalsContact O-CG 3.3Å; S415-N419 PolarHBondContact O-N 3.48Å; S415-N419 PolarHBondContact O-ND2 3.33Å; S415-N419 VanDerWaalsContact O-ND2 3.14Å; I416-N419 PolarHBondContact O-N 3.38Å; V417-N419 VanDerWaalsContact C-N 3.26Å; V417-N419 PolarHBondContact O-N 2.89Å
420	Q	86.7	Confident	87.3	Confident	138 Å²	138	46.6 Å²	46.6	65%	0.645	26%	0.255	S	S	*	.	H	α-helix	trans	-86.4	-31.9	-179.5	-71.2	173.5	-10.4	0	0	113.2	I416 V417 S418	I416-Q420 WeakPolarHBondContact O-CG 3.49Å; I416-Q420 PolarHBondContact O-N 3.34Å; I416-Q420 VanDerWaalsContact O-N 3.08Å; V417-Q420 PolarHBondContact O-N 2.91Å; V417-Q420 VanDerWaalsContact O-N 3.13Å; S418-Q420 VanDerWaalsContact C-N 3.34Å; S418-Q420 PolarHBondContact O-N 2.9Å
421	S	85.9	Confident	87.1	Confident	10 Å²	10	48.5 Å²	48.5	7%	0.07	26%	0.264	C	S	.	.			trans	-123.7	111.3	-174	179.8	0	0	0	0	111.8	V417 V423 I424 K425	V417-S421 PolarHBondContact O-N 3.18Å; S421-V423 PolarHBondContact O-N 3.03Å; S421-I424 PolarHBondContact O-N 3.04Å; S421-I424 PolarHBondContact OG-N 2.83Å; S421-K425 WeakPolarHBondContact O-CB 3.37Å; S421-K425 PolarHBondContact O-N 2.87Å
422	P	84.6	Confident	87.2	Confident	104 Å²	104	47.8 Å²	47.8	68%	0.675	26%	0.257	S	S	*	.	H	α-helix	trans	-63.9	-31.1	178.8	25.9	-33.3	0	0	0	112.2	K425 E426	P422-K425 PolarHBondContact O-N 2.74Å; P422-E426 WeakPolarHBondContact O-CB 3.39Å; P422-E426 PolarHBondContact O-N 3.34Å
423	V	84.7	Confident	87.2	Confident	64 Å²	64	44.6 Å²	44.6	39%	0.388	24%	0.238	S	C	.	.	H	α-helix	trans	-67.6	-44.8	177.9	-175.5	0	0	0	0	110.6	F268 S421 E426 V427	F268-V423 HydrophobicContact CD1-CG1 3.79Å; F268-V423 HydrophobicContact CE1-CB 4.42Å; F268-V423 HydrophobicContact CE1-CG1 3.63Å; S421-V423 PolarHBondContact O-N 3.03Å; V423-E426 PolarHBondContact O-N 3.31Å; V423-V427 WeakPolarHBondContact O-CG2 3.46Å; V423-V427 PolarHBondContact O-N 2.68Å; V423-V427 VanDerWaalsContact O-N 3.11Å
424	I	85.4	Confident	87.2	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-39.8	178	-64.8	174.3	0	0	0	110.4	I233 L236 F268 I272 V417 S421 E426 V427 L428	I233-I424 HydrophobicContact CG1-CD1 3.72Å; L236-I424 HydrophobicContact CD1-CD1 4.45Å; F268-I424 HydrophobicContact CE1-CG1 4.39Å; I272-I424 HydrophobicContact CD1-CG1 4.11Å; V417-I424 HydrophobicContact CG1-CB 4.45Å; V417-I424 HydrophobicContact CG1-CD1 3.48Å; V417-I424 VanDerWaalsContact CG1-CD1 3.48Å; V417-I424 HydrophobicContact CG1-CG2 4.2Å; S421-I424 PolarHBondContact O-N 3.04Å; S421-I424 PolarHBondContact OG-N 2.83Å; I424-E426 VanDerWaalsContact C-N 3.29Å; I424-E426 PolarHBondContact O-N 2.83Å; I424-V427 PolarHBondContact O-N 2.88Å; I424-L428 HydrophobicContact CG2-CD1 3.7Å; I424-L428 HydrophobicContact CG2-CG 4.05Å; I424-L428 WeakPolarHBondContact O-CG 3.35Å; I424-L428 PolarHBondContact O-N 3.38Å
425	K	88.1	Confident	87.3	Confident	72 Å²	72	46.6 Å²	46.6	31%	0.313	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-44.4	172.9	-175.8	166.3	-171.5	176.3	0	112	S418 S421 P422 V427 E429	S418-K425 WeakPolarHBondContact O-CB 3.48Å; S418-K425 WeakPolarHBondContact OG-CB 3.48Å; S418-K425 VanDerWaalsContact OG-CG 3.29Å; S418-K425 WeakPolarHBondContact OG-CG 3.3Å; S421-K425 WeakPolarHBondContact O-CB 3.37Å; S421-K425 PolarHBondContact O-N 2.87Å; P422-K425 PolarHBondContact O-N 2.74Å; K425-V427 VanDerWaalsContact C-N 3.35Å; K425-V427 PolarHBondContact O-N 3.31Å; K425-E429 WeakPolarHBondContact CE-OE1 3.3Å; K425-E429 HydrophobicContact CG-CG 4.24Å; K425-E429 WeakPolarHBondContact CG-OE1 3.33Å; K425-E429 IonicContact NZ-OE1 3.77Å; K425-E429 VanDerWaalsContact O-CB 3.3Å; K425-E429 WeakPolarHBondContact O-CB 3.45Å; K425-E429 WeakPolarHBondContact O-CG 3.4Å; K425-E429 PolarHBondContact O-N 3.23Å
426	E	87.6	Confident	87.3	Confident	115 Å²	115	44.4 Å²	44.4	54%	0.537	23%	0.231	S	C	.	.	H	α-helix	trans	-60.2	-45	177	-170.7	178.9	173.1	0	0	111.9	P422 V423 I424 G430 R495	P422-E426 WeakPolarHBondContact O-CB 3.39Å; P422-E426 PolarHBondContact O-N 3.34Å; V423-E426 PolarHBondContact O-N 3.31Å; I424-E426 VanDerWaalsContact C-N 3.29Å; I424-E426 PolarHBondContact O-N 2.83Å; E426-G430 VanDerWaalsContact O-CA 3.25Å; E426-G430 WeakPolarHBondContact O-CA 3.39Å; E426-G430 PolarHBondContact O-N 3.08Å; E426-R495 PolarHBondContact O-NH1 3.3Å
427	V	87.7	Confident	87.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-52	177.6	176.6	0	0	0	0	111.8	H269 I272 W273 V423 I424 K425 E431	H269-V427 WeakPolarHBondContact CD2-CG2 3.5Å; H269-V427 VanDerWaalsContact NE2-CG2 3.31Å; H269-V427 WeakPolarHBondContact NE2-CG2 3.16Å; I272-V427 HydrophobicContact CD1-CB 4.46Å; I272-V427 HydrophobicContact CD1-CG1 4.4Å; I272-V427 HydrophobicContact CD1-CG2 4.08Å; I272-V427 HydrophobicContact CG2-CG1 4.32Å; W273-V427 HydrophobicContact CZ2-CG1 3.73Å; V423-V427 WeakPolarHBondContact O-CG2 3.46Å; V423-V427 PolarHBondContact O-N 2.68Å; V423-V427 VanDerWaalsContact O-N 3.11Å; I424-V427 PolarHBondContact O-N 2.88Å; K425-V427 VanDerWaalsContact C-N 3.35Å; K425-V427 PolarHBondContact O-N 3.31Å; V427-E431 WeakPolarHBondContact O-CB 3.35Å; V427-E431 PolarHBondContact O-N 3.34Å
428	L	87.6	Confident	87.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-68.1	-43.2	-174.5	-67.5	175.8	0	0	0	112.4	W273 L276 L414 I424 Y432 F488	W273-L428 HydrophobicContact CH2-CD2 4.04Å; L276-L428 HydrophobicContact CD1-CD2 4.02Å; L414-L428 HydrophobicContact CB-CD1 4.4Å; L414-L428 HydrophobicContact CD2-CD1 4.05Å; L414-L428 HydrophobicContact CD2-CD2 4.47Å; I424-L428 HydrophobicContact CG2-CD1 3.7Å; I424-L428 HydrophobicContact CG2-CG 4.05Å; I424-L428 WeakPolarHBondContact O-CG 3.35Å; I424-L428 PolarHBondContact O-N 3.38Å; L428-Y432 PolarHBondContact O-N 3.33Å; L428-F488 HydrophobicContact CB-CD1 3.83Å; L428-F488 HydrophobicContact CB-CE1 3.85Å; L428-F488 HydrophobicContact CD1-CE1 3.85Å; L428-F488 HydrophobicContact CD1-CZ 4.18Å; L428-F488 HydrophobicContact CG-CE1 4.47Å
429	E	89	Confident	87.6	Confident	26 Å²	26	46.6 Å²	46.6	12%	0.121	24%	0.237	C	C	.	.	H	α-helix	trans	-80.2	-26.9	179.1	-63.2	179.4	175	0	0	112.4	K425 F488 A491 Y492 R495	K425-E429 WeakPolarHBondContact CE-OE1 3.3Å; K425-E429 HydrophobicContact CG-CG 4.24Å; K425-E429 WeakPolarHBondContact CG-OE1 3.33Å; K425-E429 IonicContact NZ-OE1 3.77Å; K425-E429 VanDerWaalsContact O-CB 3.3Å; K425-E429 WeakPolarHBondContact O-CB 3.45Å; K425-E429 WeakPolarHBondContact O-CG 3.4Å; K425-E429 PolarHBondContact O-N 3.23Å; E429-F488 HydrophobicContact CG-CD1 4.26Å; E429-A491 HydrophobicContact CB-CB 3.94Å; E429-A491 HydrophobicContact CG-CB 3.6Å; E429-Y492 WeakPolarHBondContact O-CA 3.11Å; E429-Y492 WeakPolarHBondContact O-CB 3.33Å; E429-Y492 WeakPolarHBondContact O-CD2 3.49Å; E429-R495 IonicContact OE2-CZ 3.27Å; E429-R495 IonicContact OE2-NE 2.8Å; E429-R495 PolarHBondContact OE2-NE 3.42Å; E429-R495 IonicContact OE2-NH2 2.94Å; E429-R495 PolarHBondContact OE2-NH2 2.95Å
430	G	85.9	Confident	87.6	Confident	15 Å²	15	41.5 Å²	41.5	16%	0.155	21%	0.21	C	C	.	.	H	α-helix	trans	-86	-33.7	-177.5	0	0	0	0	0	113.9	E426 Y492	E426-G430 VanDerWaalsContact O-CA 3.25Å; E426-G430 WeakPolarHBondContact O-CA 3.39Å; E426-G430 PolarHBondContact O-N 3.08Å; G430-Y492 WeakPolarHBondContact O-CE2 3.34Å
431	E	87.7	Confident	87.5	Confident	47 Å²	47	36.8 Å²	36.8	22%	0.22	19%	0.189	C	C	.	.	S	Bend	trans	-114.5	28.7	-178.8	-55.4	-176.7	-174.7	0	0	112.3	H269 W273 V427 P433 K434	H269-E431 IonicContact CE1-OE1 3.18Å; H269-E431 IonicContact CG-OE1 2.82Å; H269-E431 IonicContact ND1-OE1 3.71Å; H269-E431 PolarHBondContact ND1-OE1 3.28Å; W273-E431 HydrophobicContact CZ2-CB 3.84Å; W273-E431 PolarHBondContact NE1-OE2 3.43Å; V427-E431 WeakPolarHBondContact O-CB 3.35Å; V427-E431 PolarHBondContact O-N 3.34Å; E431-P433 VanDerWaalsContact C-N 3.28Å; E431-P433 VanDerWaalsContact O-N 3.1Å; E431-K434 HydrophobicContact CB-CD 4.27Å; E431-K434 WeakPolarHBondContact O-CB 3.2Å; E431-K434 PolarHBondContact O-N 2.88Å; E431-K434 IonicContact OE1-NZ 3.37Å; E431-K434 WeakPolarHBondContact OE2-CD 3.44Å; E431-K434 WeakPolarHBondContact OE2-CE 3.16Å; E431-K434 IonicContact OE2-NZ 3.53Å; E431-K434 PolarHBondContact OE2-NZ 2.71Å
432	Y	91.3	Very high	87.6	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-44.2	-39.9	177.8	170.6	-101.9	0	0	0	115.2	L428 K434 L435 L436 L485 F488 E489 Y492 L541	L428-Y432 PolarHBondContact O-N 3.33Å; Y432-K434 PolarHBondContact O-N 3.45Å; Y432-K434 VanDerWaalsContact O-N 3.09Å; Y432-L435 WeakPolarHBondContact O-CB 3.31Å; Y432-L435 PolarHBondContact O-N 3.19Å; Y432-L436 HydrophobicContact CE1-CB 4.24Å; Y432-L436 HydrophobicContact CE1-CD2 4.16Å; Y432-L436 PolarHBondContact O-N 2.84Å; Y432-L485 HydrophobicContact CE2-CB 4.11Å; Y432-L485 HydrophobicContact CE2-CD2 3.95Å; Y432-F488 HydrophobicContact CD2-CB 3.63Å; Y432-F488 HydrophobicContact CE2-CB 4.14Å; Y432-E489 HydrophobicContact CE1-CB 3.89Å; Y432-E489 HydrophobicContact CE1-CG 3.76Å; Y432-E489 HydrophobicContact CE2-CB 3.9Å; Y432-Y492 HydrophobicContact CD1-CD1 4.22Å; Y432-Y492 HydrophobicContact CD1-CG 4.27Å; Y432-Y492 HydrophobicContact CG-CG 4.44Å; Y432-L541 HydrophobicContact CD1-CD1 4.28Å; Y432-L541 HydrophobicContact CD1-CD2 3.89Å; Y432-L541 HydrophobicContact CE1-CD1 3.8Å; Y432-L541 HydrophobicContact CE1-CD2 3.72Å; Y432-L541 HydrophobicContact CE1-CG 4.39Å
433	P	89.2	Confident	87.5	Confident	9 Å²	9	33 Å²	33	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-56.8	-27.6	177.3	-27.1	35.3	0	0	0	114.5	E431 K437 Y492 Y534 V535 V537 L541	E431-P433 VanDerWaalsContact C-N 3.28Å; E431-P433 VanDerWaalsContact O-N 3.1Å; P433-K437 WeakPolarHBondContact O-CB 3.4Å; P433-K437 PolarHBondContact O-N 3.35Å; P433-Y492 HydrophobicContact CG-CE1 4.18Å; P433-Y492 HydrophobicContact CG-CE2 4.19Å; P433-Y534 WeakPolarHBondContact CB-O 3.43Å; P433-V535 HydrophobicContact CG-CG2 4.11Å; P433-V537 HydrophobicContact CB-CG2 4.32Å; P433-L541 HydrophobicContact CG-CD2 4.19Å
434	K	89.2	Confident	87.4	Confident	104 Å²	104	36.7 Å²	36.7	45%	0.452	17%	0.168	S	C	.	.	H	α-helix	trans	-71	-42.3	173.6	-66.2	-177.1	-176.6	170.3	0	111.8	W273 E431 Y432 L436 K437 L438	W273-K434 HydrophobicContact CD2-CB 4.33Å; W273-K434 HydrophobicContact CD2-CD 4.36Å; W273-K434 HydrophobicContact CE3-CB 4.39Å; W273-K434 HydrophobicContact CG-CD 4.39Å; W273-K434 HydrophobicContact CH2-CB 4.34Å; W273-K434 HydrophobicContact CZ2-CB 4.25Å; W273-K434 HydrophobicContact CZ3-CB 4.39Å; E431-K434 HydrophobicContact CB-CD 4.27Å; E431-K434 WeakPolarHBondContact O-CB 3.2Å; E431-K434 PolarHBondContact O-N 2.88Å; E431-K434 IonicContact OE1-NZ 3.37Å; E431-K434 WeakPolarHBondContact OE2-CD 3.44Å; E431-K434 WeakPolarHBondContact OE2-CE 3.16Å; E431-K434 IonicContact OE2-NZ 3.53Å; E431-K434 PolarHBondContact OE2-NZ 2.71Å; Y432-K434 PolarHBondContact O-N 3.45Å; Y432-K434 VanDerWaalsContact O-N 3.09Å; K434-L436 VanDerWaalsContact C-N 3.34Å; K434-K437 WeakPolarHBondContact O-CB 3.14Å; K434-K437 PolarHBondContact O-N 3.34Å; K434-L438 WeakPolarHBondContact O-CG 3.5Å; K434-L438 PolarHBondContact O-N 3.42Å
435	L	89.5	Confident	87.3	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-44.8	175.1	-176.3	63.4	0	0	0	110.9	W273 Y432 K437 L438 I439 L485 F488	W273-L435 HydrophobicContact CH2-CB 3.81Å; W273-L435 HydrophobicContact CZ3-CB 3.82Å; W273-L435 HydrophobicContact CZ3-CD1 4.12Å; Y432-L435 WeakPolarHBondContact O-CB 3.31Å; Y432-L435 PolarHBondContact O-N 3.19Å; L435-K437 VanDerWaalsContact C-N 3.29Å; L435-K437 PolarHBondContact O-N 3.02Å; L435-L438 PolarHBondContact O-N 2.91Å; L435-I439 HydrophobicContact CD1-CD1 4.36Å; L435-I439 HydrophobicContact CG-CD1 4.3Å; L435-I439 PolarHBondContact O-N 2.7Å; L435-I439 VanDerWaalsContact O-N 3.15Å; L435-L485 HydrophobicContact CD2-CD2 3.46Å; L435-L485 VanDerWaalsContact CD2-CD2 3.46Å; L435-L485 HydrophobicContact CG-CD2 3.6Å; L435-F488 HydrophobicContact CD2-CD2 4.11Å; L435-F488 HydrophobicContact CD2-CG 4.41Å
436	L	88.1	Confident	86.9	Confident	7 Å²	7	37.2 Å²	37.2	4%	0.037	17%	0.17	C	C	.	.	H	α-helix	trans	-60.1	-41.5	175.4	-178.7	60.9	0	0	0	111.1	Y432 K434 L438 I439 L440 L485 H538 L541	Y432-L436 HydrophobicContact CE1-CB 4.24Å; Y432-L436 HydrophobicContact CE1-CD2 4.16Å; Y432-L436 PolarHBondContact O-N 2.84Å; K434-L436 VanDerWaalsContact C-N 3.34Å; L436-L438 PolarHBondContact O-N 3.4Å; L436-I439 PolarHBondContact O-N 2.86Å; L436-L440 HydrophobicContact CD1-CD1 4.17Å; L436-L440 HydrophobicContact CD1-CG 4.18Å; L436-L440 HydrophobicContact CG-CD1 3.86Å; L436-L440 HydrophobicContact CG-CG 4.34Å; L436-L440 WeakPolarHBondContact O-CB 3.38Å; L436-L440 VanDerWaalsContact O-CG 3.27Å; L436-L440 WeakPolarHBondContact O-CG 3.07Å; L436-L440 PolarHBondContact O-N 2.9Å; L436-L485 HydrophobicContact CD1-CD1 3.81Å; L436-H538 HydrophobicContact CD2-CB 3.59Å; L436-H538 HydrophobicContact CG-CB 4.4Å; L436-L541 HydrophobicContact CD2-CB 4.17Å; L436-L541 HydrophobicContact CD2-CD2 3.83Å
437	K	88.2	Confident	86.2	Confident	112 Å²	112	35.4 Å²	35.4	49%	0.487	17%	0.167	S	C	.	.	H	α-helix	trans	-58.2	-48.5	175.2	-170.2	-179.6	173.4	-174.9	0	112.2	P433 K434 L435 I439 L440 D441 V537	P433-K437 WeakPolarHBondContact O-CB 3.4Å; P433-K437 PolarHBondContact O-N 3.35Å; K434-K437 WeakPolarHBondContact O-CB 3.14Å; K434-K437 PolarHBondContact O-N 3.34Å; L435-K437 VanDerWaalsContact C-N 3.29Å; L435-K437 PolarHBondContact O-N 3.02Å; K437-I439 VanDerWaalsContact C-N 3.27Å; K437-I439 PolarHBondContact O-N 2.8Å; K437-L440 PolarHBondContact O-N 2.67Å; K437-D441 WeakPolarHBondContact O-CB 3.27Å; K437-D441 VanDerWaalsContact O-CG 3.28Å; K437-D441 PolarHBondContact O-N 3.41Å; K437-V537 HydrophobicContact CB-CG1 3.64Å; K437-V537 HydrophobicContact CG-CG1 3.97Å
438	L	88.6	Confident	85.5	Confident	23 Å²	23	38.1 Å²	38.1	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-41.2	179.5	-69.5	178.1	0	0	0	111.9	W273 L276 D277 I280 K434 L435 L436 D441 L442	W273-L438 HydrophobicContact CE3-CD1 4.02Å; W273-L438 HydrophobicContact CZ3-CD1 4.35Å; L276-L438 HydrophobicContact CB-CD1 4.35Å; D277-L438 HydrophobicContact CB-CD2 4.17Å; D277-L438 WeakPolarHBondContact OD1-CD2 3.42Å; I280-L438 HydrophobicContact CG1-CB 4.47Å; K434-L438 WeakPolarHBondContact O-CG 3.5Å; K434-L438 PolarHBondContact O-N 3.42Å; L435-L438 PolarHBondContact O-N 2.91Å; L436-L438 PolarHBondContact O-N 3.4Å; L438-D441 PolarHBondContact O-N 2.91Å; L438-L442 PolarHBondContact O-N 3.45Å
439	I	88.2	Confident	84.4	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-73.5	-38.1	-179.6	-74.6	166.3	0	0	0	112.1	L435 L436 K437 D441 L442 E443 L477 L481 L485	L435-I439 HydrophobicContact CD1-CD1 4.36Å; L435-I439 HydrophobicContact CG-CD1 4.3Å; L435-I439 PolarHBondContact O-N 2.7Å; L435-I439 VanDerWaalsContact O-N 3.15Å; L436-I439 PolarHBondContact O-N 2.86Å; K437-I439 VanDerWaalsContact C-N 3.27Å; K437-I439 PolarHBondContact O-N 2.8Å; I439-D441 VanDerWaalsContact C-N 3.31Å; I439-L442 WeakPolarHBondContact O-CB 3.4Å; I439-L442 PolarHBondContact O-N 3.27Å; I439-E443 PolarHBondContact O-N 2.87Å; I439-L477 HydrophobicContact CG2-CD1 3.95Å; I439-L477 HydrophobicContact CG2-CD2 4.1Å; I439-L481 HydrophobicContact CG2-CB 4.09Å; I439-L481 HydrophobicContact CG2-CD1 3.95Å; I439-L481 HydrophobicContact CG2-CD2 3.9Å; I439-L481 HydrophobicContact CG2-CG 4.21Å; I439-L485 HydrophobicContact CB-CD1 4.26Å; I439-L485 HydrophobicContact CD1-CD1 3.59Å; I439-L485 HydrophobicContact CD1-CD2 3.27Å; I439-L485 HydrophobicContact CD1-CG 3.53Å; I439-L485 HydrophobicContact CG2-CD1 4.03Å
440	L	86.1	Confident	83.1	Confident	11 Å²	11	41.5 Å²	41.5	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-37.4	172.8	-70.8	169.4	0	0	0	111.5	L436 K437 E443 R444 L477 V537 H538	L436-L440 HydrophobicContact CD1-CD1 4.17Å; L436-L440 HydrophobicContact CD1-CG 4.18Å; L436-L440 HydrophobicContact CG-CD1 3.86Å; L436-L440 HydrophobicContact CG-CG 4.34Å; L436-L440 WeakPolarHBondContact O-CB 3.38Å; L436-L440 VanDerWaalsContact O-CG 3.27Å; L436-L440 WeakPolarHBondContact O-CG 3.07Å; L436-L440 PolarHBondContact O-N 2.9Å; K437-L440 PolarHBondContact O-N 2.67Å; L440-E443 PolarHBondContact O-N 3.29Å; L440-R444 WeakPolarHBondContact O-CG 3.29Å; L440-R444 PolarHBondContact O-N 3.3Å; L440-L477 HydrophobicContact CD2-CD1 4.23Å; L440-V537 HydrophobicContact CD1-CG1 4.16Å; L440-H538 HydrophobicContact CD1-CB 3.96Å
441	D	86	Confident	81.4	Confident	40 Å²	40	44.2 Å²	44.2	21%	0.214	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-37.2	175.5	-69.9	-22.1	0	0	0	110.9	K437 L438 I439 R444 R445	K437-D441 WeakPolarHBondContact O-CB 3.27Å; K437-D441 VanDerWaalsContact O-CG 3.28Å; K437-D441 PolarHBondContact O-N 3.41Å; L438-D441 PolarHBondContact O-N 2.91Å; I439-D441 VanDerWaalsContact C-N 3.31Å; D441-R444 IonicContact OD1-NH1 2.86Å; D441-R444 PolarHBondContact OD1-NH1 3.11Å; D441-R445 VanDerWaalsContact O-CG 3.29Å; D441-R445 WeakPolarHBondContact O-CG 3.22Å; D441-R445 PolarHBondContact O-N 3.16Å; D441-R445 VanDerWaalsContact O-N 3.16Å
442	L	86.8	Confident	79.5	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-51.5	169.6	176.2	67.5	0	0	0	111.5	I280 M283 E284 L403 L438 I439 R444 R445 V446	I280-L442 HydrophobicContact CG2-CB 3.72Å; I280-L442 HydrophobicContact CG2-CD1 4.07Å; I280-L442 HydrophobicContact CG2-CD2 4.21Å; I280-L442 HydrophobicContact CG2-CG 4.2Å; M283-L442 HydrophobicContact CE-CD2 4.05Å; M283-L442 HydrophobicContact CG-CD2 4.37Å; M283-L442 HydrophobicContact SD-CD2 4.08Å; E284-L442 HydrophobicContact CB-CD1 3.63Å; E284-L442 HydrophobicContact CG-CD1 4.25Å; L403-L442 HydrophobicContact CD1-CD2 4.43Å; L438-L442 PolarHBondContact O-N 3.45Å; I439-L442 WeakPolarHBondContact O-CB 3.4Å; I439-L442 PolarHBondContact O-N 3.27Å; L442-R444 VanDerWaalsContact C-N 3.3Å; L442-R444 PolarHBondContact O-N 2.66Å; L442-R445 PolarHBondContact O-N 2.96Å; L442-R445 VanDerWaalsContact O-N 3.11Å; L442-V446 HydrophobicContact CD1-CG2 3.83Å; L442-V446 HydrophobicContact CG-CG2 4.15Å; L442-V446 VanDerWaalsContact O-CG2 3.31Å; L442-V446 WeakPolarHBondContact O-CG2 3.34Å; L442-V446 PolarHBondContact O-N 3.43Å
443	E	83.6	Confident	77.4	Confident	33 Å²	33	50.5 Å²	50.5	15%	0.154	25%	0.254	C	S	.	.	H	α-helix	trans	-55.6	-45.9	-179.7	-178.8	-171.1	-161.5	0	0	111.3	I439 L440 R445 V446 T447 L477	I439-E443 PolarHBondContact O-N 2.87Å; L440-E443 PolarHBondContact O-N 3.29Å; E443-R445 VanDerWaalsContact C-N 3.34Å; E443-R445 PolarHBondContact O-N 2.92Å; E443-V446 PolarHBondContact O-N 3.42Å; E443-T447 VanDerWaalsContact O-CB 3.27Å; E443-T447 WeakPolarHBondContact O-CB 3.42Å; E443-T447 PolarHBondContact O-N 3.31Å; E443-T447 PolarHBondContact O-OG1 3.34Å; E443-L477 HydrophobicContact CB-CD1 4.14Å; E443-L477 HydrophobicContact CG-CD1 4.31Å; E443-L477 WeakPolarHBondContact OE2-CD1 3.27Å
444	R	82.7	Confident	75.2	Confident	141 Å²	141	58.4 Å²	58.4	53%	0.532	29%	0.288	S	S	.	.	H	α-helix	trans	-60	-42.2	177.4	-73.7	174.2	-174.5	149.4	-0.2	112.5	L440 D441 L442 S448	L440-R444 WeakPolarHBondContact O-CG 3.29Å; L440-R444 PolarHBondContact O-N 3.3Å; D441-R444 IonicContact OD1-NH1 2.86Å; D441-R444 PolarHBondContact OD1-NH1 3.11Å; L442-R444 VanDerWaalsContact C-N 3.3Å; L442-R444 PolarHBondContact O-N 2.66Å; R444-S448 WeakPolarHBondContact O-CB 3.47Å; R444-S448 PolarHBondContact O-N 3.04Å; R444-S448 PolarHBondContact O-OG 3.46Å
445	R	82.7	Confident	72.7	Confident	70 Å²	70	56.9 Å²	56.9	26%	0.264	29%	0.29	S	S	.	.	H	α-helix	trans	-73	-37	-179.4	-67.5	-174.9	-50.2	-124	27.6	112.6	D281 E284 D441 L442 E443 S448 T449	D281-R445 IonicContact OD1-CZ 3.38Å; D281-R445 IonicContact OD1-NH2 2.97Å; D281-R445 PolarHBondContact OD1-NH2 3.23Å; E284-R445 VanDerWaalsContact CD-NE 3.32Å; E284-R445 WeakPolarHBondContact OE1-CB 3.36Å; E284-R445 IonicContact OE1-NE 3.26Å; E284-R445 PolarHBondContact OE1-NE 2.81Å; E284-R445 IonicContact OE2-CZ 2.84Å; E284-R445 IonicContact OE2-NE 2.68Å; E284-R445 PolarHBondContact OE2-NE 2.88Å; E284-R445 IonicContact OE2-NH2 3.69Å; E284-R445 PolarHBondContact OE2-NH2 3.47Å; D441-R445 VanDerWaalsContact O-CG 3.29Å; D441-R445 WeakPolarHBondContact O-CG 3.22Å; D441-R445 PolarHBondContact O-N 3.16Å; D441-R445 VanDerWaalsContact O-N 3.16Å; L442-R445 PolarHBondContact O-N 2.96Å; L442-R445 VanDerWaalsContact O-N 3.11Å; E443-R445 VanDerWaalsContact C-N 3.34Å; E443-R445 PolarHBondContact O-N 2.92Å; R445-S448 PolarHBondContact O-OG 2.99Å; R445-T449 PolarHBondContact O-N 3.44Å; R445-T449 PolarHBondContact O-OG1 3.18Å
446	V	79.6	Confident	70.3	Confident	17 Å²	17	63.2 Å²	63.2	10%	0.103	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-46.3	173.1	177.6	0	0	0	0	109.5	I287 L442 E443 S448 T449 F450	I287-V446 HydrophobicContact CD1-CG2 4.35Å; I287-V446 HydrophobicContact CG2-CG1 4.07Å; I287-V446 HydrophobicContact CG2-CG2 4.35Å; L442-V446 HydrophobicContact CD1-CG2 3.83Å; L442-V446 HydrophobicContact CG-CG2 4.15Å; L442-V446 VanDerWaalsContact O-CG2 3.31Å; L442-V446 WeakPolarHBondContact O-CG2 3.34Å; L442-V446 PolarHBondContact O-N 3.43Å; E443-V446 PolarHBondContact O-N 3.42Å; V446-S448 PolarHBondContact O-N 2.98Å; V446-T449 WeakPolarHBondContact O-CB 3.48Å; V446-T449 PolarHBondContact O-N 3.23Å; V446-F450 HydrophobicContact CG1-CD2 4.04Å; V446-F450 HydrophobicContact CG1-CE2 3.53Å; V446-F450 WeakPolarHBondContact O-CD2 3.4Å; V446-F450 PolarHBondContact O-N 3.11Å
447	T	73.4	Confident	67.6	Low	76 Å²	76	68.7 Å²	68.7	47%	0.466	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-39.8	178.8	-51.4	0	0	0	0	112.9	E443 T449 F450 S451	E443-T447 VanDerWaalsContact O-CB 3.27Å; E443-T447 WeakPolarHBondContact O-CB 3.42Å; E443-T447 PolarHBondContact O-N 3.31Å; E443-T447 PolarHBondContact O-OG1 3.34Å; T447-T449 VanDerWaalsContact C-N 3.27Å; T447-T449 PolarHBondContact O-N 3.49Å; T447-F450 WeakPolarHBondContact O-CB 3.38Å; T447-F450 PolarHBondContact O-N 2.95Å; T447-F450 VanDerWaalsContact O-N 3.08Å; T447-S451 PolarHBondContact O-N 3.15Å; T447-S451 PolarHBondContact O-OG 3.25Å
448	S	71.3	Confident	64.9	Low	57 Å²	57	68.1 Å²	68.1	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-36.1	176.3	65.6	0	0	0	0	112.2	R444 R445 V446 F450 S451 N452	R444-S448 WeakPolarHBondContact O-CB 3.47Å; R444-S448 PolarHBondContact O-N 3.04Å; R444-S448 PolarHBondContact O-OG 3.46Å; R445-S448 PolarHBondContact O-OG 2.99Å; V446-S448 PolarHBondContact O-N 2.98Å; S448-F450 VanDerWaalsContact C-N 3.29Å; S448-F450 PolarHBondContact O-N 3.29Å; S448-S451 WeakPolarHBondContact CA-OG 3.46Å; S448-S451 PolarHBondContact O-N 2.83Å; S448-S451 PolarHBondContact O-OG 3.21Å; S448-N452 PolarHBondContact O-N 2.86Å
449	T	65	Low	62.1	Low	49 Å²	49	74.4 Å²	74.4	30%	0.301	40%	0.397	S	S	.	.	H	α-helix	trans	-64.8	-33.3	174.3	-50	0	0	0	0	111.5	R291 R445 V446 T447	R291-T449 PolarHBondContact NH2-O 2.91Å; R291-T449 VanDerWaalsContact NH2-O 3.15Å; R445-T449 PolarHBondContact O-N 3.44Å; R445-T449 PolarHBondContact O-OG1 3.18Å; V446-T449 WeakPolarHBondContact O-CB 3.48Å; V446-T449 PolarHBondContact O-N 3.23Å; T447-T449 VanDerWaalsContact C-N 3.27Å; T447-T449 PolarHBondContact O-N 3.49Å
450	F	61.5	Low	59.4	Low	50 Å²	50	85.3 Å²	85.3	22%	0.219	44%	0.44	C	S	.	.	H	α-helix	trans	-64.7	-42.5	173.1	-77.6	-80.3	0	0	0	112.7	N358 V446 T447 S448	N358-F450 WeakPolarHBondContact ND2-CE1 3.29Å; V446-F450 HydrophobicContact CG1-CD2 4.04Å; V446-F450 HydrophobicContact CG1-CE2 3.53Å; V446-F450 WeakPolarHBondContact O-CD2 3.4Å; V446-F450 PolarHBondContact O-N 3.11Å; T447-F450 WeakPolarHBondContact O-CB 3.38Å; T447-F450 PolarHBondContact O-N 2.95Å; T447-F450 VanDerWaalsContact O-N 3.08Å; S448-F450 VanDerWaalsContact C-N 3.29Å; S448-F450 PolarHBondContact O-N 3.29Å
451	S	51.4	Low	56.5	Low	71 Å²	71	91.3 Å²	91.3	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-73.4	-34.4	-174.1	37.4	0	0	0	0	115.2	T447 S448 E453	T447-S451 PolarHBondContact O-N 3.15Å; T447-S451 PolarHBondContact O-OG 3.25Å; S448-S451 WeakPolarHBondContact CA-OG 3.46Å; S448-S451 PolarHBondContact O-N 2.83Å; S448-S451 PolarHBondContact O-OG 3.21Å; S451-E453 VanDerWaalsContact C-N 3.28Å; S451-E453 PolarHBondContact O-N 3.45Å
452	N	48.2	Very low	53.7	Low	114 Å²	114	97.3 Å²	97.3	61%	0.61	50%	0.499	S	S	*	.	H	α-helix	trans	-70.6	-20.5	-174.4	-89	-7.3	0	0	0	114.1	S448 S455	S448-N452 PolarHBondContact O-N 2.86Å; N452-S455 PolarHBondContact O-OG 3.45Å
453	E	45.6	Very low	50.8	Low	70 Å²	70	107.9 Å²	107.9	33%	0.327	54%	0.54	S	S	.	.	H	α-helix	trans	-87	-23.8	-175.2	-72	176.1	-153.4	0	0	113.8	R291 L295 S451 S455	R291-E453 IonicContact CZ-OE1 3.02Å; R291-E453 IonicContact CZ-OE2 3.92Å; R291-E453 IonicContact NH2-OE1 3.99Å; R291-E453 PolarHBondContact NH2-OE1 3.41Å; R291-E453 VanDerWaalsContact NH2-OE1 3.08Å; R291-E453 IonicContact NH2-OE2 3.58Å; R291-E453 PolarHBondContact NH2-OE2 3.2Å; L295-E453 WeakPolarHBondContact CD1-OE2 3.37Å; S451-E453 VanDerWaalsContact C-N 3.28Å; S451-E453 PolarHBondContact O-N 3.45Å; E453-S455 VanDerWaalsContact C-N 3.3Å
454	F	43.3	Very low	48.1	Very low	176 Å²	176	112.7 Å²	112.7	77%	0.772	57%	0.572	S	S	*	*	H	α-helix	trans	-75.3	-19.3	174.2	-77.2	-76.9	0	0	0	113.1
455	S	37.4	Very low	45.3	Very low	71 Å²	71	114 Å²	114	50%	0.497	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-15.7	-180	34.3	0	0	0	0	115	N452 E453	N452-S455 PolarHBondContact O-OG 3.45Å; E453-S455 VanDerWaalsContact C-N 3.3Å
456	N	37.7	Very low	42.5	Very low	138 Å²	138	113.9 Å²	113.9	74%	0.738	60%	0.599	S	S	*	*	S	Bend	trans	-93.8	-9.2	-171.9	-81.2	-9.1	0	0	0	115.3
457	D	32.6	Very low	39.9	Very low	121 Å²	121	119.4 Å²	119.4	65%	0.647	64%	0.635	S	S	*	*			trans	-102.2	57.5	177	-77.4	-28.4	0	0	0	111.2	K299	K299-D457 IonicContact NZ-OD2 2.75Å; K299-D457 PolarHBondContact NZ-OD2 3.11Å
458	S	31.2	Very low	37.5	Very low	101 Å²	101	121.1 Å²	121.1	71%	0.706	64%	0.64	S	S	*	*			trans	-99.6	61.8	170.4	67.3	0	0	0	0	111.1
459	N	29	Very low	35.5	Very low	154 Å²	154	125.6 Å²	125.6	82%	0.824	65%	0.654	S	S	*	*			trans	-160.6	52.6	171.5	-116.5	3.5	0	0	0	112.7
460	Y	31.2	Very low	33.8	Very low	231 Å²	231	131.9 Å²	131.9	91%	0.906	68%	0.68	S	S	*	*	S	Bend	trans	-152.3	145.4	154.7	-99.3	-74.6	0	0	0	110.6
461	D	26.3	Very low	32.1	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	70%	0.699	S	S	*	*			trans	-62.7	132.6	-157.5	-66.5	-57.4	0	0	0	116.6	Y463	D461-Y463 PolarHBondContact O-N 2.71Å
462	Q	26.8	Very low	31	Very low	165 Å²	165	138.4 Å²	138.4	77%	0.771	71%	0.712	S	S	*	*	S	Bend		27.4	79.3	124.4	-157.5	168.9	35.6	0	0	116.1
463	Y	26.5	Very low	30.1	Very low	223 Å²	223	139.4 Å²	139.4	88%	0.875	72%	0.722	S	S	*	*			trans	166.7	59.7	143.5	-81	-62.1	0	0	0	109.7	D461	D461-Y463 PolarHBondContact O-N 2.71Å
464	T	26.7	Very low	29.5	Very low	135 Å²	135	142.5 Å²	142.5	83%	0.828	74%	0.74	S	S	*	*	S	Bend	trans	-142.8	138.1	163.8	43.9	0	0	0	0	110.5
465	L	24.8	Very low	29.7	Very low	167 Å²	167	142 Å²	142	87%	0.874	74%	0.741	S	S	*	*			trans	-42.1	132.6	-171.6	-70.8	102.6	0	0	0	114.3
466	S	22.2	Very low	30.6	Very low	69 Å²	69	146.7 Å²	146.7	48%	0.483	76%	0.755	S	S	.	*			trans	-33.9	136.4	159.5	48.9	0	0	0	0	113.8	I468	S466-I468 PolarHBondContact O-N 3.09Å; S466-I468 WeakPolarHBondContact OG-CD1 3.4Å; S466-I468 VanDerWaalsContact OG-CG1 3.31Å; S466-I468 WeakPolarHBondContact OG-CG1 3.41Å
467	P	25.4	Very low	31.9	Very low	133 Å²	133	141.4 Å²	141.4	86%	0.864	73%	0.726	S	S	*	*			trans	-74.7	78.8	168.3	32.5	-31.1	0	0	0	108.4
468	I	24.3	Very low	33.8	Very low	112 Å²	112	137.7 Å²	137.7	57%	0.574	71%	0.709	S	S	*	*			trans	-95.8	117.8	170	-52	174.4	0	0	0	105.5	S466	S466-I468 PolarHBondContact O-N 3.09Å; S466-I468 WeakPolarHBondContact OG-CD1 3.4Å; S466-I468 VanDerWaalsContact OG-CG1 3.31Å; S466-I468 WeakPolarHBondContact OG-CG1 3.41Å
469	H	28.8	Very low	36	Very low	151 Å²	151	136.7 Å²	136.7	70%	0.699	70%	0.702	S	S	*	*			trans	108.4	45	171.4	-54.6	92.9	0	0	0	119.4
470	H	29.6	Very low	38.4	Very low	180 Å²	180	129.4 Å²	129.4	83%	0.833	66%	0.663	S	S	*	*			trans	-96.2	44.3	140.9	-73.2	-53.1	0	0	0	111	T472	H470-T472 PolarHBondContact O-N 2.93Å
471	Q	24.9	Very low	40.9	Very low	132 Å²	132	118.6 Å²	118.6	62%	0.617	62%	0.621	S	S	*	*			trans	-86.1	105.2	170.5	-80.3	-176.1	6.1	0	0	109.7	T473	Q471-T473 PolarHBondContact O-N 2.97Å
472	T	27.6	Very low	43.6	Very low	127 Å²	127	115.1 Å²	115.1	78%	0.779	60%	0.604	S	S	*	*			trans	67.1	38.1	133.6	-19.5	0	0	0	0	117.7	H470	H470-T472 PolarHBondContact O-N 2.93Å
473	T	29.3	Very low	46.4	Very low	134 Å²	134	114 Å²	114	82%	0.822	59%	0.593	S	S	*	*			trans	-90.2	117.1	152.2	24.4	0	0	0	0	107.8	Q471 E475	Q471-T473 PolarHBondContact O-N 2.97Å; T473-E475 PolarHBondContact O-N 2.91Å
474	L	34.8	Very low	49.1	Very low	135 Å²	135	103.4 Å²	103.4	71%	0.707	55%	0.552	S	S	*	*			trans	-31	129.5	168.7	-96	127.8	0	0	0	110.2	Q476	L474-Q476 WeakPolarHBondContact O-CG 3.47Å; L474-Q476 PolarHBondContact O-N 3.42Å
475	E	46	Very low	52	Low	167 Å²	167	97.1 Å²	97.1	78%	0.78	51%	0.513	S	S	*	.			trans	-48.9	90.5	170.5	-72.7	172.5	157.2	0	0	108.9	T473	T473-E475 PolarHBondContact O-N 2.91Å
476	Q	57	Low	55	Low	168 Å²	168	94.1 Å²	94.1	79%	0.785	49%	0.494	S	S	*	.			trans	-95.1	112.3	176.4	-80.4	-175.6	-1.8	0	0	105.5	L474	L474-Q476 WeakPolarHBondContact O-CG 3.47Å; L474-Q476 PolarHBondContact O-N 3.42Å
477	L	64.2	Low	58.1	Low	27 Å²	27	94.1 Å²	94.1	14%	0.141	49%	0.493	C	S	.	.			trans	-44.3	134.6	173.5	-171	75.4	0	0	0	109.6	I439 L440 E443 S479 L481 V482 L485	I439-L477 HydrophobicContact CG2-CD1 3.95Å; I439-L477 HydrophobicContact CG2-CD2 4.1Å; L440-L477 HydrophobicContact CD2-CD1 4.23Å; E443-L477 HydrophobicContact CB-CD1 4.14Å; E443-L477 HydrophobicContact CG-CD1 4.31Å; E443-L477 WeakPolarHBondContact OE2-CD1 3.27Å; L477-S479 PolarHBondContact O-N 2.71Å; L477-L481 HydrophobicContact CD1-CB 4.29Å; L477-L481 HydrophobicContact CD1-CD1 3.98Å; L477-L481 HydrophobicContact CD2-CB 3.76Å; L477-L481 HydrophobicContact CG-CB 3.82Å; L477-L481 HydrophobicContact CG-CD1 4.33Å; L477-V482 HydrophobicContact CB-CG2 3.93Å; L477-V482 HydrophobicContact CD2-CG2 3.93Å; L477-V482 HydrophobicContact CG-CG2 4.22Å; L477-V482 WeakPolarHBondContact O-CG2 3.25Å; L477-L485 HydrophobicContact CD2-CD1 4.14Å
478	P	73	Confident	61.3	Low	43 Å²	43	88.1 Å²	88.1	28%	0.279	45%	0.453	S	S	.	.			trans	-47.6	139.1	178.1	-30.8	34.6	0	0	0	112.9	L403 C480 L481 V482	L403-P478 HydrophobicContact CD2-CB 4.2Å; L403-P478 HydrophobicContact CD2-CG 4.14Å; P478-C480 PolarHBondContact O-N 2.96Å; P478-C480 VanDerWaalsContact O-N 3.14Å; P478-L481 HydrophobicContact CB-CD1 4.35Å; P478-L481 HydrophobicContact CG-CD1 4.21Å; P478-L481 PolarHBondContact O-N 2.92Å; P478-V482 PolarHBondContact O-N 2.83Å; P478-V482 VanDerWaalsContact O-N 3.13Å
479	S	77.4	Confident	64.4	Low	80 Å²	80	83.7 Å²	83.7	56%	0.559	43%	0.43	S	S	*	.	H	α-helix	trans	-52.5	-38.9	-175.5	39.6	0	0	0	0	113.5	E400 L477 L481 V482 R483	E400-S479 PolarHBondContact OE1-OG 3.03Å; L477-S479 PolarHBondContact O-N 2.71Å; S479-L481 VanDerWaalsContact C-N 3.35Å; S479-L481 PolarHBondContact O-N 3.43Å; S479-V482 PolarHBondContact O-N 3.03Å; S479-R483 WeakPolarHBondContact O-CB 3.13Å; S479-R483 PolarHBondContact O-N 3.45Å
480	C	80	Confident	67.4	Low	2 Å²	2	79.6 Å²	79.6	1%	0.014	42%	0.416	C	S	.	.	H	α-helix	trans	-58.2	-43.2	175.7	54.5	0	0	0	0	113.2	E400 P478 R483 A484	E400-C480 PolarHBondContact OE1-N 2.91Å; E400-C480 VanDerWaalsContact OE2-CB 3.28Å; E400-C480 WeakPolarHBondContact OE2-CB 3.42Å; P478-C480 PolarHBondContact O-N 2.96Å; P478-C480 VanDerWaalsContact O-N 3.14Å; C480-R483 PolarHBondContact O-N 3.33Å; C480-A484 WeakPolarHBondContact O-CB 3.33Å; C480-A484 PolarHBondContact O-N 3.14Å
481	L	82.7	Confident	70.3	Confident	4 Å²	4	72 Å²	72	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-73.8	-37.7	-179.2	-70.8	170.7	0	0	0	111.4	M283 L403 S407 I439 L477 P478 S479 A484 L485	M283-L481 HydrophobicContact CE-CD2 4.5Å; L403-L481 HydrophobicContact CD1-CD1 4.29Å; S407-L481 WeakPolarHBondContact OG-CD2 3.15Å; I439-L481 HydrophobicContact CG2-CB 4.09Å; I439-L481 HydrophobicContact CG2-CD1 3.95Å; I439-L481 HydrophobicContact CG2-CD2 3.9Å; I439-L481 HydrophobicContact CG2-CG 4.21Å; L477-L481 HydrophobicContact CD1-CB 4.29Å; L477-L481 HydrophobicContact CD1-CD1 3.98Å; L477-L481 HydrophobicContact CD2-CB 3.76Å; L477-L481 HydrophobicContact CG-CB 3.82Å; L477-L481 HydrophobicContact CG-CD1 4.33Å; P478-L481 HydrophobicContact CB-CD1 4.35Å; P478-L481 HydrophobicContact CG-CD1 4.21Å; P478-L481 PolarHBondContact O-N 2.92Å; S479-L481 VanDerWaalsContact C-N 3.35Å; S479-L481 PolarHBondContact O-N 3.43Å; L481-A484 PolarHBondContact O-N 2.99Å; L481-L485 WeakPolarHBondContact O-CB 3.36Å; L481-L485 WeakPolarHBondContact O-CG 3.4Å; L481-L485 PolarHBondContact O-N 3.02Å; L481-L485 VanDerWaalsContact O-N 3.09Å
482	V	83.6	Confident	73.6	Confident	64 Å²	64	65.8 Å²	65.8	39%	0.388	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-47.4	171.9	177.9	0	0	0	0	110.3	L477 P478 S479 A484 L485 H486	L477-V482 HydrophobicContact CB-CG2 3.93Å; L477-V482 HydrophobicContact CD2-CG2 3.93Å; L477-V482 HydrophobicContact CG-CG2 4.22Å; L477-V482 WeakPolarHBondContact O-CG2 3.25Å; P478-V482 PolarHBondContact O-N 2.83Å; P478-V482 VanDerWaalsContact O-N 3.13Å; S479-V482 PolarHBondContact O-N 3.03Å; V482-A484 VanDerWaalsContact C-N 3.31Å; V482-A484 PolarHBondContact O-N 3.35Å; V482-L485 PolarHBondContact O-N 2.95Å; V482-H486 WeakPolarHBondContact O-CB 3.36Å; V482-H486 PolarHBondContact O-N 3.32Å
483	R	84.7	Confident	76.7	Confident	140 Å²	140	61.3 Å²	61.3	53%	0.528	33%	0.326	S	S	.	.	H	α-helix	trans	-59.5	-41.7	177.4	-178.4	171.5	65.6	-169.9	-6.5	111.8	E400 D408 S479 C480 L485	E400-R483 IonicContact OE2-NH2 3.89Å; D408-R483 IonicContact OD1-CZ 2.58Å; D408-R483 IonicContact OD1-NE 2.63Å; D408-R483 PolarHBondContact OD1-NE 2.78Å; D408-R483 IonicContact OD1-NH2 3.83Å; D408-R483 PolarHBondContact OD1-NH2 3.39Å; D408-R483 IonicContact OD2-CZ 2.77Å; D408-R483 IonicContact OD2-NH2 3.72Å; D408-R483 PolarHBondContact OD2-NH2 3.04Å; S479-R483 WeakPolarHBondContact O-CB 3.13Å; S479-R483 PolarHBondContact O-N 3.45Å; C480-R483 PolarHBondContact O-N 3.33Å; R483-L485 VanDerWaalsContact C-N 3.3Å; R483-L485 PolarHBondContact O-N 2.98Å
484	A	83.8	Confident	79.7	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.017	31%	0.312	C	S	.	.	H	α-helix	trans	-64	-34.4	178.3	0	0	0	0	0	113.2	A411 C480 L481 V482	A411-A484 HydrophobicContact CB-CB 3.7Å; C480-A484 WeakPolarHBondContact O-CB 3.33Å; C480-A484 PolarHBondContact O-N 3.14Å; L481-A484 PolarHBondContact O-N 2.99Å; V482-A484 VanDerWaalsContact C-N 3.31Å; V482-A484 PolarHBondContact O-N 3.35Å
485	L	87.4	Confident	82.4	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-89.8	-25	-174.8	-74.4	176.6	0	0	0	114.9	Y432 L435 L436 I439 L477 L481 V482 R483 P487 F488 E489	Y432-L485 HydrophobicContact CE2-CB 4.11Å; Y432-L485 HydrophobicContact CE2-CD2 3.95Å; L435-L485 HydrophobicContact CD2-CD2 3.46Å; L435-L485 VanDerWaalsContact CD2-CD2 3.46Å; L435-L485 HydrophobicContact CG-CD2 3.6Å; L436-L485 HydrophobicContact CD1-CD1 3.81Å; I439-L485 HydrophobicContact CB-CD1 4.26Å; I439-L485 HydrophobicContact CD1-CD1 3.59Å; I439-L485 HydrophobicContact CD1-CD2 3.27Å; I439-L485 HydrophobicContact CD1-CG 3.53Å; I439-L485 HydrophobicContact CG2-CD1 4.03Å; L477-L485 HydrophobicContact CD2-CD1 4.14Å; L481-L485 WeakPolarHBondContact O-CB 3.36Å; L481-L485 WeakPolarHBondContact O-CG 3.4Å; L481-L485 PolarHBondContact O-N 3.02Å; L481-L485 VanDerWaalsContact O-N 3.09Å; V482-L485 PolarHBondContact O-N 2.95Å; R483-L485 VanDerWaalsContact C-N 3.3Å; R483-L485 PolarHBondContact O-N 2.98Å; L485-P487 VanDerWaalsContact C-CD 3.42Å; L485-F488 PolarHBondContact O-N 2.93Å; L485-E489 PolarHBondContact O-N 3.41Å
486	H	88	Confident	84.7	Confident	103 Å²	103	47.5 Å²	47.5	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-51.5	-42.1	-171.1	-174.3	-81.2	0	0	0	115	V482 F488 E489 T490	V482-H486 WeakPolarHBondContact O-CB 3.36Å; V482-H486 PolarHBondContact O-N 3.32Å; H486-F488 VanDerWaalsContact C-N 3.32Å; H486-F488 PolarHBondContact O-N 3.07Å; H486-E489 PolarHBondContact O-N 3.14Å; H486-T490 VanDerWaalsContact CE1-CG2 3.49Å; H486-T490 WeakPolarHBondContact CE1-CG2 3.31Å; H486-T490 WeakPolarHBondContact O-CG2 3.49Å; H486-T490 PolarHBondContact O-N 3.43Å; H486-T490 PolarHBondContact O-OG1 2.96Å
487	P	88.7	Confident	86.4	Confident	69 Å²	69	40.7 Å²	40.7	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-62.3	-38	178.1	-22.5	34.7	0	0	0	113.2	L485 T490 A491	L485-P487 VanDerWaalsContact C-CD 3.42Å; P487-T490 PolarHBondContact O-OG1 3.37Å; P487-A491 WeakPolarHBondContact O-CB 3.46Å; P487-A491 PolarHBondContact O-N 3.44Å
488	F	90.6	Very high	87.8	Confident	8 Å²	8	42 Å²	42	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-77.1	-36	179.8	-56.1	-70.4	0	0	0	111.6	L414 L428 E429 Y432 L435 L485 H486 A491 Y492	L414-F488 HydrophobicContact CB-CE2 4.04Å; L414-F488 HydrophobicContact CB-CZ 3.68Å; L414-F488 HydrophobicContact CD1-CE2 4.36Å; L428-F488 HydrophobicContact CB-CD1 3.83Å; L428-F488 HydrophobicContact CB-CE1 3.85Å; L428-F488 HydrophobicContact CD1-CE1 3.85Å; L428-F488 HydrophobicContact CD1-CZ 4.18Å; L428-F488 HydrophobicContact CG-CE1 4.47Å; E429-F488 HydrophobicContact CG-CD1 4.26Å; Y432-F488 HydrophobicContact CD2-CB 3.63Å; Y432-F488 HydrophobicContact CE2-CB 4.14Å; L435-F488 HydrophobicContact CD2-CD2 4.11Å; L435-F488 HydrophobicContact CD2-CG 4.41Å; L485-F488 PolarHBondContact O-N 2.93Å; H486-F488 VanDerWaalsContact C-N 3.32Å; H486-F488 PolarHBondContact O-N 3.07Å; F488-A491 PolarHBondContact O-N 3.01Å; F488-Y492 WeakPolarHBondContact O-CB 3.33Å; F488-Y492 PolarHBondContact O-N 3.03Å
489	E	91.3	Very high	88.7	Confident	19 Å²	19	44.1 Å²	44.1	9%	0.089	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-50.3	174.8	-170.5	-177.6	177.7	0	0	111.2	Y432 L485 H486 A491 Y492 L493 L541 K544	Y432-E489 HydrophobicContact CE1-CB 3.89Å; Y432-E489 HydrophobicContact CE1-CG 3.76Å; Y432-E489 HydrophobicContact CE2-CB 3.9Å; L485-E489 PolarHBondContact O-N 3.41Å; H486-E489 PolarHBondContact O-N 3.14Å; E489-A491 VanDerWaalsContact C-N 3.34Å; E489-A491 PolarHBondContact O-N 3.4Å; E489-Y492 PolarHBondContact O-N 2.98Å; E489-L493 HydrophobicContact CG-CD1 4.12Å; E489-L493 HydrophobicContact CG-CG 4.47Å; E489-L493 WeakPolarHBondContact O-CG 3.45Å; E489-L493 PolarHBondContact O-N 2.96Å; E489-L541 HydrophobicContact CG-CD1 4.01Å; E489-K544 WeakPolarHBondContact OE1-CD 3.13Å; E489-K544 WeakPolarHBondContact OE1-CE 3.35Å; E489-K544 IonicContact OE1-NZ 3.26Å; E489-K544 PolarHBondContact OE1-NZ 3.24Å; E489-K544 IonicContact OE2-NZ 3.74Å
490	T	91.4	Very high	89.4	Confident	65 Å²	65	40.4 Å²	40.4	40%	0.399	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-42	180	50.2	0	0	0	0	112	H486 P487 L493 S494	H486-T490 VanDerWaalsContact CE1-CG2 3.49Å; H486-T490 WeakPolarHBondContact CE1-CG2 3.31Å; H486-T490 WeakPolarHBondContact O-CG2 3.49Å; H486-T490 PolarHBondContact O-N 3.43Å; H486-T490 PolarHBondContact O-OG1 2.96Å; P487-T490 PolarHBondContact O-OG1 3.37Å; T490-L493 PolarHBondContact O-N 3.29Å; T490-S494 WeakPolarHBondContact O-CB 3.45Å; T490-S494 PolarHBondContact O-N 3.44Å
491	A	90.6	Very high	90.1	Very high	20 Å²	20	43.4 Å²	43.4	17%	0.165	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-44.5	174.5	0	0	0	0	0	112.3	E429 P487 F488 E489 S494 R495	E429-A491 HydrophobicContact CB-CB 3.94Å; E429-A491 HydrophobicContact CG-CB 3.6Å; P487-A491 WeakPolarHBondContact O-CB 3.46Å; P487-A491 PolarHBondContact O-N 3.44Å; F488-A491 PolarHBondContact O-N 3.01Å; E489-A491 VanDerWaalsContact C-N 3.34Å; E489-A491 PolarHBondContact O-N 3.4Å; A491-S494 PolarHBondContact O-N 3.27Å; A491-R495 WeakPolarHBondContact O-CB 3.37Å; A491-R495 WeakPolarHBondContact O-CG 3.47Å; A491-R495 PolarHBondContact O-N 3.1Å
492	Y	93.5	Very high	90.7	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.6	-46.4	176.7	178.3	-99.2	0	0	0	111.6	E429 G430 Y432 P433 F488 E489 S494 R495 S496 E531 V535 V545	E429-Y492 WeakPolarHBondContact O-CA 3.11Å; E429-Y492 WeakPolarHBondContact O-CB 3.33Å; E429-Y492 WeakPolarHBondContact O-CD2 3.49Å; G430-Y492 WeakPolarHBondContact O-CE2 3.34Å; Y432-Y492 HydrophobicContact CD1-CD1 4.22Å; Y432-Y492 HydrophobicContact CD1-CG 4.27Å; Y432-Y492 HydrophobicContact CG-CG 4.44Å; P433-Y492 HydrophobicContact CG-CE1 4.18Å; P433-Y492 HydrophobicContact CG-CE2 4.19Å; F488-Y492 WeakPolarHBondContact O-CB 3.33Å; F488-Y492 PolarHBondContact O-N 3.03Å; E489-Y492 PolarHBondContact O-N 2.98Å; Y492-S494 PolarHBondContact O-N 2.69Å; Y492-R495 PolarHBondContact O-N 3.37Å; Y492-S496 PolarHBondContact O-N 3.37Å; Y492-E531 PolarHBondContact OH-OE2 2.78Å; Y492-V535 HydrophobicContact CE1-CG2 3.67Å; Y492-V535 VanDerWaalsContact OH-CG2 3.29Å; Y492-V535 WeakPolarHBondContact OH-CG2 3.04Å; Y492-V545 HydrophobicContact CE1-CG2 4.19Å
493	L	93	Very high	91	Very high	32 Å²	32	50.7 Å²	50.7	17%	0.168	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-43.9	177.8	-69.8	174	0	0	0	111.5	E489 T490 R495 S496 V497 L541 K544 V545 N548	E489-L493 HydrophobicContact CG-CD1 4.12Å; E489-L493 HydrophobicContact CG-CG 4.47Å; E489-L493 WeakPolarHBondContact O-CG 3.45Å; E489-L493 PolarHBondContact O-N 2.96Å; T490-L493 PolarHBondContact O-N 3.29Å; L493-R495 VanDerWaalsContact C-N 3.34Å; L493-R495 PolarHBondContact O-N 3.48Å; L493-S496 PolarHBondContact O-N 2.9Å; L493-S496 PolarHBondContact O-OG 3.46Å; L493-V497 WeakPolarHBondContact O-CG2 3.47Å; L493-V497 PolarHBondContact O-N 3.13Å; L493-V497 VanDerWaalsContact O-N 3.11Å; L493-L541 HydrophobicContact CD2-CD1 4.25Å; L493-K544 HydrophobicContact CD1-CB 4.14Å; L493-K544 HydrophobicContact CD1-CD 4.14Å; L493-K544 HydrophobicContact CD2-CB 3.85Å; L493-V545 HydrophobicContact CD2-CG2 3.71Å; L493-N548 PolarHBondContact O-ND2 3.33Å
494	S	93	Very high	91.4	Very high	76 Å²	76	44 Å²	44	53%	0.531	23%	0.227	S	C	.	.	H	α-helix	trans	-60.8	-41.9	175.4	-171.7	0	0	0	0	112.4	T490 A491 Y492 S498	T490-S494 WeakPolarHBondContact O-CB 3.45Å; T490-S494 PolarHBondContact O-N 3.44Å; A491-S494 PolarHBondContact O-N 3.27Å; Y492-S494 PolarHBondContact O-N 2.69Å; S494-S498 PolarHBondContact O-N 3.21Å; S494-S498 VanDerWaalsContact O-N 3.11Å; S494-S498 PolarHBondContact O-OG 2.9Å
495	R	91.1	Very high	91.8	Very high	71 Å²	71	46.9 Å²	46.9	27%	0.268	25%	0.245	S	C	.	.	H	α-helix	trans	-66.8	-40.2	176.4	-74.9	178.4	177	-168.1	2.8	112.1	E426 E429 A491 Y492 L493 V497 S498 R499	E426-R495 PolarHBondContact O-NH1 3.3Å; E429-R495 IonicContact OE2-CZ 3.27Å; E429-R495 IonicContact OE2-NE 2.8Å; E429-R495 PolarHBondContact OE2-NE 3.42Å; E429-R495 IonicContact OE2-NH2 2.94Å; E429-R495 PolarHBondContact OE2-NH2 2.95Å; A491-R495 WeakPolarHBondContact O-CB 3.37Å; A491-R495 WeakPolarHBondContact O-CG 3.47Å; A491-R495 PolarHBondContact O-N 3.1Å; Y492-R495 PolarHBondContact O-N 3.37Å; L493-R495 VanDerWaalsContact C-N 3.34Å; L493-R495 PolarHBondContact O-N 3.48Å; R495-V497 PolarHBondContact O-N 3.21Å; R495-S498 PolarHBondContact O-N 3Å; R495-R499 WeakPolarHBondContact O-CG 3.5Å; R495-R499 PolarHBondContact O-N 3.46Å
496	S	93	Very high	92	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.7	-44	177.3	73.6	0	0	0	0	111.3	Y492 L493 S498 R499 L500 N548	Y492-S496 PolarHBondContact O-N 3.37Å; L493-S496 PolarHBondContact O-N 2.9Å; L493-S496 PolarHBondContact O-OG 3.46Å; S496-S498 VanDerWaalsContact C-N 3.34Å; S496-S498 PolarHBondContact O-N 3.39Å; S496-R499 PolarHBondContact O-N 3.31Å; S496-L500 WeakPolarHBondContact O-CB 3.38Å; S496-L500 WeakPolarHBondContact O-CG 3.32Å; S496-L500 PolarHBondContact O-N 3.25Å; S496-L500 VanDerWaalsContact O-N 3.08Å; S496-N548 PolarHBondContact OG-ND2 3.2Å
497	V	93.6	Very high	92	Very high	24 Å²	24	46.3 Å²	46.3	15%	0.145	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-45.1	173.8	177.2	0	0	0	0	111	L493 R495 L500 F501 N548	L493-V497 WeakPolarHBondContact O-CG2 3.47Å; L493-V497 PolarHBondContact O-N 3.13Å; L493-V497 VanDerWaalsContact O-N 3.11Å; R495-V497 PolarHBondContact O-N 3.21Å; V497-L500 WeakPolarHBondContact O-CB 3.45Å; V497-L500 PolarHBondContact O-N 2.97Å; V497-F501 HydrophobicContact CG1-CD1 3.99Å; V497-F501 HydrophobicContact CG1-CD2 4.17Å; V497-F501 HydrophobicContact CG1-CE1 3.86Å; V497-F501 HydrophobicContact CG1-CE2 4.05Å; V497-F501 HydrophobicContact CG1-CG 4.17Å; V497-F501 HydrophobicContact CG1-CZ 3.91Å; V497-F501 WeakPolarHBondContact O-CB 3.47Å; V497-F501 WeakPolarHBondContact O-CD1 3.47Å; V497-F501 WeakPolarHBondContact O-CG 3.42Å; V497-F501 PolarHBondContact O-N 3.46Å; V497-N548 HydrophobicContact CG2-CB 3.71Å; V497-N548 WeakPolarHBondContact CG2-OD1 3.45Å
498	S	93.4	Very high	92.1	Very high	55 Å²	55	44.3 Å²	44.3	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-62.2	-49.1	-178.4	-53.5	0	0	0	0	111.5	S494 R495 S496 L500 F501 D502	S494-S498 PolarHBondContact O-N 3.21Å; S494-S498 VanDerWaalsContact O-N 3.11Å; S494-S498 PolarHBondContact O-OG 2.9Å; R495-S498 PolarHBondContact O-N 3Å; S496-S498 VanDerWaalsContact C-N 3.34Å; S496-S498 PolarHBondContact O-N 3.39Å; S498-L500 VanDerWaalsContact C-N 3.28Å; S498-L500 PolarHBondContact O-N 3.05Å; S498-F501 PolarHBondContact O-N 3.49Å; S498-F501 VanDerWaalsContact O-N 3.12Å; S498-D502 WeakPolarHBondContact O-CB 3.44Å; S498-D502 PolarHBondContact O-N 3.03Å
499	R	92	Very high	91.9	Very high	88 Å²	88	47.7 Å²	47.7	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-57.8	-41.3	176.6	-67.3	172.7	-163.7	170.5	3.7	112.2	R495 S496 R503 E531	R495-R499 WeakPolarHBondContact O-CG 3.5Å; R495-R499 PolarHBondContact O-N 3.46Å; S496-R499 PolarHBondContact O-N 3.31Å; R499-R503 VanDerWaalsContact O-CG 3.27Å; R499-R503 WeakPolarHBondContact O-CG 3.47Å; R499-R503 PolarHBondContact O-N 3.23Å; R499-E531 WeakPolarHBondContact CD-OE1 3.33Å; R499-E531 IonicContact CZ-OE1 2.69Å; R499-E531 IonicContact NE-OE1 3.86Å; R499-E531 IonicContact NH1-OE1 3.49Å; R499-E531 PolarHBondContact NH1-OE1 2.88Å; R499-E531 IonicContact NH1-OE2 3.59Å
500	L	93	Very high	91.3	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-45.7	176.7	-74.1	178.7	0	0	0	111.2	S496 V497 S498 R503 V504 T527 A528 E531 N548 L549 L552	S496-L500 WeakPolarHBondContact O-CB 3.38Å; S496-L500 WeakPolarHBondContact O-CG 3.32Å; S496-L500 PolarHBondContact O-N 3.25Å; S496-L500 VanDerWaalsContact O-N 3.08Å; V497-L500 WeakPolarHBondContact O-CB 3.45Å; V497-L500 PolarHBondContact O-N 2.97Å; S498-L500 VanDerWaalsContact C-N 3.28Å; S498-L500 PolarHBondContact O-N 3.05Å; L500-R503 PolarHBondContact O-N 2.91Å; L500-V504 PolarHBondContact O-N 3.35Å; L500-T527 HydrophobicContact CD2-CG2 4.23Å; L500-A528 HydrophobicContact CD2-CB 4.3Å; L500-E531 HydrophobicContact CD2-CG 4.27Å; L500-N548 HydrophobicContact CD1-CB 4.21Å; L500-L549 HydrophobicContact CD1-CG 4.36Å; L500-L552 HydrophobicContact CB-CB 4.42Å; L500-L552 HydrophobicContact CB-CD1 3.79Å; L500-L552 HydrophobicContact CD2-CD1 4.3Å; L500-L552 HydrophobicContact CD2-CD2 4.26Å; L500-L552 VanDerWaalsContact O-CD1 3.23Å; L500-L552 WeakPolarHBondContact O-CD1 3.34Å
501	F	94.7	Very high	90.4	Very high	65 Å²	65	48.9 Å²	48.9	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-70	-39.8	-178.4	-81	21.7	0	0	0	112.9	V497 S498 R503 V504 T505 K551 L555	V497-F501 HydrophobicContact CG1-CD1 3.99Å; V497-F501 HydrophobicContact CG1-CD2 4.17Å; V497-F501 HydrophobicContact CG1-CE1 3.86Å; V497-F501 HydrophobicContact CG1-CE2 4.05Å; V497-F501 HydrophobicContact CG1-CG 4.17Å; V497-F501 HydrophobicContact CG1-CZ 3.91Å; V497-F501 WeakPolarHBondContact O-CB 3.47Å; V497-F501 WeakPolarHBondContact O-CD1 3.47Å; V497-F501 WeakPolarHBondContact O-CG 3.42Å; V497-F501 PolarHBondContact O-N 3.46Å; S498-F501 PolarHBondContact O-N 3.49Å; S498-F501 VanDerWaalsContact O-N 3.12Å; F501-R503 VanDerWaalsContact C-N 3.28Å; F501-R503 PolarHBondContact O-N 3.45Å; F501-V504 PolarHBondContact O-N 3.49Å; F501-T505 WeakPolarHBondContact O-CB 3.29Å; F501-T505 PolarHBondContact O-N 3.25Å; F501-T505 PolarHBondContact O-OG1 3.39Å; F501-K551 HydrophobicContact CE1-CB 3.91Å; F501-K551 HydrophobicContact CZ-CB 3.94Å; F501-L555 HydrophobicContact CB-CD2 3.89Å; F501-L555 HydrophobicContact CD1-CD2 3.65Å; F501-L555 HydrophobicContact CD2-CD2 3.81Å; F501-L555 HydrophobicContact CE1-CB 4.28Å; F501-L555 HydrophobicContact CE1-CD2 4.03Å; F501-L555 HydrophobicContact CE2-CD2 4.17Å; F501-L555 HydrophobicContact CG-CD2 3.52Å; F501-L555 HydrophobicContact CZ-CB 4.42Å; F501-L555 HydrophobicContact CZ-CD2 4.26Å
502	D	93.6	Very high	89.2	Confident	105 Å²	105	53.5 Å²	53.5	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-61.3	-40.6	177.9	-69.3	-22.9	0	0	0	110.6	S498 T505 L506	S498-D502 WeakPolarHBondContact O-CB 3.44Å; S498-D502 PolarHBondContact O-N 3.03Å; D502-T505 PolarHBondContact O-N 2.86Å; D502-L506 VanDerWaalsContact O-CB 3.22Å; D502-L506 WeakPolarHBondContact O-CB 3.45Å; D502-L506 PolarHBondContact O-N 3.13Å
503	R	91	Very high	87.9	Confident	117 Å²	117	58.8 Å²	58.8	44%	0.442	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-42.9	177.1	-70.7	-68.7	177.6	-174	-2.5	112.8	R499 L500 F501 A507 I524 T527	R499-R503 VanDerWaalsContact O-CG 3.27Å; R499-R503 WeakPolarHBondContact O-CG 3.47Å; R499-R503 PolarHBondContact O-N 3.23Å; L500-R503 PolarHBondContact O-N 2.91Å; F501-R503 VanDerWaalsContact C-N 3.28Å; F501-R503 PolarHBondContact O-N 3.45Å; R503-A507 WeakPolarHBondContact O-CB 3.33Å; R503-A507 PolarHBondContact O-N 3.47Å; R503-I524 HydrophobicContact CB-CG1 4.43Å; R503-T527 HydrophobicContact CG-CG2 3.99Å
504	V	92.6	Very high	86.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.8	-48.3	174.9	175.7	0	0	0	0	110.2	L500 F501 L506 A507 F508 I524 L552 L555 F556 K559	L500-V504 PolarHBondContact O-N 3.35Å; F501-V504 PolarHBondContact O-N 3.49Å; V504-L506 VanDerWaalsContact C-N 3.3Å; V504-L506 PolarHBondContact O-N 3.46Å; V504-A507 PolarHBondContact O-N 3.03Å; V504-F508 HydrophobicContact CG1-CD2 3.86Å; V504-F508 HydrophobicContact CG1-CE2 3.94Å; V504-F508 WeakPolarHBondContact O-CD2 3.33Å; V504-F508 PolarHBondContact O-N 2.96Å; V504-F508 VanDerWaalsContact O-N 3.11Å; V504-I524 HydrophobicContact CG2-CD1 4.27Å; V504-I524 HydrophobicContact CG2-CG1 4.44Å; V504-I524 HydrophobicContact CG2-CG2 3.98Å; V504-L552 HydrophobicContact CG2-CD1 3.22Å; V504-L552 HydrophobicContact CG2-CG 4.18Å; V504-L555 HydrophobicContact CB-CD2 4.24Å; V504-L555 HydrophobicContact CG1-CD2 4.25Å; V504-L555 HydrophobicContact CG1-CG 4.15Å; V504-F556 HydrophobicContact CG1-CB 4.43Å; V504-F556 HydrophobicContact CG1-CD2 4.39Å; V504-K559 HydrophobicContact CG1-CG 4.47Å
505	T	92.3	Very high	86.4	Confident	62 Å²	62	56.1 Å²	56.1	38%	0.38	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-40.1	-176.8	-56.5	0	0	0	0	111.6	F501 D502 F508 S509	F501-T505 WeakPolarHBondContact O-CB 3.29Å; F501-T505 PolarHBondContact O-N 3.25Å; F501-T505 PolarHBondContact O-OG1 3.39Å; D502-T505 PolarHBondContact O-N 2.86Å; T505-F508 PolarHBondContact O-N 3.3Å; T505-S509 WeakPolarHBondContact O-CB 3.39Å; T505-S509 PolarHBondContact O-N 3.08Å; T505-S509 PolarHBondContact O-OG 3.34Å
506	L	91.3	Very high	86.2	Confident	92 Å²	92	52.9 Å²	52.9	48%	0.482	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-49.3	175.6	-174.2	150.6	0	0	0	111.1	D502 V504 F508 S509 T510	D502-L506 VanDerWaalsContact O-CB 3.22Å; D502-L506 WeakPolarHBondContact O-CB 3.45Å; D502-L506 PolarHBondContact O-N 3.13Å; V504-L506 VanDerWaalsContact C-N 3.3Å; V504-L506 PolarHBondContact O-N 3.46Å; L506-F508 VanDerWaalsContact C-N 3.3Å; L506-F508 PolarHBondContact O-N 3.48Å; L506-S509 WeakPolarHBondContact CA-OG 3.38Å; L506-S509 PolarHBondContact O-N 3.47Å; L506-S509 PolarHBondContact O-OG 2.86Å; L506-T510 PolarHBondContact O-N 2.87Å; L506-T510 PolarHBondContact O-OG1 2.85Å
507	A	89	Confident	85.8	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-33.8	-179.5	0	0	0	0	0	113.7	R503 V504 T510 P516 E520 I524	R503-A507 WeakPolarHBondContact O-CB 3.33Å; R503-A507 PolarHBondContact O-N 3.47Å; V504-A507 PolarHBondContact O-N 3.03Å; A507-T510 PolarHBondContact O-OG1 2.86Å; A507-T510 VanDerWaalsContact O-OG1 3.07Å; A507-P516 HydrophobicContact CB-CB 4Å; A507-E520 HydrophobicContact CB-CB 4Å; A507-I524 HydrophobicContact CB-CD1 3.75Å; A507-I524 HydrophobicContact CB-CG1 4.35Å
508	F	89.2	Confident	85.5	Confident	26 Å²	26	58.7 Å²	58.7	11%	0.114	33%	0.331	C	S	.	.	H	α-helix	trans	-84.1	-14.9	174.8	-79.7	-89	0	0	0	113.7	V504 T505 L506 P516 F556 K559 T560 L563	V504-F508 HydrophobicContact CG1-CD2 3.86Å; V504-F508 HydrophobicContact CG1-CE2 3.94Å; V504-F508 WeakPolarHBondContact O-CD2 3.33Å; V504-F508 PolarHBondContact O-N 2.96Å; V504-F508 VanDerWaalsContact O-N 3.11Å; T505-F508 PolarHBondContact O-N 3.3Å; L506-F508 VanDerWaalsContact C-N 3.3Å; L506-F508 PolarHBondContact O-N 3.48Å; F508-P516 HydrophobicContact CE1-CG 4.4Å; F508-P516 HydrophobicContact CE2-CG 4.07Å; F508-P516 HydrophobicContact CZ-CG 4.01Å; F508-F556 AromaticContact CE2-CD2 3.66Å; F508-F556 HydrophobicContact CE2-CD2 3.66Å; F508-F556 AromaticContact CE2-CE2 3.71Å; F508-F556 HydrophobicContact CE2-CE2 3.71Å; F508-F556 HydrophobicContact CE2-CG 4.31Å; F508-F556 HydrophobicContact CE2-CZ 4.41Å; F508-F556 HydrophobicContact CZ-CD2 4.14Å; F508-F556 AromaticContact CZ-CE2 3.96Å; F508-F556 HydrophobicContact CZ-CE2 3.96Å; F508-F556 HydrophobicContact CZ-CZ 4.2Å; F508-K559 HydrophobicContact CD1-CB 3.8Å; F508-K559 HydrophobicContact CD2-CB 3.78Å; F508-K559 HydrophobicContact CD2-CG 4.23Å; F508-K559 HydrophobicContact CE1-CB 3.75Å; F508-K559 HydrophobicContact CE2-CB 3.75Å; F508-K559 HydrophobicContact CG-CB 3.81Å; F508-K559 HydrophobicContact CG-CG 4.34Å; F508-K559 HydrophobicContact CZ-CB 3.73Å; F508-T560 WeakPolarHBondContact CZ-OG1 3.49Å; F508-L563 HydrophobicContact CD1-CD1 4.09Å; F508-L563 HydrophobicContact CE1-CD1 3.92Å
509	S	87.1	Confident	85.3	Confident	80 Å²	80	60.9 Å²	60.9	56%	0.559	34%	0.339	S	S	*	.	H	α-helix	trans	-83.6	-30.5	178.4	69.8	0	0	0	0	113.1	T505 L506	T505-S509 WeakPolarHBondContact O-CB 3.39Å; T505-S509 PolarHBondContact O-N 3.08Å; T505-S509 PolarHBondContact O-OG 3.34Å; L506-S509 WeakPolarHBondContact CA-OG 3.38Å; L506-S509 PolarHBondContact O-N 3.47Å; L506-S509 PolarHBondContact O-OG 2.86Å
510	T	79.2	Confident	85.2	Confident	80 Å²	80	58.3 Å²	58.3	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-75	-31.8	176.9	44.4	0	0	0	0	111.9	L506 A507 E520	L506-T510 PolarHBondContact O-N 2.87Å; L506-T510 PolarHBondContact O-OG1 2.85Å; A507-T510 PolarHBondContact O-OG1 2.86Å; A507-T510 VanDerWaalsContact O-OG1 3.07Å; T510-E520 VanDerWaalsContact CB-OE1 3.31Å; T510-E520 WeakPolarHBondContact CB-OE1 3.39Å; T510-E520 PolarHBondContact OG1-OE1 3.44Å
511	S	71.6	Confident	85.1	Confident	28 Å²	28	58.3 Å²	58.3	20%	0.196	33%	0.33	C	S	.	.			trans	-109.5	97.3	-173.6	-65.6	0	0	0	0	112	G515 E520	S511-G515 WeakPolarHBondContact CB-O 3.41Å; S511-G515 PolarHBondContact OG-O 3.3Å; S511-E520 PolarHBondContact OG-OE2 3.42Å
512	T	65.7	Low	84.9	Confident	118 Å²	118	58.4 Å²	58.4	72%	0.724	33%	0.334	S	S	*	.	S	Bend	trans	-81	-21.2	-167.6	52.3	0	0	0	0	115.9
513	T	67.5	Low	84.8	Confident	113 Å²	113	57.8 Å²	57.8	69%	0.693	33%	0.331	S	S	*	.	S	Bend	trans	-132.8	-17.8	-171.8	60.3	0	0	0	0	115.9
514	A	71.3	Confident	84.9	Confident	46 Å²	46	52.3 Å²	52.3	38%	0.38	31%	0.31	S	S	.	.	S	Bend	trans	-119.2	-4	-175.2	0	0	0	0	0	114.1	H587	A514-H587 PolarHBondContact O-CD2 2.82Å; A514-H587 VanDerWaalsContact O-CD2 3.24Å; A514-H587 PolarHBondContact O-NE2 3.12Å
515	G	81.8	Confident	84.9	Confident	5 Å²	5	52.3 Å²	52.3	5%	0.052	31%	0.31	C	S	.	.			trans	76.4	179.1	-168.8	0	0	0	0	0	112.6	S511	S511-G515 WeakPolarHBondContact CB-O 3.41Å; S511-G515 PolarHBondContact OG-O 3.3Å
516	P	86.4	Confident	84.9	Confident	4 Å²	4	53 Å²	53	3%	0.026	31%	0.309	C	S	.	.			trans	-64.5	146.1	-171.6	23.9	-35.6	0	0	0	114	A507 F508 E520 F556 L591	A507-P516 HydrophobicContact CB-CB 4Å; F508-P516 HydrophobicContact CE1-CG 4.4Å; F508-P516 HydrophobicContact CE2-CG 4.07Å; F508-P516 HydrophobicContact CZ-CG 4.01Å; P516-E520 VanDerWaalsContact CA-OE2 3.23Å; P516-E520 WeakPolarHBondContact CA-OE2 3.48Å; P516-E520 HydrophobicContact CB-CB 4.07Å; P516-F556 HydrophobicContact CG-CE2 4.02Å; P516-F556 HydrophobicContact CG-CZ 4.25Å; P516-L591 HydrophobicContact CG-CD1 4.35Å; P516-L591 HydrophobicContact CG-CD2 4.09Å
517	D	86.5	Confident	84.9	Confident	74 Å²	74	49.8 Å²	49.8	40%	0.396	29%	0.293	S	S	.	.			trans	-75.9	174.5	175.3	84.2	5.3	0	0	0	112.4	N519 E520 L521	D517-N519 VanDerWaalsContact C-N 3.25Å; D517-N519 PolarHBondContact O-N 3.3Å; D517-N519 WeakPolarHBondContact OD1-CA 3.38Å; D517-N519 WeakPolarHBondContact OD1-CB 3.37Å; D517-N519 PolarHBondContact OD1-N 2.7Å; D517-E520 PolarHBondContact N-OE2 3.41Å; D517-E520 WeakPolarHBondContact OD1-CB 3.19Å; D517-E520 VanDerWaalsContact OD1-CG 3.29Å; D517-E520 WeakPolarHBondContact OD1-CG 3.49Å; D517-E520 PolarHBondContact OD1-N 3.33Å; D517-L521 VanDerWaalsContact O-CB 3.3Å; D517-L521 WeakPolarHBondContact O-CB 3.41Å; D517-L521 PolarHBondContact O-N 3.2Å
518	T	86.6	Confident	85.1	Confident	72 Å²	72	49.7 Å²	49.7	44%	0.442	29%	0.292	S	S	.	.	H	α-helix	trans	-67	-24.8	-177.6	57.7	0	0	0	0	113.5	N522	T518-N522 PolarHBondContact O-N 3.07Å; T518-N522 PolarHBondContact O-ND2 2.83Å
519	N	88.1	Confident	85.1	Confident	101 Å²	101	48.4 Å²	48.4	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-80.1	-46.7	179	-65.1	-41.6	0	0	0	110.7	D517 L521 N522 D523	D517-N519 VanDerWaalsContact C-N 3.25Å; D517-N519 PolarHBondContact O-N 3.3Å; D517-N519 WeakPolarHBondContact OD1-CA 3.38Å; D517-N519 WeakPolarHBondContact OD1-CB 3.37Å; D517-N519 PolarHBondContact OD1-N 2.7Å; N519-L521 PolarHBondContact O-N 3.44Å; N519-N522 WeakPolarHBondContact O-CA 3.27Å; N519-N522 WeakPolarHBondContact O-CB 3.2Å; N519-N522 PolarHBondContact O-N 3.3Å; N519-D523 PolarHBondContact O-N 2.97Å
520	E	91	Very high	85.2	Confident	34 Å²	34	47.7 Å²	47.7	16%	0.159	28%	0.277	C	S	.	.	H	α-helix	trans	-56.8	-40.4	173	-69.3	173.6	158	0	0	110.8	A507 T510 S511 P516 D517 D523 I524	A507-E520 HydrophobicContact CB-CB 4Å; T510-E520 VanDerWaalsContact CB-OE1 3.31Å; T510-E520 WeakPolarHBondContact CB-OE1 3.39Å; T510-E520 PolarHBondContact OG1-OE1 3.44Å; S511-E520 PolarHBondContact OG-OE2 3.42Å; P516-E520 VanDerWaalsContact CA-OE2 3.23Å; P516-E520 WeakPolarHBondContact CA-OE2 3.48Å; P516-E520 HydrophobicContact CB-CB 4.07Å; D517-E520 PolarHBondContact N-OE2 3.41Å; D517-E520 WeakPolarHBondContact OD1-CB 3.19Å; D517-E520 VanDerWaalsContact OD1-CG 3.29Å; D517-E520 WeakPolarHBondContact OD1-CG 3.49Å; D517-E520 PolarHBondContact OD1-N 3.33Å; E520-D523 PolarHBondContact O-N 2.83Å; E520-I524 WeakPolarHBondContact O-CG1 3.44Å; E520-I524 PolarHBondContact O-N 3.49Å; E520-I524 VanDerWaalsContact O-N 3.09Å
521	L	91	Very high	85.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-45.6	173.8	-166.5	69	0	0	0	112.4	D517 N519 D523 I524 I525 F556 Q594 F595	D517-L521 VanDerWaalsContact O-CB 3.3Å; D517-L521 WeakPolarHBondContact O-CB 3.41Å; D517-L521 PolarHBondContact O-N 3.2Å; N519-L521 PolarHBondContact O-N 3.44Å; L521-D523 VanDerWaalsContact C-N 3.28Å; L521-D523 PolarHBondContact O-N 3.39Å; L521-I524 PolarHBondContact O-N 3.37Å; L521-I525 HydrophobicContact CG-CD1 4.05Å; L521-I525 WeakPolarHBondContact O-CD1 3.44Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.43Å; L521-I525 PolarHBondContact O-N 3.4Å; L521-F556 HydrophobicContact CD1-CE2 3.87Å; L521-F556 HydrophobicContact CD1-CZ 3.87Å; L521-Q594 HydrophobicContact CD2-CB 4.24Å; L521-Q594 HydrophobicContact CD2-CG 3.7Å; L521-F595 HydrophobicContact CD1-CB 3.78Å; L521-F595 HydrophobicContact CD1-CD2 3.37Å; L521-F595 HydrophobicContact CD1-CE2 4.31Å; L521-F595 HydrophobicContact CD1-CG 3.91Å; L521-F595 HydrophobicContact CD2-CB 4.45Å; L521-F595 HydrophobicContact CG-CD2 4.2Å
522	N	90.4	Very high	86.4	Confident	68 Å²	68	43 Å²	43	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-35.9	177.1	-74	-35	0	0	0	111.3	T518 N519 I525 Q526	T518-N522 PolarHBondContact O-N 3.07Å; T518-N522 PolarHBondContact O-ND2 2.83Å; N519-N522 WeakPolarHBondContact O-CA 3.27Å; N519-N522 WeakPolarHBondContact O-CB 3.2Å; N519-N522 PolarHBondContact O-N 3.3Å; N522-I525 PolarHBondContact O-N 3.13Å; N522-Q526 WeakPolarHBondContact O-CB 3.41Å; N522-Q526 VanDerWaalsContact O-CG 3.3Å; N522-Q526 WeakPolarHBondContact O-CG 3.42Å; N522-Q526 PolarHBondContact O-N 2.77Å
523	D	91.9	Very high	87.3	Confident	92 Å²	92	38.8 Å²	38.8	49%	0.492	23%	0.226	S	C	.	.	H	α-helix	trans	-66.4	-41.2	177.3	-73.3	-17.2	0	0	0	112.6	N519 E520 L521 I525 T527	N519-D523 PolarHBondContact O-N 2.97Å; E520-D523 PolarHBondContact O-N 2.83Å; L521-D523 VanDerWaalsContact C-N 3.28Å; L521-D523 PolarHBondContact O-N 3.39Å; D523-I525 VanDerWaalsContact C-N 3.33Å; D523-T527 WeakPolarHBondContact O-CB 3.35Å; D523-T527 PolarHBondContact O-N 3.24Å; D523-T527 PolarHBondContact O-OG1 2.9Å
524	I	93.3	Very high	88.1	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-48.5	172.2	-63.7	165.4	0	0	0	109.5	R503 V504 A507 E520 L521 T527 A528 L552 F556 F595	R503-I524 HydrophobicContact CB-CG1 4.43Å; V504-I524 HydrophobicContact CG2-CD1 4.27Å; V504-I524 HydrophobicContact CG2-CG1 4.44Å; V504-I524 HydrophobicContact CG2-CG2 3.98Å; A507-I524 HydrophobicContact CB-CD1 3.75Å; A507-I524 HydrophobicContact CB-CG1 4.35Å; E520-I524 WeakPolarHBondContact O-CG1 3.44Å; E520-I524 PolarHBondContact O-N 3.49Å; E520-I524 VanDerWaalsContact O-N 3.09Å; L521-I524 PolarHBondContact O-N 3.37Å; I524-T527 PolarHBondContact O-N 3.39Å; I524-A528 WeakPolarHBondContact O-CB 3.4Å; I524-A528 PolarHBondContact O-N 3.29Å; I524-L552 HydrophobicContact CG2-CD1 4.17Å; I524-L552 HydrophobicContact CG2-CD2 4.35Å; I524-F556 HydrophobicContact CD1-CD2 4.27Å; I524-F556 HydrophobicContact CD1-CE2 4.18Å; I524-F595 HydrophobicContact CG2-CE2 3.92Å; I524-F595 HydrophobicContact CG2-CZ 4.39Å
525	I	92.5	Very high	88.7	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-40.8	-177.2	-67.7	166.6	0	0	0	111.7	L521 N522 D523 T527 A528 A529 F595 N598 L599 T602	L521-I525 HydrophobicContact CG-CD1 4.05Å; L521-I525 WeakPolarHBondContact O-CD1 3.44Å; L521-I525 VanDerWaalsContact O-CG1 3.26Å; L521-I525 WeakPolarHBondContact O-CG1 3.43Å; L521-I525 PolarHBondContact O-N 3.4Å; N522-I525 PolarHBondContact O-N 3.13Å; D523-I525 VanDerWaalsContact C-N 3.33Å; I525-T527 VanDerWaalsContact C-N 3.35Å; I525-A528 WeakPolarHBondContact O-CB 3.36Å; I525-A528 PolarHBondContact O-N 3.36Å; I525-A529 VanDerWaalsContact O-CB 3.29Å; I525-A529 WeakPolarHBondContact O-CB 3.39Å; I525-A529 PolarHBondContact O-N 2.66Å; I525-F595 HydrophobicContact CD1-CD2 4.22Å; I525-F595 HydrophobicContact CG1-CD2 4.12Å; I525-F595 HydrophobicContact CG1-CE2 4.05Å; I525-N598 HydrophobicContact CD1-CB 3.46Å; I525-N598 VanDerWaalsContact CD1-CB 3.46Å; I525-L599 HydrophobicContact CG1-CB 4.26Å; I525-L599 HydrophobicContact CG1-CD1 4.28Å; I525-L599 HydrophobicContact CG2-CD1 4.38Å; I525-T602 HydrophobicContact CG2-CG2 3.91Å; I525-T602 WeakPolarHBondContact CG2-OG1 3.42Å
526	Q	92.1	Very high	88.7	Confident	75 Å²	75	39.2 Å²	39.2	35%	0.35	21%	0.208	S	C	.	.	H	α-helix	trans	-67	-37.6	176.4	-72	-56	-34.5	0	0	111.5	N522 A529 N530	N522-Q526 WeakPolarHBondContact O-CB 3.41Å; N522-Q526 VanDerWaalsContact O-CG 3.3Å; N522-Q526 WeakPolarHBondContact O-CG 3.42Å; N522-Q526 PolarHBondContact O-N 2.77Å; Q526-A529 PolarHBondContact O-N 3.15Å; Q526-N530 WeakPolarHBondContact O-CB 3.15Å; Q526-N530 PolarHBondContact O-N 3.14Å; Q526-N530 PolarHBondContact O-ND2 2.75Å
527	T	91.4	Very high	88.4	Confident	25 Å²	25	41.2 Å²	41.2	15%	0.153	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-48.3	174.7	-54.2	0	0	0	0	110.7	L500 R503 D523 I524 I525 A529 N530 E531	L500-T527 HydrophobicContact CD2-CG2 4.23Å; R503-T527 HydrophobicContact CG-CG2 3.99Å; D523-T527 WeakPolarHBondContact O-CB 3.35Å; D523-T527 PolarHBondContact O-N 3.24Å; D523-T527 PolarHBondContact O-OG1 2.9Å; I524-T527 PolarHBondContact O-N 3.39Å; I525-T527 VanDerWaalsContact C-N 3.35Å; T527-A529 VanDerWaalsContact C-N 3.33Å; T527-A529 PolarHBondContact O-N 2.7Å; T527-N530 PolarHBondContact O-N 3.38Å; T527-E531 PolarHBondContact O-N 3.45Å
528	A	92.1	Very high	88.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-54	-46.8	173.3	0	0	0	0	0	112.8	L500 I524 I525 L532 L549 L552 L599	L500-A528 HydrophobicContact CD2-CB 4.3Å; I524-A528 WeakPolarHBondContact O-CB 3.4Å; I524-A528 PolarHBondContact O-N 3.29Å; I525-A528 WeakPolarHBondContact O-CB 3.36Å; I525-A528 PolarHBondContact O-N 3.36Å; A528-L532 PolarHBondContact O-N 2.57Å; A528-L549 HydrophobicContact CB-CD2 3.31Å; A528-L552 HydrophobicContact CB-CD2 4.07Å; A528-L599 HydrophobicContact CB-CD1 3.82Å
529	A	90	Very high	87.8	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-37.7	179.3	0	0	0	0	0	112.9	I525 Q526 T527 G533 T602 R606	I525-A529 VanDerWaalsContact O-CB 3.29Å; I525-A529 WeakPolarHBondContact O-CB 3.39Å; I525-A529 PolarHBondContact O-N 2.66Å; Q526-A529 PolarHBondContact O-N 3.15Å; T527-A529 VanDerWaalsContact C-N 3.33Å; T527-A529 PolarHBondContact O-N 2.7Å; A529-G533 PolarHBondContact O-N 3.49Å; A529-T602 HydrophobicContact CB-CG2 3.8Å; A529-R606 HydrophobicContact CB-CG 4.09Å
530	N	88.7	Confident	87.6	Confident	65 Å²	65	38.5 Å²	38.5	35%	0.348	20%	0.199	S	C	.	.	H	α-helix	trans	-70.9	-42.5	178.8	-69.3	-23	0	0	0	111.8	Q526 T527 L532 G533 Y534	Q526-N530 WeakPolarHBondContact O-CB 3.15Å; Q526-N530 PolarHBondContact O-N 3.14Å; Q526-N530 PolarHBondContact O-ND2 2.75Å; T527-N530 PolarHBondContact O-N 3.38Å; N530-L532 VanDerWaalsContact C-N 3.29Å; N530-L532 PolarHBondContact O-N 2.92Å; N530-G533 WeakPolarHBondContact O-CA 3.2Å; N530-G533 PolarHBondContact O-N 2.93Å; N530-Y534 HydrophobicContact CB-CE2 4.13Å; N530-Y534 WeakPolarHBondContact O-CD2 3.4Å; N530-Y534 PolarHBondContact O-N 3.41Å
531	E	88.2	Confident	87.3	Confident	8 Å²	8	37 Å²	37	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-59.7	-38.7	176.1	-70.5	-63.3	151.3	0	0	111.7	Y492 R499 L500 T527 V535 V545	Y492-E531 PolarHBondContact OH-OE2 2.78Å; R499-E531 WeakPolarHBondContact CD-OE1 3.33Å; R499-E531 IonicContact CZ-OE1 2.69Å; R499-E531 IonicContact NE-OE1 3.86Å; R499-E531 IonicContact NH1-OE1 3.49Å; R499-E531 PolarHBondContact NH1-OE1 2.88Å; R499-E531 IonicContact NH1-OE2 3.59Å; L500-E531 HydrophobicContact CD2-CG 4.27Å; T527-E531 PolarHBondContact O-N 3.45Å; E531-V535 WeakPolarHBondContact O-CG2 3.48Å; E531-V545 HydrophobicContact CB-CG1 4.26Å
532	L	87.8	Confident	87.2	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-40.2	170.9	-70.5	173.3	0	0	0	112.5	A528 N530 Y534 V535 T536 L542 V545 L549 V603 I653	A528-L532 PolarHBondContact O-N 2.57Å; N530-L532 VanDerWaalsContact C-N 3.29Å; N530-L532 PolarHBondContact O-N 2.92Å; L532-Y534 VanDerWaalsContact C-N 3.34Å; L532-Y534 PolarHBondContact O-N 3.41Å; L532-V535 PolarHBondContact O-N 3.29Å; L532-T536 WeakPolarHBondContact O-CG2 3.5Å; L532-T536 PolarHBondContact O-N 3.4Å; L532-L542 HydrophobicContact CD2-CD1 3.73Å; L532-V545 HydrophobicContact CD2-CG1 4.26Å; L532-L549 HydrophobicContact CD1-CD1 3.64Å; L532-L549 HydrophobicContact CD2-CD1 3.45Å; L532-L549 VanDerWaalsContact CD2-CD1 3.45Å; L532-L549 HydrophobicContact CG-CD1 3.47Å; L532-L549 VanDerWaalsContact CG-CD1 3.47Å; L532-V603 HydrophobicContact CD1-CB 4.29Å; L532-V603 HydrophobicContact CD1-CG1 3.48Å; L532-V603 VanDerWaalsContact CD1-CG1 3.48Å; L532-V603 HydrophobicContact CD1-CG2 3.86Å; L532-I653 HydrophobicContact CD1-CD1 4.33Å
533	G	84.8	Confident	87	Confident	29 Å²	29	35.8 Å²	35.8	30%	0.299	19%	0.185	S	C	.	.	H	α-helix	trans	-56.6	-45.8	179.7	0	0	0	0	0	112.6	A529 N530 V535 T536	A529-G533 PolarHBondContact O-N 3.49Å; N530-G533 WeakPolarHBondContact O-CA 3.2Å; N530-G533 PolarHBondContact O-N 2.93Å; G533-V535 PolarHBondContact O-N 3.26Å; G533-T536 PolarHBondContact O-OG1 3.49Å
534	Y	83.5	Confident	86.9	Confident	143 Å²	143	34 Å²	34	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-64.5	-24.2	-179.4	-65.3	-54.3	0	0	0	114	P433 N530 L532	P433-Y534 WeakPolarHBondContact CB-O 3.43Å; N530-Y534 HydrophobicContact CB-CE2 4.13Å; N530-Y534 WeakPolarHBondContact O-CD2 3.4Å; N530-Y534 PolarHBondContact O-N 3.41Å; L532-Y534 VanDerWaalsContact C-N 3.34Å; L532-Y534 PolarHBondContact O-N 3.41Å
535	V	84.6	Confident	86.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-102.4	-4.7	-166.3	168	0	0	0	0	112.8	P433 Y492 E531 L532 G533 V537 H538 L541 L542 V545	P433-V535 HydrophobicContact CG-CG2 4.11Å; Y492-V535 HydrophobicContact CE1-CG2 3.67Å; Y492-V535 VanDerWaalsContact OH-CG2 3.29Å; Y492-V535 WeakPolarHBondContact OH-CG2 3.04Å; E531-V535 WeakPolarHBondContact O-CG2 3.48Å; L532-V535 PolarHBondContact O-N 3.29Å; G533-V535 PolarHBondContact O-N 3.26Å; V535-V537 PolarHBondContact O-N 2.92Å; V535-H538 PolarHBondContact O-N 3.36Å; V535-L541 HydrophobicContact CB-CD2 4.36Å; V535-L541 HydrophobicContact CB-CG 4.45Å; V535-L541 HydrophobicContact CG1-CB 3.74Å; V535-L541 HydrophobicContact CG1-CD2 3.78Å; V535-L541 HydrophobicContact CG1-CG 3.45Å; V535-L541 VanDerWaalsContact CG1-CG 3.45Å; V535-L541 WeakPolarHBondContact CG1-O 3.49Å; V535-L541 HydrophobicContact CG2-CD2 4.11Å; V535-L541 HydrophobicContact CG2-CG 4.34Å; V535-L542 HydrophobicContact CG1-CB 4.12Å; V535-L542 HydrophobicContact CG1-CD1 4.43Å; V535-V545 HydrophobicContact CB-CG2 4.36Å; V535-V545 HydrophobicContact CG1-CB 4.24Å; V535-V545 HydrophobicContact CG1-CG2 3.99Å; V535-V545 HydrophobicContact CG2-CB 4.41Å; V535-V545 HydrophobicContact CG2-CG2 3.77Å
536	T	81.3	Confident	86.6	Confident	31 Å²	31	34 Å²	34	19%	0.19	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.6	179.3	57.2	0	0	0	0	115.5	L532 G533 H538 L542 L607 L610	L532-T536 WeakPolarHBondContact O-CG2 3.5Å; L532-T536 PolarHBondContact O-N 3.4Å; G533-T536 PolarHBondContact O-OG1 3.49Å; T536-H538 VanDerWaalsContact C-N 3.33Å; T536-H538 PolarHBondContact O-N 3.23Å; T536-L542 HydrophobicContact CG2-CD1 4.38Å; T536-L607 HydrophobicContact CG2-CD2 4.48Å; T536-L610 HydrophobicContact CG2-CD1 3.38Å; T536-L610 HydrophobicContact CG2-CG 4.44Å
537	V	80	Confident	86.6	Confident	45 Å²	45	37.8 Å²	37.8	27%	0.273	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-38.1	171.8	-175.2	0	0	0	0	112.5	P433 K437 L440 V535	P433-V537 HydrophobicContact CB-CG2 4.32Å; K437-V537 HydrophobicContact CB-CG1 3.64Å; K437-V537 HydrophobicContact CG-CG1 3.97Å; L440-V537 HydrophobicContact CD1-CG1 4.16Å; V535-V537 PolarHBondContact O-N 2.92Å
538	H	80.7	Confident	86.7	Confident	59 Å²	59	37 Å²	37	27%	0.273	18%	0.179	S	C	.	.			trans	-141.7	137	-174.4	-170.9	-110.5	0	0	0	112.2	L436 L440 V535 T536 D540 L541 L542	L436-H538 HydrophobicContact CD2-CB 3.59Å; L436-H538 HydrophobicContact CG-CB 4.4Å; L440-H538 HydrophobicContact CD1-CB 3.96Å; V535-H538 PolarHBondContact O-N 3.36Å; T536-H538 VanDerWaalsContact C-N 3.33Å; T536-H538 PolarHBondContact O-N 3.23Å; H538-D540 VanDerWaalsContact CE1-CB 3.4Å; H538-D540 WeakPolarHBondContact CE1-CB 3.29Å; H538-D540 WeakPolarHBondContact ND1-CB 3.44Å; H538-D540 PolarHBondContact ND1-N 3.41Å; H538-D540 PolarHBondContact O-N 2.89Å; H538-L541 HydrophobicContact CB-CB 4.36Å; H538-L541 PolarHBondContact O-N 3.02Å; H538-L542 WeakPolarHBondContact O-CB 3.34Å; H538-L542 PolarHBondContact O-N 3.41Å
539	H	81.3	Confident	86.7	Confident	63 Å²	63	37.1 Å²	37.1	29%	0.292	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-42.2	-174.5	-173.1	65.5	0	0	0	112.9	L541 L542 L543	H539-L541 PolarHBondContact O-N 3.01Å; H539-L542 WeakPolarHBondContact O-CB 3.38Å; H539-L542 PolarHBondContact O-N 3.41Å; H539-L543 WeakPolarHBondContact O-CG 3.27Å; H539-L543 PolarHBondContact O-N 2.9Å
540	D	82.3	Confident	86.8	Confident	69 Å²	69	40 Å²	40	37%	0.369	20%	0.195	S	C	.	.	H	α-helix	trans	-65.6	-41.4	-179.6	-176.4	44.9	0	0	0	112	H538 L542 L543 K544	H538-D540 VanDerWaalsContact CE1-CB 3.4Å; H538-D540 WeakPolarHBondContact CE1-CB 3.29Å; H538-D540 WeakPolarHBondContact ND1-CB 3.44Å; H538-D540 PolarHBondContact ND1-N 3.41Å; H538-D540 PolarHBondContact O-N 2.89Å; D540-L542 VanDerWaalsContact C-N 3.28Å; D540-L542 PolarHBondContact O-N 3.19Å; D540-L543 PolarHBondContact O-N 3.23Å; D540-K544 WeakPolarHBondContact O-CG 3.18Å; D540-K544 PolarHBondContact O-N 3.37Å; D540-K544 WeakPolarHBondContact OD2-CE 3.49Å; D540-K544 IonicContact OD2-NZ 3.91Å; D540-K544 PolarHBondContact OD2-NZ 3.18Å
541	L	85.9	Confident	87	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-38.2	176.6	-168.7	66	0	0	0	110.4	Y432 P433 L436 E489 L493 V535 H538 H539 L543 K544 V545	Y432-L541 HydrophobicContact CD1-CD1 4.28Å; Y432-L541 HydrophobicContact CD1-CD2 3.89Å; Y432-L541 HydrophobicContact CE1-CD1 3.8Å; Y432-L541 HydrophobicContact CE1-CD2 3.72Å; Y432-L541 HydrophobicContact CE1-CG 4.39Å; P433-L541 HydrophobicContact CG-CD2 4.19Å; L436-L541 HydrophobicContact CD2-CB 4.17Å; L436-L541 HydrophobicContact CD2-CD2 3.83Å; E489-L541 HydrophobicContact CG-CD1 4.01Å; L493-L541 HydrophobicContact CD2-CD1 4.25Å; V535-L541 HydrophobicContact CB-CD2 4.36Å; V535-L541 HydrophobicContact CB-CG 4.45Å; V535-L541 HydrophobicContact CG1-CB 3.74Å; V535-L541 HydrophobicContact CG1-CD2 3.78Å; V535-L541 HydrophobicContact CG1-CG 3.45Å; V535-L541 VanDerWaalsContact CG1-CG 3.45Å; V535-L541 WeakPolarHBondContact CG1-O 3.49Å; V535-L541 HydrophobicContact CG2-CD2 4.11Å; V535-L541 HydrophobicContact CG2-CG 4.34Å; H538-L541 HydrophobicContact CB-CB 4.36Å; H538-L541 PolarHBondContact O-N 3.02Å; H539-L541 PolarHBondContact O-N 3.01Å; L541-L543 VanDerWaalsContact C-N 3.34Å; L541-L543 PolarHBondContact O-N 3.47Å; L541-K544 PolarHBondContact O-N 3.42Å; L541-V545 PolarHBondContact O-N 3.4Å
542	L	87.5	Confident	87.3	Confident	16 Å²	16	41.4 Å²	41.4	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-42.5	175.1	-176.3	65.3	0	0	0	112.1	L532 V535 T536 H538 H539 D540 T546 L607 P649	L532-L542 HydrophobicContact CD2-CD1 3.73Å; V535-L542 HydrophobicContact CG1-CB 4.12Å; V535-L542 HydrophobicContact CG1-CD1 4.43Å; T536-L542 HydrophobicContact CG2-CD1 4.38Å; H538-L542 WeakPolarHBondContact O-CB 3.34Å; H538-L542 PolarHBondContact O-N 3.41Å; H539-L542 WeakPolarHBondContact O-CB 3.38Å; H539-L542 PolarHBondContact O-N 3.41Å; D540-L542 VanDerWaalsContact C-N 3.28Å; D540-L542 PolarHBondContact O-N 3.19Å; L542-T546 VanDerWaalsContact O-CB 3.29Å; L542-T546 WeakPolarHBondContact O-CB 3.23Å; L542-T546 PolarHBondContact O-N 3.23Å; L542-T546 PolarHBondContact O-OG1 3.23Å; L542-L607 HydrophobicContact CD1-CD2 4.21Å; L542-L607 HydrophobicContact CD2-CD2 4.03Å; L542-P649 HydrophobicContact CD2-CB 4.5Å; L542-P649 HydrophobicContact CD2-CG 3.95Å; L542-P649 HydrophobicContact CG-CB 4.42Å; L542-P649 HydrophobicContact CG-CG 4.39Å
543	L	87.5	Confident	87.6	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.141	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-42.7	174.6	-66.7	178.9	0	0	0	111.7	H539 D540 L541 T546 R547 K647 L652	H539-L543 WeakPolarHBondContact O-CG 3.27Å; H539-L543 PolarHBondContact O-N 2.9Å; D540-L543 PolarHBondContact O-N 3.23Å; L541-L543 VanDerWaalsContact C-N 3.34Å; L541-L543 PolarHBondContact O-N 3.47Å; L543-T546 WeakPolarHBondContact O-CB 3.34Å; L543-T546 PolarHBondContact O-N 3.18Å; L543-R547 WeakPolarHBondContact O-CG 3.48Å; L543-R547 PolarHBondContact O-N 3.03Å; L543-K647 WeakPolarHBondContact CD2-O 3.5Å; L543-L652 HydrophobicContact CD2-CD1 3.97Å
544	K	88.9	Confident	88.1	Confident	54 Å²	54	41.1 Å²	41.1	24%	0.235	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-43.2	178	-72.1	167.5	173.8	166.5	0	112.1	E489 L493 D540 L541 R547 N548	E489-K544 WeakPolarHBondContact OE1-CD 3.13Å; E489-K544 WeakPolarHBondContact OE1-CE 3.35Å; E489-K544 IonicContact OE1-NZ 3.26Å; E489-K544 PolarHBondContact OE1-NZ 3.24Å; E489-K544 IonicContact OE2-NZ 3.74Å; L493-K544 HydrophobicContact CD1-CB 4.14Å; L493-K544 HydrophobicContact CD1-CD 4.14Å; L493-K544 HydrophobicContact CD2-CB 3.85Å; D540-K544 WeakPolarHBondContact O-CG 3.18Å; D540-K544 PolarHBondContact O-N 3.37Å; D540-K544 WeakPolarHBondContact OD2-CE 3.49Å; D540-K544 IonicContact OD2-NZ 3.91Å; D540-K544 PolarHBondContact OD2-NZ 3.18Å; L541-K544 PolarHBondContact O-N 3.42Å; K544-R547 WeakPolarHBondContact O-CB 3.35Å; K544-R547 PolarHBondContact O-N 3.37Å; K544-N548 PolarHBondContact O-N 2.81Å
545	V	90.6	Very high	88.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-71.7	-33.5	175.5	175.7	0	0	0	0	111.7	Y492 L493 E531 L532 V535 L541 R547 N548 L549	Y492-V545 HydrophobicContact CE1-CG2 4.19Å; L493-V545 HydrophobicContact CD2-CG2 3.71Å; E531-V545 HydrophobicContact CB-CG1 4.26Å; L532-V545 HydrophobicContact CD2-CG1 4.26Å; V535-V545 HydrophobicContact CB-CG2 4.36Å; V535-V545 HydrophobicContact CG1-CB 4.24Å; V535-V545 HydrophobicContact CG1-CG2 3.99Å; V535-V545 HydrophobicContact CG2-CB 4.41Å; V535-V545 HydrophobicContact CG2-CG2 3.77Å; L541-V545 PolarHBondContact O-N 3.4Å; V545-R547 VanDerWaalsContact C-N 3.28Å; V545-R547 PolarHBondContact O-N 3.04Å; V545-N548 WeakPolarHBondContact O-CA 3.46Å; V545-N548 WeakPolarHBondContact O-CB 3.36Å; V545-N548 PolarHBondContact O-N 3.35Å; V545-L549 PolarHBondContact O-N 2.96Å; V545-L549 VanDerWaalsContact O-N 3.13Å
546	T	90.2	Very high	89	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-36.2	171.2	-57.4	0	0	0	0	112	L542 L543 N548 L549 D550 P649 L652 I653	L542-T546 VanDerWaalsContact O-CB 3.29Å; L542-T546 WeakPolarHBondContact O-CB 3.23Å; L542-T546 PolarHBondContact O-N 3.23Å; L542-T546 PolarHBondContact O-OG1 3.23Å; L543-T546 WeakPolarHBondContact O-CB 3.34Å; L543-T546 PolarHBondContact O-N 3.18Å; T546-N548 VanDerWaalsContact C-N 3.27Å; T546-N548 PolarHBondContact O-N 2.9Å; T546-L549 WeakPolarHBondContact O-CB 3.02Å; T546-L549 PolarHBondContact O-N 3.28Å; T546-L549 VanDerWaalsContact O-N 3.14Å; T546-D550 PolarHBondContact O-N 3.4Å; T546-D550 VanDerWaalsContact O-N 3.15Å; T546-P649 HydrophobicContact CG2-CB 4.15Å; T546-P649 WeakPolarHBondContact OG1-CB 3.45Å; T546-L652 HydrophobicContact CG2-CB 3.79Å; T546-L652 HydrophobicContact CG2-CD1 4.13Å; T546-I653 HydrophobicContact CG2-CD1 4.08Å; T546-I653 HydrophobicContact CG2-CG1 3.73Å
547	R	91.5	Very high	89.7	Confident	155 Å²	155	34.7 Å²	34.7	59%	0.585	17%	0.168	S	C	*	.	H	α-helix	trans	-67.3	-25.4	171.6	-69	174.7	-178.9	169.5	1.3	113.1	L543 K544 V545 L549 D550 K551	L543-R547 WeakPolarHBondContact O-CG 3.48Å; L543-R547 PolarHBondContact O-N 3.03Å; K544-R547 WeakPolarHBondContact O-CB 3.35Å; K544-R547 PolarHBondContact O-N 3.37Å; V545-R547 VanDerWaalsContact C-N 3.28Å; V545-R547 PolarHBondContact O-N 3.04Å; R547-L549 VanDerWaalsContact C-N 3.34Å; R547-D550 WeakPolarHBondContact O-CB 3.49Å; R547-D550 PolarHBondContact O-N 3.39Å; R547-K551 PolarHBondContact O-N 3.21Å
548	N	92.8	Very high	90.3	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-73.4	-29.7	171.9	-65.6	-20.9	0	0	0	111.6	L493 S496 V497 L500 K544 V545 T546 K551 L552	L493-N548 PolarHBondContact O-ND2 3.33Å; S496-N548 PolarHBondContact OG-ND2 3.2Å; V497-N548 HydrophobicContact CG2-CB 3.71Å; V497-N548 WeakPolarHBondContact CG2-OD1 3.45Å; L500-N548 HydrophobicContact CD1-CB 4.21Å; K544-N548 PolarHBondContact O-N 2.81Å; V545-N548 WeakPolarHBondContact O-CA 3.46Å; V545-N548 WeakPolarHBondContact O-CB 3.36Å; V545-N548 PolarHBondContact O-N 3.35Å; T546-N548 VanDerWaalsContact C-N 3.27Å; T546-N548 PolarHBondContact O-N 2.9Å; N548-K551 WeakPolarHBondContact O-CB 3.39Å; N548-K551 PolarHBondContact O-N 3.49Å; N548-L552 PolarHBondContact O-N 3.11Å
549	L	92.5	Very high	90.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-69	-33.3	171	-75.1	139.8	0	0	0	112.9	L500 A528 L532 V545 T546 R547 K551 L552 I553	L500-L549 HydrophobicContact CD1-CG 4.36Å; A528-L549 HydrophobicContact CB-CD2 3.31Å; L532-L549 HydrophobicContact CD1-CD1 3.64Å; L532-L549 HydrophobicContact CD2-CD1 3.45Å; L532-L549 VanDerWaalsContact CD2-CD1 3.45Å; L532-L549 HydrophobicContact CG-CD1 3.47Å; L532-L549 VanDerWaalsContact CG-CD1 3.47Å; V545-L549 PolarHBondContact O-N 2.96Å; V545-L549 VanDerWaalsContact O-N 3.13Å; T546-L549 WeakPolarHBondContact O-CB 3.02Å; T546-L549 PolarHBondContact O-N 3.28Å; T546-L549 VanDerWaalsContact O-N 3.14Å; R547-L549 VanDerWaalsContact C-N 3.34Å; L549-K551 VanDerWaalsContact C-N 3.3Å; L549-K551 PolarHBondContact O-N 2.8Å; L549-L552 HydrophobicContact CD2-CD2 3.87Å; L549-L552 WeakPolarHBondContact O-CB 3.22Å; L549-L552 PolarHBondContact O-N 2.7Å; L549-I553 VanDerWaalsContact O-CG1 3.27Å; L549-I553 WeakPolarHBondContact O-CG1 3.28Å; L549-I553 PolarHBondContact O-N 3.04Å
550	D	92.2	Very high	91.3	Very high	62 Å²	62	34.5 Å²	34.5	33%	0.332	17%	0.169	S	C	.	.	H	α-helix	trans	-57.6	-46	170.8	176.5	68.8	0	0	0	111.1	T546 R547 L552 I553 A554 S656 H660	T546-D550 PolarHBondContact O-N 3.4Å; T546-D550 VanDerWaalsContact O-N 3.15Å; R547-D550 WeakPolarHBondContact O-CB 3.49Å; R547-D550 PolarHBondContact O-N 3.39Å; D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 PolarHBondContact O-N 3.01Å; D550-I553 PolarHBondContact O-N 3.4Å; D550-A554 WeakPolarHBondContact O-CB 3.31Å; D550-A554 PolarHBondContact O-N 3.24Å; D550-S656 WeakPolarHBondContact CA-OG 3.14Å; D550-S656 WeakPolarHBondContact OD1-CB 3.11Å; D550-S656 PolarHBondContact OD1-OG 3.38Å; D550-H660 IonicContact OD1-CD2 2.98Å; D550-H660 IonicContact OD1-NE2 3.39Å
551	K	93.4	Very high	91.7	Very high	102 Å²	102	36.2 Å²	36.2	44%	0.443	17%	0.174	S	C	.	.	H	α-helix	trans	-62.2	-38.6	173.7	-61.3	174.8	-176.4	170.8	0	112.9	F501 R547 N548 L549 A554 L555	F501-K551 HydrophobicContact CE1-CB 3.91Å; F501-K551 HydrophobicContact CZ-CB 3.94Å; R547-K551 PolarHBondContact O-N 3.21Å; N548-K551 WeakPolarHBondContact O-CB 3.39Å; N548-K551 PolarHBondContact O-N 3.49Å; L549-K551 VanDerWaalsContact C-N 3.3Å; L549-K551 PolarHBondContact O-N 2.8Å; K551-A554 PolarHBondContact O-N 3.22Å; K551-L555 WeakPolarHBondContact O-CB 3.5Å; K551-L555 PolarHBondContact O-N 3.42Å
552	L	94.8	Very high	91.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-48.5	174.3	170.6	89.2	0	0	0	110.7	L500 V504 I524 A528 N548 L549 D550 A554 L555 F556	L500-L552 HydrophobicContact CB-CB 4.42Å; L500-L552 HydrophobicContact CB-CD1 3.79Å; L500-L552 HydrophobicContact CD2-CD1 4.3Å; L500-L552 HydrophobicContact CD2-CD2 4.26Å; L500-L552 VanDerWaalsContact O-CD1 3.23Å; L500-L552 WeakPolarHBondContact O-CD1 3.34Å; V504-L552 HydrophobicContact CG2-CD1 3.22Å; V504-L552 HydrophobicContact CG2-CG 4.18Å; I524-L552 HydrophobicContact CG2-CD1 4.17Å; I524-L552 HydrophobicContact CG2-CD2 4.35Å; A528-L552 HydrophobicContact CB-CD2 4.07Å; N548-L552 PolarHBondContact O-N 3.11Å; L549-L552 HydrophobicContact CD2-CD2 3.87Å; L549-L552 WeakPolarHBondContact O-CB 3.22Å; L549-L552 PolarHBondContact O-N 2.7Å; D550-L552 VanDerWaalsContact C-N 3.34Å; D550-L552 PolarHBondContact O-N 3.01Å; L552-A554 VanDerWaalsContact C-N 3.33Å; L552-A554 PolarHBondContact O-N 2.86Å; L552-L555 PolarHBondContact O-N 3.21Å; L552-F556 PolarHBondContact O-N 3.21Å
553	I	93.7	Very high	91.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-43.1	180	-66.3	162.4	0	0	0	109.9	L549 D550 F556 A557 F595 L599 I653 S656 T657 H660 L661	L549-I553 VanDerWaalsContact O-CG1 3.27Å; L549-I553 WeakPolarHBondContact O-CG1 3.28Å; L549-I553 PolarHBondContact O-N 3.04Å; D550-I553 PolarHBondContact O-N 3.4Å; I553-F556 PolarHBondContact O-N 3.33Å; I553-A557 WeakPolarHBondContact O-CB 3.41Å; I553-A557 PolarHBondContact O-N 3.06Å; I553-F595 HydrophobicContact CG1-CE1 4.34Å; I553-L599 HydrophobicContact CD1-CD2 3.77Å; I553-L599 HydrophobicContact CG1-CD2 3.73Å; I553-I653 HydrophobicContact CD1-CG2 4.42Å; I553-S656 WeakPolarHBondContact CD1-OG 3.34Å; I553-T657 HydrophobicContact CD1-CG2 3.99Å; I553-H660 HydrophobicContact CG2-CB 4Å; I553-L661 HydrophobicContact CG2-CD1 4.18Å; I553-L661 HydrophobicContact CG2-CD2 3.98Å; I553-L661 HydrophobicContact CG2-CG 3.85Å
554	A	94.1	Very high	91.9	Very high	23 Å²	23	42.1 Å²	42.1	19%	0.19	22%	0.217	C	C	.	.	H	α-helix	trans	-61.8	-42.4	175.2	0	0	0	0	0	112.5	D550 K551 L552 A557 T558	D550-A554 WeakPolarHBondContact O-CB 3.31Å; D550-A554 PolarHBondContact O-N 3.24Å; K551-A554 PolarHBondContact O-N 3.22Å; L552-A554 VanDerWaalsContact C-N 3.33Å; L552-A554 PolarHBondContact O-N 2.86Å; A554-A557 PolarHBondContact O-N 2.84Å; A554-T558 WeakPolarHBondContact O-CB 3.43Å; A554-T558 PolarHBondContact O-N 2.69Å; A554-T558 PolarHBondContact O-OG1 2.85Å
555	L	94.2	Very high	91.7	Very high	33 Å²	33	41.3 Å²	41.3	17%	0.173	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-44	176.3	179.8	63.8	0	0	0	111.5	F501 V504 K551 L552 A557 T558 K559	F501-L555 HydrophobicContact CB-CD2 3.89Å; F501-L555 HydrophobicContact CD1-CD2 3.65Å; F501-L555 HydrophobicContact CD2-CD2 3.81Å; F501-L555 HydrophobicContact CE1-CB 4.28Å; F501-L555 HydrophobicContact CE1-CD2 4.03Å; F501-L555 HydrophobicContact CE2-CD2 4.17Å; F501-L555 HydrophobicContact CG-CD2 3.52Å; F501-L555 HydrophobicContact CZ-CB 4.42Å; F501-L555 HydrophobicContact CZ-CD2 4.26Å; V504-L555 HydrophobicContact CB-CD2 4.24Å; V504-L555 HydrophobicContact CG1-CD2 4.25Å; V504-L555 HydrophobicContact CG1-CG 4.15Å; K551-L555 WeakPolarHBondContact O-CB 3.5Å; K551-L555 PolarHBondContact O-N 3.42Å; L552-L555 PolarHBondContact O-N 3.21Å; L555-A557 VanDerWaalsContact C-N 3.35Å; L555-A557 PolarHBondContact O-N 3.49Å; L555-T558 PolarHBondContact O-N 3.1Å; L555-K559 HydrophobicContact CD1-CG 4.35Å; L555-K559 WeakPolarHBondContact O-CG 3.44Å; L555-K559 PolarHBondContact O-N 3.21Å
556	F	94.6	Very high	90.8	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.6	-49.1	175.2	-173.9	-85	0	0	0	110.6	V504 F508 P516 L521 I524 L552 I553 T558 K559 T560 L591 L592 F595 L661	V504-F556 HydrophobicContact CG1-CB 4.43Å; V504-F556 HydrophobicContact CG1-CD2 4.39Å; F508-F556 AromaticContact CE2-CD2 3.66Å; F508-F556 HydrophobicContact CE2-CD2 3.66Å; F508-F556 AromaticContact CE2-CE2 3.71Å; F508-F556 HydrophobicContact CE2-CE2 3.71Å; F508-F556 HydrophobicContact CE2-CG 4.31Å; F508-F556 HydrophobicContact CE2-CZ 4.41Å; F508-F556 HydrophobicContact CZ-CD2 4.14Å; F508-F556 AromaticContact CZ-CE2 3.96Å; F508-F556 HydrophobicContact CZ-CE2 3.96Å; F508-F556 HydrophobicContact CZ-CZ 4.2Å; P516-F556 HydrophobicContact CG-CE2 4.02Å; P516-F556 HydrophobicContact CG-CZ 4.25Å; L521-F556 HydrophobicContact CD1-CE2 3.87Å; L521-F556 HydrophobicContact CD1-CZ 3.87Å; I524-F556 HydrophobicContact CD1-CD2 4.27Å; I524-F556 HydrophobicContact CD1-CE2 4.18Å; L552-F556 PolarHBondContact O-N 3.21Å; I553-F556 PolarHBondContact O-N 3.33Å; F556-T558 PolarHBondContact O-N 2.78Å; F556-K559 PolarHBondContact O-N 3.28Å; F556-T560 PolarHBondContact O-N 2.95Å; F556-T560 PolarHBondContact O-OG1 3.05Å; F556-T560 VanDerWaalsContact O-OG1 3.11Å; F556-L591 HydrophobicContact CZ-CD2 4.42Å; F556-L591 HydrophobicContact CZ-CG 4.31Å; F556-L592 HydrophobicContact CD1-CD2 4.25Å; F556-L592 HydrophobicContact CE1-CD2 4.04Å; F556-F595 HydrophobicContact CB-CD1 4.47Å; F556-F595 HydrophobicContact CB-CE1 3.87Å; F556-F595 HydrophobicContact CB-CZ 4.22Å; F556-F595 AromaticContact CD1-CD1 3.43Å; F556-F595 HydrophobicContact CD1-CD1 3.43Å; F556-F595 VanDerWaalsContact CD1-CD1 3.43Å; F556-F595 AromaticContact CD1-CE1 3.73Å; F556-F595 HydrophobicContact CD1-CE1 3.73Å; F556-F595 HydrophobicContact CD1-CG 4.01Å; F556-F595 HydrophobicContact CD1-CZ 4.5Å; F556-F595 HydrophobicContact CD2-CD1 4.26Å; F556-F595 HydrophobicContact CD2-CD2 4.38Å; F556-F595 HydrophobicContact CD2-CE1 4.13Å; F556-F595 HydrophobicContact CD2-CE2 4.23Å; F556-F595 HydrophobicContact CD2-CG 4.38Å; F556-F595 HydrophobicContact CD2-CZ 4.1Å; F556-F595 HydrophobicContact CE1-CB 3.83Å; F556-F595 AromaticContact CE1-CD1 3.61Å; F556-F595 HydrophobicContact CE1-CD1 3.61Å; F556-F595 HydrophobicContact CE1-CE1 4.32Å; F556-F595 AromaticContact CE1-CG 3.73Å; F556-F595 HydrophobicContact CE1-CG 3.73Å; F556-F595 HydrophobicContact CE2-CD1 4.41Å; F556-F595 HydrophobicContact CE2-CD2 4.15Å; F556-F595 HydrophobicContact CE2-CE2 4.41Å; F556-F595 HydrophobicContact CE2-CG 4.14Å; F556-F595 AromaticContact CG-CD1 3.8Å; F556-F595 HydrophobicContact CG-CD1 3.8Å; F556-F595 AromaticContact CG-CE1 3.63Å; F556-F595 HydrophobicContact CG-CE1 3.63Å; F556-F595 HydrophobicContact CG-CG 4.33Å; F556-F595 HydrophobicContact CG-CZ 4.02Å; F556-F595 HydrophobicContact CZ-CB 3.9Å; F556-F595 HydrophobicContact CZ-CD1 4.11Å; F556-F595 HydrophobicContact CZ-CD2 4.24Å; F556-F595 AromaticContact CZ-CG 3.81Å; F556-F595 HydrophobicContact CZ-CG 3.81Å; F556-L661 HydrophobicContact CD1-CD2 4.32Å
557	A	94	Very high	89.6	Confident	7 Å²	7	48.3 Å²	48.3	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-57.6	-46.1	176.7	0	0	0	0	0	112	I553 A554 L555 K559 T560 E561 H660 L661 L664	I553-A557 WeakPolarHBondContact O-CB 3.41Å; I553-A557 PolarHBondContact O-N 3.06Å; A554-A557 PolarHBondContact O-N 2.84Å; L555-A557 VanDerWaalsContact C-N 3.35Å; L555-A557 PolarHBondContact O-N 3.49Å; A557-K559 VanDerWaalsContact C-N 3.33Å; A557-K559 PolarHBondContact O-N 2.67Å; A557-T560 PolarHBondContact O-N 3.29Å; A557-E561 WeakPolarHBondContact O-CB 3.49Å; A557-E561 PolarHBondContact O-N 3.21Å; A557-H660 HydrophobicContact CB-CB 4.11Å; A557-L661 HydrophobicContact CB-CD2 4.16Å; A557-L664 HydrophobicContact CB-CD2 4Å; A557-L664 VanDerWaalsContact O-CD2 3.25Å; A557-L664 WeakPolarHBondContact O-CD2 3.48Å
558	T	93.3	Very high	88.3	Confident	83 Å²	83	43.7 Å²	43.7	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-39.7	179.1	-52.5	0	0	0	0	112	A554 L555 F556 E561 A562	A554-T558 WeakPolarHBondContact O-CB 3.43Å; A554-T558 PolarHBondContact O-N 2.69Å; A554-T558 PolarHBondContact O-OG1 2.85Å; L555-T558 PolarHBondContact O-N 3.1Å; F556-T558 PolarHBondContact O-N 2.78Å; T558-E561 PolarHBondContact O-N 3.45Å; T558-A562 PolarHBondContact O-N 2.9Å
559	K	91.5	Very high	87.1	Confident	80 Å²	80	49.5 Å²	49.5	35%	0.348	30%	0.303	S	S	.	.	H	α-helix	trans	-68.8	-39.3	176.8	-70.1	-68.3	-175.3	178.9	0	111.8	V504 F508 L555 F556 A557 A562	V504-K559 HydrophobicContact CG1-CG 4.47Å; F508-K559 HydrophobicContact CD1-CB 3.8Å; F508-K559 HydrophobicContact CD2-CB 3.78Å; F508-K559 HydrophobicContact CD2-CG 4.23Å; F508-K559 HydrophobicContact CE1-CB 3.75Å; F508-K559 HydrophobicContact CE2-CB 3.75Å; F508-K559 HydrophobicContact CG-CB 3.81Å; F508-K559 HydrophobicContact CG-CG 4.34Å; F508-K559 HydrophobicContact CZ-CB 3.73Å; L555-K559 HydrophobicContact CD1-CG 4.35Å; L555-K559 WeakPolarHBondContact O-CG 3.44Å; L555-K559 PolarHBondContact O-N 3.21Å; F556-K559 PolarHBondContact O-N 3.28Å; A557-K559 VanDerWaalsContact C-N 3.33Å; A557-K559 PolarHBondContact O-N 2.67Å; K559-A562 PolarHBondContact O-N 2.96Å
560	T	91.4	Very high	86.1	Confident	0 Å²	0	52 Å²	52	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-39.8	172.7	-57.8	0	0	0	0	111.8	F508 F556 A557 A562 L563 L588 L592 L664	F508-T560 WeakPolarHBondContact CZ-OG1 3.49Å; F556-T560 PolarHBondContact O-N 2.95Å; F556-T560 PolarHBondContact O-OG1 3.05Å; F556-T560 VanDerWaalsContact O-OG1 3.11Å; A557-T560 PolarHBondContact O-N 3.29Å; T560-A562 VanDerWaalsContact C-N 3.28Å; T560-A562 PolarHBondContact O-N 3.38Å; T560-L563 WeakPolarHBondContact O-CB 3.42Å; T560-L563 PolarHBondContact O-N 3.44Å; T560-L588 HydrophobicContact CG2-CB 4.1Å; T560-L588 HydrophobicContact CG2-CD1 4.49Å; T560-L588 HydrophobicContact CG2-CD2 4.14Å; T560-L588 HydrophobicContact CG2-CG 4.45Å; T560-L592 HydrophobicContact CG2-CD1 4.04Å; T560-L592 HydrophobicContact CG2-CD2 3.93Å; T560-L592 HydrophobicContact CG2-CG 3.93Å; T560-L664 HydrophobicContact CG2-CD2 4.31Å
561	E	91.2	Very high	85.2	Confident	104 Å²	104	49.4 Å²	49.4	49%	0.486	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-38.2	178	-171.5	176.3	-171.6	0	0	112	A557 T558 L563 I564 L664	A557-E561 WeakPolarHBondContact O-CB 3.49Å; A557-E561 PolarHBondContact O-N 3.21Å; T558-E561 PolarHBondContact O-N 3.45Å; E561-L563 PolarHBondContact O-N 3.11Å; E561-L563 VanDerWaalsContact O-N 3.16Å; E561-I564 HydrophobicContact CB-CD1 4.26Å; E561-I564 HydrophobicContact CG-CD1 3.88Å; E561-I564 WeakPolarHBondContact O-CB 3.48Å; E561-I564 VanDerWaalsContact O-CG1 3.27Å; E561-I564 WeakPolarHBondContact O-CG1 3.44Å; E561-I564 PolarHBondContact O-N 3.41Å; E561-I564 VanDerWaalsContact O-N 3.11Å; E561-L664 HydrophobicContact CB-CD1 3.9Å; E561-L664 HydrophobicContact CB-CD2 4.36Å; E561-L664 HydrophobicContact CG-CD1 3.92Å
562	A	89.6	Confident	84.6	Confident	85 Å²	85	46.2 Å²	46.2	70%	0.702	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.8	176.3	0	0	0	0	0	114.3	T558 K559 T560	T558-A562 PolarHBondContact O-N 2.9Å; K559-A562 PolarHBondContact O-N 2.96Å; T560-A562 VanDerWaalsContact C-N 3.28Å; T560-A562 PolarHBondContact O-N 3.38Å
563	L	87.9	Confident	83.9	Confident	46 Å²	46	49.1 Å²	49.1	24%	0.241	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.2	177.4	-59.9	176.7	0	0	0	113	F508 T560 E561 S565 L588	F508-L563 HydrophobicContact CD1-CD1 4.09Å; F508-L563 HydrophobicContact CE1-CD1 3.92Å; T560-L563 WeakPolarHBondContact O-CB 3.42Å; T560-L563 PolarHBondContact O-N 3.44Å; E561-L563 PolarHBondContact O-N 3.11Å; E561-L563 VanDerWaalsContact O-N 3.16Å; L563-S565 PolarHBondContact O-N 2.88Å; L563-L588 HydrophobicContact CB-CD1 3.95Å; L563-L588 HydrophobicContact CB-CD2 4.19Å; L563-L588 HydrophobicContact CD1-CD2 4.24Å
564	I	87.5	Confident	83.3	Confident	37 Å²	37	50.8 Å²	50.8	19%	0.19	32%	0.318	C	S	.	.			trans	-66.7	127.5	-177	-62.1	171	0	0	0	110.1	E561 S566 L588 L664 I668	E561-I564 HydrophobicContact CB-CD1 4.26Å; E561-I564 HydrophobicContact CG-CD1 3.88Å; E561-I564 WeakPolarHBondContact O-CB 3.48Å; E561-I564 VanDerWaalsContact O-CG1 3.27Å; E561-I564 WeakPolarHBondContact O-CG1 3.44Å; E561-I564 PolarHBondContact O-N 3.41Å; E561-I564 VanDerWaalsContact O-N 3.11Å; I564-S566 PolarHBondContact O-N 3.05Å; I564-S566 VanDerWaalsContact O-N 3.08Å; I564-L588 HydrophobicContact CG1-CD1 4.12Å; I564-L664 HydrophobicContact CD1-CD1 4Å; I564-I668 HydrophobicContact CD1-CD1 4.12Å; I564-I668 HydrophobicContact CD1-CG1 3.48Å; I564-I668 VanDerWaalsContact CD1-CG1 3.48Å; I564-I668 HydrophobicContact CG1-CD1 4.27Å; I564-I668 HydrophobicContact CG1-CG1 3.87Å
565	S	84.2	Confident	82.3	Confident	37 Å²	37	54.3 Å²	54.3	26%	0.259	34%	0.338	S	S	.	.			trans	-72.8	102.4	173.1	-69.6	0	0	0	0	109.9	L563 A571 N585	L563-S565 PolarHBondContact O-N 2.88Å; S565-A571 WeakPolarHBondContact O-CB 3.38Å; S565-N585 PolarHBondContact N-OD1 3Å; S565-N585 PolarHBondContact O-ND2 2.9Å
566	S	71.4	Confident	81.3	Confident	121 Å²	121	57.6 Å²	57.6	85%	0.846	36%	0.355	S	S	*	.			trans	-103	84.3	-179	45.4	0	0	0	0	111.2	I564	I564-S566 PolarHBondContact O-N 3.05Å; I564-S566 VanDerWaalsContact O-N 3.08Å
567	G	65.8	Low	80.4	Confident	28 Å²	28	62 Å²	62	29%	0.289	39%	0.387	S	S	.	.			trans	-157.3	132.6	177.1	0	0	0	0	0	112.3	I569 S570 A571	G567-I569 VanDerWaalsContact C-N 3.29Å; G567-I569 PolarHBondContact O-N 3.42Å; G567-S570 PolarHBondContact O-N 3.38Å; G567-S570 PolarHBondContact O-OG 3.43Å; G567-A571 VanDerWaalsContact O-CB 3.29Å; G567-A571 WeakPolarHBondContact O-CB 3.36Å; G567-A571 PolarHBondContact O-N 2.91Å
568	G	65	Low	79.8	Confident	59 Å²	59	62.5 Å²	62.5	61%	0.608	39%	0.388	S	S	*	.	H	α-helix	trans	-58.2	-35.1	-173.7	0	0	0	0	0	114.2	V572	G568-V572 WeakPolarHBondContact O-CB 3.4Å; G568-V572 PolarHBondContact O-N 2.99Å
569	I	66.6	Low	79.4	Confident	132 Å²	132	59.9 Å²	59.9	68%	0.677	37%	0.372	S	S	*	.	H	α-helix	trans	-83.3	-44.1	177.3	-55.5	102.7	0	0	0	111.3	G567 A571 Q573	G567-I569 VanDerWaalsContact C-N 3.29Å; G567-I569 PolarHBondContact O-N 3.42Å; I569-A571 PolarHBondContact O-N 3.47Å; I569-Q573 WeakPolarHBondContact O-CB 3.25Å
570	S	72.1	Confident	78.9	Confident	52 Å²	52	62.9 Å²	62.9	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-79.4	-15.2	-173.4	58.9	0	0	0	0	115	G567 T579 G581 Q582	G567-S570 PolarHBondContact O-N 3.38Å; G567-S570 PolarHBondContact O-OG 3.43Å; S570-T579 PolarHBondContact O-OG1 3.22Å; S570-G581 CarbonylContact O-C 3.52Å; S570-G581 WeakPolarHBondContact O-CA 3.42Å; S570-Q582 PolarHBondContact O-N 3.28Å
571	A	73.1	Confident	78.6	Confident	8 Å²	8	63.2 Å²	63.2	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-116.4	-22.1	-178.2	0	0	0	0	0	113.2	S565 G567 I569 Q582	S565-A571 WeakPolarHBondContact O-CB 3.38Å; G567-A571 VanDerWaalsContact O-CB 3.29Å; G567-A571 WeakPolarHBondContact O-CB 3.36Å; G567-A571 PolarHBondContact O-N 2.91Å; I569-A571 PolarHBondContact O-N 3.47Å; A571-Q582 WeakPolarHBondContact O-CG 3.21Å; A571-Q582 PolarHBondContact O-NE2 2.88Å
572	V	80	Confident	78.4	Confident	36 Å²	36	58.6 Å²	58.6	22%	0.218	37%	0.372	C	S	.	.	H	α-helix	trans	-126.4	-5.7	-163.4	-168.9	0	0	0	0	113.5	G568 L574 P671 A675	G568-V572 WeakPolarHBondContact O-CB 3.4Å; G568-V572 PolarHBondContact O-N 2.99Å; V572-L574 PolarHBondContact O-N 2.92Å; V572-P671 HydrophobicContact CG2-CB 4.16Å; V572-A675 HydrophobicContact CG1-CB 3.05Å
573	Q	81.6	Confident	78.3	Confident	61 Å²	61	58.5 Å²	58.5	29%	0.285	36%	0.357	S	S	.	.			trans	-62.1	135.6	-179.1	-177.9	176.3	-5.3	0	0	112.9	I569 T575 T579 Q582	I569-Q573 WeakPolarHBondContact O-CB 3.25Å; Q573-T575 WeakPolarHBondContact CG-OG1 3.4Å; Q573-T575 PolarHBondContact NE2-OG1 3.37Å; Q573-T579 HydrophobicContact CB-CG2 4.36Å; Q573-Q582 PolarHBondContact O-NE2 2.94Å
574	L	80.7	Confident	78.4	Confident	34 Å²	34	57.7 Å²	57.7	18%	0.178	36%	0.356	C	S	.	.			trans	-119.8	15.5	-176.5	-65.6	171.4	0	0	0	113.6	V572 F672 A675 I676 K679 F715 Y723	V572-L574 PolarHBondContact O-N 2.92Å; L574-F672 HydrophobicContact CD2-CD2 4.46Å; L574-F672 HydrophobicContact CD2-CE2 3.5Å; L574-F672 VanDerWaalsContact CD2-CE2 3.5Å; L574-F672 HydrophobicContact CD2-CZ 3.83Å; L574-A675 HydrophobicContact CD1-CB 4.07Å; L574-I676 HydrophobicContact CD1-CG1 4.41Å; L574-I676 HydrophobicContact CD2-CG1 3.91Å; L574-K679 HydrophobicContact CD1-CB 4.16Å; L574-F715 HydrophobicContact CD1-CZ 4.16Å; L574-Y723 HydrophobicContact CD2-CD2 4.12Å; L574-Y723 HydrophobicContact CD2-CE2 3.9Å; L574-Y723 PolarHBondContact O-OH 3.16Å
575	T	72.4	Confident	78.5	Confident	98 Å²	98	56.7 Å²	56.7	60%	0.601	35%	0.351	S	S	*	.	S	Bend	trans	-87.7	-43.8	-172.7	-25.2	0	0	0	0	112.8	Q573	Q573-T575 WeakPolarHBondContact CG-OG1 3.4Å; Q573-T575 PolarHBondContact NE2-OG1 3.37Å
576	D	72.8	Confident	78.8	Confident	101 Å²	101	55.5 Å²	55.5	54%	0.54	34%	0.341	S	S	.	.	S	Bend	trans	-128.1	-164.7	-170.3	-59.3	-53.6	0	0	0	111.1	Y723	D576-Y723 WeakPolarHBondContact O-CE1 3.39Å; D576-Y723 VanDerWaalsContact O-CZ 3.29Å; D576-Y723 PolarHBondContact O-OH 2.88Å
577	S	77.3	Confident	79.7	Confident	94 Å²	94	53.7 Å²	53.7	66%	0.657	32%	0.319	S	S	*	.	S	Bend	trans	-57.6	163.7	173.3	53.6	0	0	0	0	113	T579	S577-T579 PolarHBondContact O-N 2.91Å
578	Q	79.9	Confident	80.9	Confident	17 Å²	17	52.3 Å²	52.3	8%	0.079	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-50.6	134.2	-180	-62.9	-175.1	11.5	0	0	112.6	Q583 Q722 Y723 F725 D726	Q578-Q583 HydrophobicContact CB-CG 3.94Å; Q578-Q722 WeakPolarHBondContact CG-O 3.44Å; Q578-Q722 PolarHBondContact NE2-O 3.3Å; Q578-Y723 HydrophobicContact CG-CD1 4.03Å; Q578-Y723 VanDerWaalsContact NE2-C 3.35Å; Q578-Y723 PolarHBondContact NE2-O 3.38Å; Q578-Y723 VanDerWaalsContact NE2-O 3.11Å; Q578-F725 VanDerWaalsContact NE2-CD1 3.29Å; Q578-D726 PolarHBondContact OE1-OD2 2.98Å
579	T	84.7	Confident	82.2	Confident	28 Å²	28	49.5 Å²	49.5	17%	0.172	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-75.6	156.7	169.9	56.2	0	0	0	0	110.8	S570 Q573 S577 G581 Q582 Q583	S570-T579 PolarHBondContact O-OG1 3.22Å; Q573-T579 HydrophobicContact CB-CG2 4.36Å; S577-T579 PolarHBondContact O-N 2.91Å; T579-G581 PolarHBondContact O-N 2.83Å; T579-Q582 WeakPolarHBondContact O-CB 3.25Å; T579-Q582 PolarHBondContact O-N 3.11Å; T579-Q582 VanDerWaalsContact O-N 3.08Å; T579-Q582 WeakPolarHBondContact OG1-CB 3.25Å; T579-Q582 WeakPolarHBondContact OG1-CG 3.35Å; T579-Q582 PolarHBondContact OG1-N 3.16Å; T579-Q582 PolarHBondContact OG1-OE1 3.11Å; T579-Q583 PolarHBondContact O-N 3.28Å
580	L	82.2	Confident	83.4	Confident	143 Å²	143	44.6 Å²	44.6	75%	0.749	25%	0.251	S	S	*	.	H	α-helix	trans	-58.3	-33.1	176.6	-69	174.4	0	0	0	112.5	S584	L580-S584 VanDerWaalsContact O-CB 3.32Å; L580-S584 WeakPolarHBondContact O-CB 3.35Å; L580-S584 PolarHBondContact O-N 3.16Å
581	G	85.4	Confident	84.3	Confident	6 Å²	6	42.4 Å²	42.4	6%	0.062	24%	0.236	C	C	.	.	H	α-helix	trans	-69.8	-37.9	175.8	0	0	0	0	0	112.8	S570 T579 S584 N585	S570-G581 CarbonylContact O-C 3.52Å; S570-G581 WeakPolarHBondContact O-CA 3.42Å; T579-G581 PolarHBondContact O-N 2.83Å; G581-S584 PolarHBondContact O-N 3.08Å; G581-N585 WeakPolarHBondContact O-CB 3.45Å; G581-N585 PolarHBondContact O-N 3.02Å; G581-N585 PolarHBondContact O-OD1 3.35Å
582	Q	86.9	Confident	85.3	Confident	8 Å²	8	42 Å²	42	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-45.9	171.7	-75	163.8	-18.9	0	0	111.8	S570 A571 Q573 T579 S584 N585 I586 F672	S570-Q582 PolarHBondContact O-N 3.28Å; A571-Q582 WeakPolarHBondContact O-CG 3.21Å; A571-Q582 PolarHBondContact O-NE2 2.88Å; Q573-Q582 PolarHBondContact O-NE2 2.94Å; T579-Q582 WeakPolarHBondContact O-CB 3.25Å; T579-Q582 PolarHBondContact O-N 3.11Å; T579-Q582 VanDerWaalsContact O-N 3.08Å; T579-Q582 WeakPolarHBondContact OG1-CB 3.25Å; T579-Q582 WeakPolarHBondContact OG1-CG 3.35Å; T579-Q582 PolarHBondContact OG1-N 3.16Å; T579-Q582 PolarHBondContact OG1-OE1 3.11Å; Q582-S584 VanDerWaalsContact C-N 3.33Å; Q582-S584 PolarHBondContact O-N 3.05Å; Q582-N585 PolarHBondContact O-N 3.42Å; Q582-I586 VanDerWaalsContact O-CG1 3.3Å; Q582-I586 WeakPolarHBondContact O-CG1 3.5Å; Q582-I586 PolarHBondContact O-N 3.06Å; Q582-F672 HydrophobicContact CG-CD2 4.49Å; Q582-F672 VanDerWaalsContact NE2-CE2 3.32Å
583	Q	87.9	Confident	85.8	Confident	83 Å²	83	40.4 Å²	40.4	39%	0.388	22%	0.222	S	C	.	.	H	α-helix	trans	-58.8	-45.6	176	-74.5	177.4	-6.8	0	0	111.6	Q578 T579 I586 H587	Q578-Q583 HydrophobicContact CB-CG 3.94Å; T579-Q583 PolarHBondContact O-N 3.28Å; Q583-I586 PolarHBondContact O-N 3.3Å; Q583-H587 WeakPolarHBondContact O-CB 3.17Å; Q583-H587 PolarHBondContact O-N 3.36Å
584	S	88.2	Confident	86.2	Confident	29 Å²	29	40.8 Å²	40.8	20%	0.203	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-50.2	175.6	-179.5	0	0	0	0	111.2	L580 G581 Q582 I586 H587 L588	L580-S584 VanDerWaalsContact O-CB 3.32Å; L580-S584 WeakPolarHBondContact O-CB 3.35Å; L580-S584 PolarHBondContact O-N 3.16Å; G581-S584 PolarHBondContact O-N 3.08Å; Q582-S584 VanDerWaalsContact C-N 3.33Å; Q582-S584 PolarHBondContact O-N 3.05Å; S584-I586 VanDerWaalsContact C-N 3.35Å; S584-I586 PolarHBondContact O-N 2.98Å; S584-H587 WeakPolarHBondContact O-CA 3.27Å; S584-H587 WeakPolarHBondContact O-CB 3.38Å; S584-H587 PolarHBondContact O-N 2.9Å; S584-H587 VanDerWaalsContact O-N 3.1Å; S584-L588 WeakPolarHBondContact O-CG 3.47Å; S584-L588 PolarHBondContact O-N 3.32Å
585	N	90.7	Very high	86.7	Confident	16 Å²	16	39.1 Å²	39.1	9%	0.086	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-40.4	179.5	-73.4	-5.7	0	0	0	112.6	S565 G581 Q582 L588 V589 I668	S565-N585 PolarHBondContact N-OD1 3Å; S565-N585 PolarHBondContact O-ND2 2.9Å; G581-N585 WeakPolarHBondContact O-CB 3.45Å; G581-N585 PolarHBondContact O-N 3.02Å; G581-N585 PolarHBondContact O-OD1 3.35Å; Q582-N585 PolarHBondContact O-N 3.42Å; N585-L588 PolarHBondContact O-N 3.19Å; N585-V589 WeakPolarHBondContact O-CG2 3.29Å; N585-V589 PolarHBondContact O-N 2.98Å; N585-V589 VanDerWaalsContact O-N 3.1Å; N585-I668 HydrophobicContact CB-CG2 3.66Å
586	I	89.9	Confident	87.5	Confident	11 Å²	11	34.5 Å²	34.5	6%	0.056	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-41.8	174.7	-67.6	164	0	0	0	110.9	Q582 Q583 S584 L588 V589 N590 Y723 D726 L727	Q582-I586 VanDerWaalsContact O-CG1 3.3Å; Q582-I586 WeakPolarHBondContact O-CG1 3.5Å; Q582-I586 PolarHBondContact O-N 3.06Å; Q583-I586 PolarHBondContact O-N 3.3Å; S584-I586 VanDerWaalsContact C-N 3.35Å; S584-I586 PolarHBondContact O-N 2.98Å; I586-L588 VanDerWaalsContact C-N 3.34Å; I586-L588 PolarHBondContact O-N 2.8Å; I586-V589 PolarHBondContact O-N 2.57Å; I586-N590 PolarHBondContact O-N 3.09Å; I586-N590 VanDerWaalsContact O-N 3.07Å; I586-Y723 WeakPolarHBondContact CD1-O 3.2Å; I586-D726 HydrophobicContact CG2-CB 3.7Å; I586-L727 HydrophobicContact CG2-CD2 3.94Å; I586-L727 HydrophobicContact CG2-CG 4.03Å
587	H	90.4	Very high	88.1	Confident	83 Å²	83	30.3 Å²	30.3	38%	0.384	17%	0.165	S	C	.	.	H	α-helix	trans	-60.3	-43.5	175	-178.8	72.7	0	0	0	111.8	A514 Q583 S584 V589 N590 L591	A514-H587 PolarHBondContact O-CD2 2.82Å; A514-H587 VanDerWaalsContact O-CD2 3.24Å; A514-H587 PolarHBondContact O-NE2 3.12Å; Q583-H587 WeakPolarHBondContact O-CB 3.17Å; Q583-H587 PolarHBondContact O-N 3.36Å; S584-H587 WeakPolarHBondContact O-CA 3.27Å; S584-H587 WeakPolarHBondContact O-CB 3.38Å; S584-H587 PolarHBondContact O-N 2.9Å; S584-H587 VanDerWaalsContact O-N 3.1Å; H587-V589 VanDerWaalsContact C-N 3.35Å; H587-V589 PolarHBondContact O-N 3.35Å; H587-N590 WeakPolarHBondContact O-CB 3.48Å; H587-N590 PolarHBondContact O-N 3.27Å; H587-L591 WeakPolarHBondContact O-CB 3.39Å; H587-L591 PolarHBondContact O-N 3Å
588	L	91.6	Very high	88.7	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-39.2	177.1	-62.6	-180	0	0	0	112.2	T560 L563 I564 S584 N585 I586 N590 L591 L592 I668	T560-L588 HydrophobicContact CG2-CB 4.1Å; T560-L588 HydrophobicContact CG2-CD1 4.49Å; T560-L588 HydrophobicContact CG2-CD2 4.14Å; T560-L588 HydrophobicContact CG2-CG 4.45Å; L563-L588 HydrophobicContact CB-CD1 3.95Å; L563-L588 HydrophobicContact CB-CD2 4.19Å; L563-L588 HydrophobicContact CD1-CD2 4.24Å; I564-L588 HydrophobicContact CG1-CD1 4.12Å; S584-L588 WeakPolarHBondContact O-CG 3.47Å; S584-L588 PolarHBondContact O-N 3.32Å; N585-L588 PolarHBondContact O-N 3.19Å; I586-L588 VanDerWaalsContact C-N 3.34Å; I586-L588 PolarHBondContact O-N 2.8Å; L588-N590 VanDerWaalsContact C-N 3.34Å; L588-N590 PolarHBondContact O-N 3.41Å; L588-L591 WeakPolarHBondContact O-CB 3.44Å; L588-L591 PolarHBondContact O-N 3.17Å; L588-L592 VanDerWaalsContact O-CG 3.31Å; L588-L592 WeakPolarHBondContact O-CG 3.07Å; L588-L592 PolarHBondContact O-N 3.07Å; L588-I668 HydrophobicContact CB-CD1 4.22Å
589	V	91.9	Very high	89.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.3	-44.3	174	172.3	0	0	0	0	110.9	N585 I586 H587 L591 L592 C593 C665 I668 L669 L727 A753	N585-V589 WeakPolarHBondContact O-CG2 3.29Å; N585-V589 PolarHBondContact O-N 2.98Å; N585-V589 VanDerWaalsContact O-N 3.1Å; I586-V589 PolarHBondContact O-N 2.57Å; H587-V589 VanDerWaalsContact C-N 3.35Å; H587-V589 PolarHBondContact O-N 3.35Å; V589-L591 VanDerWaalsContact C-N 3.34Å; V589-L591 PolarHBondContact O-N 3.19Å; V589-L592 PolarHBondContact O-N 3.08Å; V589-C593 PolarHBondContact O-N 3.49Å; V589-C593 VanDerWaalsContact O-N 3.08Å; V589-C593 PolarHBondContact O-SG 3.01Å; V589-C665 HydrophobicContact CG1-CB 4.37Å; V589-I668 HydrophobicContact CG2-CB 3.98Å; V589-I668 HydrophobicContact CG2-CD1 4.24Å; V589-I668 HydrophobicContact CG2-CG2 3.75Å; V589-L669 HydrophobicContact CG2-CD2 4.19Å; V589-L669 HydrophobicContact CG2-CG 4.08Å; V589-L727 HydrophobicContact CB-CD2 4.42Å; V589-L727 HydrophobicContact CG1-CD2 4.01Å; V589-A753 HydrophobicContact CG1-CB 4.22Å
590	N	91.9	Very high	89.2	Confident	29 Å²	29	26.4 Å²	26.4	16%	0.155	14%	0.136	C	C	.	.	H	α-helix	trans	-63.1	-41.8	176.8	-71.2	-25.5	0	0	0	111.8	I586 H587 L588 C593 Q594 D726 S728	I586-N590 PolarHBondContact O-N 3.09Å; I586-N590 VanDerWaalsContact O-N 3.07Å; H587-N590 WeakPolarHBondContact O-CB 3.48Å; H587-N590 PolarHBondContact O-N 3.27Å; L588-N590 VanDerWaalsContact C-N 3.34Å; L588-N590 PolarHBondContact O-N 3.41Å; N590-C593 PolarHBondContact O-N 3.37Å; N590-Q594 WeakPolarHBondContact O-CB 3.42Å; N590-Q594 PolarHBondContact O-N 3.32Å; N590-D726 PolarHBondContact ND2-O 2.9Å; N590-S728 VanDerWaalsContact OD1-CB 3.24Å; N590-S728 WeakPolarHBondContact OD1-CB 3.47Å; N590-S728 PolarHBondContact OD1-N 2.82Å; N590-S728 PolarHBondContact OD1-OG 3.26Å
591	L	91.8	Very high	89.3	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-45.4	176.9	180	68.5	0	0	0	111.8	P516 F556 H587 L588 V589 Q594 F595	P516-L591 HydrophobicContact CG-CD1 4.35Å; P516-L591 HydrophobicContact CG-CD2 4.09Å; F556-L591 HydrophobicContact CZ-CD2 4.42Å; F556-L591 HydrophobicContact CZ-CG 4.31Å; H587-L591 WeakPolarHBondContact O-CB 3.39Å; H587-L591 PolarHBondContact O-N 3Å; L588-L591 WeakPolarHBondContact O-CB 3.44Å; L588-L591 PolarHBondContact O-N 3.17Å; V589-L591 VanDerWaalsContact C-N 3.34Å; V589-L591 PolarHBondContact O-N 3.19Å; L591-Q594 PolarHBondContact O-N 3.28Å; L591-F595 WeakPolarHBondContact O-CB 3.44Å; L591-F595 PolarHBondContact O-N 3.25Å
592	L	92.5	Very high	89.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-45	177.4	-72.3	166.4	0	0	0	111.8	F556 T560 L588 V589 F595 G596 L661 L664 C665 I668	F556-L592 HydrophobicContact CD1-CD2 4.25Å; F556-L592 HydrophobicContact CE1-CD2 4.04Å; T560-L592 HydrophobicContact CG2-CD1 4.04Å; T560-L592 HydrophobicContact CG2-CD2 3.93Å; T560-L592 HydrophobicContact CG2-CG 3.93Å; L588-L592 VanDerWaalsContact O-CG 3.31Å; L588-L592 WeakPolarHBondContact O-CG 3.07Å; L588-L592 PolarHBondContact O-N 3.07Å; V589-L592 PolarHBondContact O-N 3.08Å; L592-F595 PolarHBondContact O-N 3.49Å; L592-G596 PolarHBondContact O-N 3.3Å; L592-L661 HydrophobicContact CD2-CD2 3.72Å; L592-L664 HydrophobicContact CD1-CB 4.2Å; L592-L664 HydrophobicContact CD1-CD2 3.74Å; L592-L664 HydrophobicContact CD1-CG 3.84Å; L592-L664 HydrophobicContact CD2-CD2 3.91Å; L592-L664 HydrophobicContact CG-CD2 4.49Å; L592-C665 VanDerWaalsContact CB-SG 3.58Å; L592-I668 HydrophobicContact CD1-CD1 3.68Å
593	C	90.8	Very high	89.2	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.007	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-42.9	177	-63.1	0	0	0	0	111.3	V589 N590 T597 Y747 C749	V589-C593 PolarHBondContact O-N 3.49Å; V589-C593 VanDerWaalsContact O-N 3.08Å; V589-C593 PolarHBondContact O-SG 3.01Å; N590-C593 PolarHBondContact O-N 3.37Å; C593-T597 WeakPolarHBondContact O-CB 3.31Å; C593-T597 PolarHBondContact O-N 3.5Å; C593-T597 PolarHBondContact O-OG1 3.38Å; C593-Y747 WeakPolarHBondContact CB-O 3.46Å; C593-C749 VanDerWaalsContact SG-C 3.58Å
594	Q	89.6	Confident	89	Confident	69 Å²	69	21.4 Å²	21.4	32%	0.322	11%	0.113	S	C	.	.	H	α-helix	trans	-63.3	-45.1	177.6	-174.5	179.2	-5.8	0	0	111.5	L521 N590 L591 N598	L521-Q594 HydrophobicContact CD2-CB 4.24Å; L521-Q594 HydrophobicContact CD2-CG 3.7Å; N590-Q594 WeakPolarHBondContact O-CB 3.42Å; N590-Q594 PolarHBondContact O-N 3.32Å; L591-Q594 PolarHBondContact O-N 3.28Å; Q594-N598 WeakPolarHBondContact CG-ND2 3.4Å; Q594-N598 VanDerWaalsContact O-CB 3.24Å; Q594-N598 WeakPolarHBondContact O-CB 3.29Å; Q594-N598 VanDerWaalsContact O-CG 3.27Å; Q594-N598 PolarHBondContact O-N 3.23Å; Q594-N598 PolarHBondContact O-ND2 2.79Å
595	F	91.1	Very high	88.7	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-56.9	177.4	179.1	-123.4	0	0	0	111.3	L521 I524 I525 I553 F556 L591 L592 T597 N598 L599 L661	L521-F595 HydrophobicContact CD1-CB 3.78Å; L521-F595 HydrophobicContact CD1-CD2 3.37Å; L521-F595 HydrophobicContact CD1-CE2 4.31Å; L521-F595 HydrophobicContact CD1-CG 3.91Å; L521-F595 HydrophobicContact CD2-CB 4.45Å; L521-F595 HydrophobicContact CG-CD2 4.2Å; I524-F595 HydrophobicContact CG2-CE2 3.92Å; I524-F595 HydrophobicContact CG2-CZ 4.39Å; I525-F595 HydrophobicContact CD1-CD2 4.22Å; I525-F595 HydrophobicContact CG1-CD2 4.12Å; I525-F595 HydrophobicContact CG1-CE2 4.05Å; I553-F595 HydrophobicContact CG1-CE1 4.34Å; F556-F595 HydrophobicContact CB-CD1 4.47Å; F556-F595 HydrophobicContact CB-CE1 3.87Å; F556-F595 HydrophobicContact CB-CZ 4.22Å; F556-F595 AromaticContact CD1-CD1 3.43Å; F556-F595 HydrophobicContact CD1-CD1 3.43Å; F556-F595 VanDerWaalsContact CD1-CD1 3.43Å; F556-F595 AromaticContact CD1-CE1 3.73Å; F556-F595 HydrophobicContact CD1-CE1 3.73Å; F556-F595 HydrophobicContact CD1-CG 4.01Å; F556-F595 HydrophobicContact CD1-CZ 4.5Å; F556-F595 HydrophobicContact CD2-CD1 4.26Å; F556-F595 HydrophobicContact CD2-CD2 4.38Å; F556-F595 HydrophobicContact CD2-CE1 4.13Å; F556-F595 HydrophobicContact CD2-CE2 4.23Å; F556-F595 HydrophobicContact CD2-CG 4.38Å; F556-F595 HydrophobicContact CD2-CZ 4.1Å; F556-F595 HydrophobicContact CE1-CB 3.83Å; F556-F595 AromaticContact CE1-CD1 3.61Å; F556-F595 HydrophobicContact CE1-CD1 3.61Å; F556-F595 HydrophobicContact CE1-CE1 4.32Å; F556-F595 AromaticContact CE1-CG 3.73Å; F556-F595 HydrophobicContact CE1-CG 3.73Å; F556-F595 HydrophobicContact CE2-CD1 4.41Å; F556-F595 HydrophobicContact CE2-CD2 4.15Å; F556-F595 HydrophobicContact CE2-CE2 4.41Å; F556-F595 HydrophobicContact CE2-CG 4.14Å; F556-F595 AromaticContact CG-CD1 3.8Å; F556-F595 HydrophobicContact CG-CD1 3.8Å; F556-F595 AromaticContact CG-CE1 3.63Å; F556-F595 HydrophobicContact CG-CE1 3.63Å; F556-F595 HydrophobicContact CG-CG 4.33Å; F556-F595 HydrophobicContact CG-CZ 4.02Å; F556-F595 HydrophobicContact CZ-CB 3.9Å; F556-F595 HydrophobicContact CZ-CD1 4.11Å; F556-F595 HydrophobicContact CZ-CD2 4.24Å; F556-F595 AromaticContact CZ-CG 3.81Å; F556-F595 HydrophobicContact CZ-CG 3.81Å; L591-F595 WeakPolarHBondContact O-CB 3.44Å; L591-F595 PolarHBondContact O-N 3.25Å; L592-F595 PolarHBondContact O-N 3.49Å; F595-T597 PolarHBondContact O-N 3.01Å; F595-N598 PolarHBondContact O-N 2.92Å; F595-L599 HydrophobicContact CE1-CD2 4.33Å; F595-L599 HydrophobicContact CZ-CD2 4.06Å; F595-L599 WeakPolarHBondContact O-CB 3.43Å; F595-L599 PolarHBondContact O-N 2.98Å; F595-L661 HydrophobicContact CD1-CD1 3.78Å; F595-L661 HydrophobicContact CD1-CD2 4.18Å; F595-L661 HydrophobicContact CE1-CD1 4.31Å
596	G	89.5	Confident	88.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-40.9	-175.4	0	0	0	0	0	112.5	L592 Q600	L592-G596 PolarHBondContact O-N 3.3Å; G596-Q600 WeakPolarHBondContact O-CB 3.47Å; G596-Q600 VanDerWaalsContact O-CG 3.32Å; G596-Q600 WeakPolarHBondContact O-CG 3.48Å; G596-Q600 PolarHBondContact O-N 3.24Å
597	T	87	Confident	87.5	Confident	13 Å²	13	31 Å²	31	8%	0.08	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-48.7	177.8	-56.5	0	0	0	0	111.7	C593 F595 L599 Q600 L601 F741 Y747 V748	C593-T597 WeakPolarHBondContact O-CB 3.31Å; C593-T597 PolarHBondContact O-N 3.5Å; C593-T597 PolarHBondContact O-OG1 3.38Å; F595-T597 PolarHBondContact O-N 3.01Å; T597-L599 PolarHBondContact O-N 3.46Å; T597-Q600 PolarHBondContact O-N 2.86Å; T597-L601 HydrophobicContact CG2-CD1 3.94Å; T597-L601 HydrophobicContact CG2-CG 4.45Å; T597-L601 WeakPolarHBondContact O-CB 3.33Å; T597-L601 VanDerWaalsContact O-CG 3.27Å; T597-L601 WeakPolarHBondContact O-CG 3.48Å; T597-L601 PolarHBondContact O-N 3.43Å; T597-F741 HydrophobicContact CG2-CE1 4.15Å; T597-Y747 PolarHBondContact OG1-O 3Å; T597-V748 HydrophobicContact CG2-CG1 4.42Å; T597-V748 WeakPolarHBondContact OG1-CA 3.45Å
598	N	88.2	Confident	86.5	Confident	46 Å²	46	30.2 Å²	30.2	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-35	-178.5	-71.2	-19.2	0	0	0	111.9	I525 Q594 F595 T602	I525-N598 HydrophobicContact CD1-CB 3.46Å; I525-N598 VanDerWaalsContact CD1-CB 3.46Å; Q594-N598 WeakPolarHBondContact CG-ND2 3.4Å; Q594-N598 VanDerWaalsContact O-CB 3.24Å; Q594-N598 WeakPolarHBondContact O-CB 3.29Å; Q594-N598 VanDerWaalsContact O-CG 3.27Å; Q594-N598 PolarHBondContact O-N 3.23Å; Q594-N598 PolarHBondContact O-ND2 2.79Å; F595-N598 PolarHBondContact O-N 2.92Å; N598-T602 VanDerWaalsContact O-CB 3.28Å; N598-T602 WeakPolarHBondContact O-CB 3.37Å; N598-T602 PolarHBondContact O-N 3.15Å; N598-T602 PolarHBondContact O-OG1 3.37Å
599	L	89.4	Confident	85	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-53.7	173.3	-177.9	67	0	0	0	110.3	I525 A528 I553 F595 T597 L601 T602 V603	I525-L599 HydrophobicContact CG1-CB 4.26Å; I525-L599 HydrophobicContact CG1-CD1 4.28Å; I525-L599 HydrophobicContact CG2-CD1 4.38Å; A528-L599 HydrophobicContact CB-CD1 3.82Å; I553-L599 HydrophobicContact CD1-CD2 3.77Å; I553-L599 HydrophobicContact CG1-CD2 3.73Å; F595-L599 HydrophobicContact CE1-CD2 4.33Å; F595-L599 HydrophobicContact CZ-CD2 4.06Å; F595-L599 WeakPolarHBondContact O-CB 3.43Å; F595-L599 PolarHBondContact O-N 2.98Å; T597-L599 PolarHBondContact O-N 3.46Å; L599-L601 PolarHBondContact O-N 3.13Å; L599-T602 PolarHBondContact O-N 3.06Å; L599-V603 HydrophobicContact CD1-CG2 4.07Å; L599-V603 HydrophobicContact CG-CG2 4.42Å; L599-V603 WeakPolarHBondContact O-CB 3.42Å; L599-V603 VanDerWaalsContact O-CG2 3.25Å; L599-V603 WeakPolarHBondContact O-CG2 3.4Å; L599-V603 PolarHBondContact O-N 3.42Å
600	Q	86.5	Confident	83.3	Confident	11 Å²	11	39.1 Å²	39.1	5%	0.051	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-44.2	179	-75.6	-178.9	-5.3	0	0	111.8	G596 T597 N604 I653 T657 S744	G596-Q600 WeakPolarHBondContact O-CB 3.47Å; G596-Q600 VanDerWaalsContact O-CG 3.32Å; G596-Q600 WeakPolarHBondContact O-CG 3.48Å; G596-Q600 PolarHBondContact O-N 3.24Å; T597-Q600 PolarHBondContact O-N 2.86Å; Q600-N604 WeakPolarHBondContact O-CB 3.5Å; Q600-N604 PolarHBondContact O-N 3.23Å; Q600-N604 PolarHBondContact O-ND2 3.23Å; Q600-N604 VanDerWaalsContact O-ND2 3.15Å; Q600-I653 HydrophobicContact CG-CG2 4.25Å; Q600-T657 HydrophobicContact CG-CG2 4.35Å; Q600-T657 PolarHBondContact NE2-OG1 3.41Å; Q600-S744 VanDerWaalsContact OE1-CB 3.27Å
601	L	84.8	Confident	81.1	Confident	53 Å²	53	41.5 Å²	41.5	28%	0.277	21%	0.21	S	C	.	.	H	α-helix	trans	-63.2	-42.9	178	-75.5	174.7	0	0	0	112.6	T597 L599 K605 F741	T597-L601 HydrophobicContact CG2-CD1 3.94Å; T597-L601 HydrophobicContact CG2-CG 4.45Å; T597-L601 WeakPolarHBondContact O-CB 3.33Å; T597-L601 VanDerWaalsContact O-CG 3.27Å; T597-L601 WeakPolarHBondContact O-CG 3.48Å; T597-L601 PolarHBondContact O-N 3.43Å; L599-L601 PolarHBondContact O-N 3.13Å; L601-K605 WeakPolarHBondContact O-CB 3.44Å; L601-K605 WeakPolarHBondContact O-CG 3.49Å; L601-K605 PolarHBondContact O-N 3.03Å; L601-F741 HydrophobicContact CD1-CE1 4.33Å; L601-F741 HydrophobicContact CD1-CZ 4.24Å; L601-F741 HydrophobicContact CD2-CE1 3.91Å; L601-F741 HydrophobicContact CD2-CZ 3.76Å; L601-F741 HydrophobicContact CG-CE1 4.2Å; L601-F741 HydrophobicContact CG-CZ 4.35Å
602	T	85.9	Confident	78.6	Confident	26 Å²	26	47.4 Å²	47.4	16%	0.16	25%	0.247	C	C	.	.	H	α-helix	trans	-70.1	-43.4	-178.8	-55	0	0	0	0	110.9	I525 A529 N598 L599 K605 R606	I525-T602 HydrophobicContact CG2-CG2 3.91Å; I525-T602 WeakPolarHBondContact CG2-OG1 3.42Å; A529-T602 HydrophobicContact CB-CG2 3.8Å; N598-T602 VanDerWaalsContact O-CB 3.28Å; N598-T602 WeakPolarHBondContact O-CB 3.37Å; N598-T602 PolarHBondContact O-N 3.15Å; N598-T602 PolarHBondContact O-OG1 3.37Å; L599-T602 PolarHBondContact O-N 3.06Å; T602-K605 PolarHBondContact O-N 3.42Å; T602-R606 WeakPolarHBondContact O-CG 3.38Å; T602-R606 PolarHBondContact O-N 3.19Å
603	V	84.2	Confident	76	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-44.1	177.3	174	0	0	0	0	111.2	L532 L599 K605 R606 L607 L650 I653	L532-V603 HydrophobicContact CD1-CB 4.29Å; L532-V603 HydrophobicContact CD1-CG1 3.48Å; L532-V603 VanDerWaalsContact CD1-CG1 3.48Å; L532-V603 HydrophobicContact CD1-CG2 3.86Å; L599-V603 HydrophobicContact CD1-CG2 4.07Å; L599-V603 HydrophobicContact CG-CG2 4.42Å; L599-V603 WeakPolarHBondContact O-CB 3.42Å; L599-V603 VanDerWaalsContact O-CG2 3.25Å; L599-V603 WeakPolarHBondContact O-CG2 3.4Å; L599-V603 PolarHBondContact O-N 3.42Å; V603-K605 VanDerWaalsContact C-N 3.35Å; V603-K605 PolarHBondContact O-N 3.44Å; V603-R606 PolarHBondContact O-N 3.36Å; V603-L607 HydrophobicContact CG1-CD1 3.45Å; V603-L607 VanDerWaalsContact CG1-CD1 3.45Å; V603-L607 HydrophobicContact CG1-CG 4.3Å; V603-L607 WeakPolarHBondContact O-CB 3.23Å; V603-L607 PolarHBondContact O-N 3.37Å; V603-L650 HydrophobicContact CG1-CD2 4.15Å; V603-I653 HydrophobicContact CB-CD1 4.35Å; V603-I653 HydrophobicContact CG1-CD1 3.51Å; V603-I653 HydrophobicContact CG2-CD1 4.43Å
604	N	82.5	Confident	73.6	Confident	56 Å²	56	55.7 Å²	55.7	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-56.4	-48.1	173.6	-81.8	-30.3	0	0	0	111.1	Q600 R606 L607 S608 L650	Q600-N604 WeakPolarHBondContact O-CB 3.5Å; Q600-N604 PolarHBondContact O-N 3.23Å; Q600-N604 PolarHBondContact O-ND2 3.23Å; Q600-N604 VanDerWaalsContact O-ND2 3.15Å; N604-R606 VanDerWaalsContact C-N 3.34Å; N604-R606 PolarHBondContact O-N 3.04Å; N604-L607 PolarHBondContact O-N 3.48Å; N604-S608 WeakPolarHBondContact O-CB 3.31Å; N604-S608 PolarHBondContact O-N 2.89Å; N604-S608 PolarHBondContact O-OG 3.43Å; N604-L650 WeakPolarHBondContact OD1-CD1 3.36Å; N604-L650 WeakPolarHBondContact OD1-CD2 3.4Å
605	K	81.9	Confident	70.7	Confident	135 Å²	135	55.8 Å²	55.8	59%	0.587	31%	0.306	S	S	*	.	H	α-helix	trans	-60.9	-40.4	177.6	-75.3	170.4	-176.4	179	0	112.6	L601 T602 V603 S608 N609	L601-K605 WeakPolarHBondContact O-CB 3.44Å; L601-K605 WeakPolarHBondContact O-CG 3.49Å; L601-K605 PolarHBondContact O-N 3.03Å; T602-K605 PolarHBondContact O-N 3.42Å; V603-K605 VanDerWaalsContact C-N 3.35Å; V603-K605 PolarHBondContact O-N 3.44Å; K605-S608 PolarHBondContact O-OG 3.05Å; K605-N609 PolarHBondContact O-N 3.38Å; K605-N609 PolarHBondContact O-ND2 3.32Å; K605-N609 VanDerWaalsContact O-ND2 3.14Å; K605-N609 PolarHBondContact O-OD1 3.46Å
606	R	79.9	Confident	67.8	Low	114 Å²	114	60.6 Å²	60.6	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-68	-46.1	178.3	-72.8	-63.4	-171	-177.4	1.5	111.8	A529 T602 V603 N604 L610	A529-R606 HydrophobicContact CB-CG 4.09Å; T602-R606 WeakPolarHBondContact O-CG 3.38Å; T602-R606 PolarHBondContact O-N 3.19Å; V603-R606 PolarHBondContact O-N 3.36Å; N604-R606 VanDerWaalsContact C-N 3.34Å; N604-R606 PolarHBondContact O-N 3.04Å; R606-L610 WeakPolarHBondContact O-CD1 3.27Å; R606-L610 WeakPolarHBondContact O-CG 3.45Å
607	L	76.9	Confident	65.1	Low	7 Å²	7	67.3 Å²	67.3	4%	0.037	38%	0.375	C	S	.	.	H	α-helix	trans	-75.9	-34.8	-177.9	-72.8	165.5	0	0	0	112.9	T536 L542 V603 N604 N609 L610 N611 P649 L650	T536-L607 HydrophobicContact CG2-CD2 4.48Å; L542-L607 HydrophobicContact CD1-CD2 4.21Å; L542-L607 HydrophobicContact CD2-CD2 4.03Å; V603-L607 HydrophobicContact CG1-CD1 3.45Å; V603-L607 VanDerWaalsContact CG1-CD1 3.45Å; V603-L607 HydrophobicContact CG1-CG 4.3Å; V603-L607 WeakPolarHBondContact O-CB 3.23Å; V603-L607 PolarHBondContact O-N 3.37Å; N604-L607 PolarHBondContact O-N 3.48Å; L607-N609 PolarHBondContact O-N 3.42Å; L607-L610 CarbonylContact O-C 3.49Å; L607-L610 WeakPolarHBondContact O-CA 3.39Å; L607-L610 PolarHBondContact O-N 3.37Å; L607-N611 PolarHBondContact O-N 3.18Å; L607-N611 VanDerWaalsContact O-N 3.09Å; L607-P649 HydrophobicContact CD1-CB 4.45Å; L607-P649 HydrophobicContact CD1-CG 4.44Å; L607-L650 HydrophobicContact CB-CD2 4.41Å; L607-L650 HydrophobicContact CD1-CD2 3.45Å; L607-L650 VanDerWaalsContact CD1-CD2 3.45Å; L607-L650 HydrophobicContact CD1-CG 4.16Å
608	S	69.8	Low	62.5	Low	68 Å²	68	73.1 Å²	73.1	48%	0.476	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-35.1	176.8	64.5	0	0	0	0	111.8	N604 K605 L610	N604-S608 WeakPolarHBondContact O-CB 3.31Å; N604-S608 PolarHBondContact O-N 2.89Å; N604-S608 PolarHBondContact O-OG 3.43Å; K605-S608 PolarHBondContact O-OG 3.05Å; S608-L610 PolarHBondContact O-N 3.32Å
609	N	59.9	Low	59.5	Low	128 Å²	128	77.5 Å²	77.5	68%	0.684	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.6	175.7	-65.6	-8.4	0	0	0	112.7	K605 L607	K605-N609 PolarHBondContact O-N 3.38Å; K605-N609 PolarHBondContact O-ND2 3.32Å; K605-N609 VanDerWaalsContact O-ND2 3.14Å; K605-N609 PolarHBondContact O-OD1 3.46Å; L607-N609 PolarHBondContact O-N 3.42Å
610	L	54.9	Low	56.6	Low	59 Å²	59	86.4 Å²	86.4	31%	0.309	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-5.7	-174.5	-65.5	163.8	0	0	0	113.2	T536 R606 L607 S608 T612 I613	T536-L610 HydrophobicContact CG2-CD1 3.38Å; T536-L610 HydrophobicContact CG2-CG 4.44Å; R606-L610 WeakPolarHBondContact O-CD1 3.27Å; R606-L610 WeakPolarHBondContact O-CG 3.45Å; L607-L610 CarbonylContact O-C 3.49Å; L607-L610 WeakPolarHBondContact O-CA 3.39Å; L607-L610 PolarHBondContact O-N 3.37Å; S608-L610 PolarHBondContact O-N 3.32Å; L610-T612 PolarHBondContact O-N 3.07Å; L610-I613 PolarHBondContact O-N 3.5Å
611	N	46	Very low	53.8	Low	78 Å²	78	94.1 Å²	94.1	42%	0.417	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	23.2	-179.3	-82.9	-13.9	0	0	0	115.1	L607	L607-N611 PolarHBondContact O-N 3.18Å; L607-N611 VanDerWaalsContact O-N 3.09Å
612	T	39.4	Very low	50.9	Low	130 Å²	130	103.7 Å²	103.7	80%	0.798	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.7	164.3	40.2	0	0	0	0	113.6	L610	L610-T612 PolarHBondContact O-N 3.07Å
613	I	38.8	Very low	48	Very low	104 Å²	104	112.7 Å²	112.7	53%	0.533	57%	0.567	S	S	.	*	S	Bend	trans	-103.3	-9	-174	-57.3	178.9	0	0	0	114.1	L610	L610-I613 PolarHBondContact O-N 3.5Å
614	T	39.1	Very low	45.1	Very low	71 Å²	71	119.9 Å²	119.9	44%	0.436	61%	0.606	S	S	.	*	S	Bend	trans	-126.6	5	-176	44.1	0	0	0	0	115.6
615	A	29.8	Very low	42.5	Very low	72 Å²	72	126.3 Å²	126.3	60%	0.595	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	2	178.1	0	0	0	0	0	114.8
616	S	30.5	Very low	39.6	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-7.6	178.7	49.9	0	0	0	0	115.2
617	N	31.3	Very low	37.1	Very low	141 Å²	141	124 Å²	124	75%	0.754	65%	0.649	S	S	*	*	S	Bend	trans	-132.7	14.9	-173.7	-84.9	-26.7	0	0	0	117.2
618	I	32.9	Very low	34.6	Very low	135 Å²	135	130 Å²	130	69%	0.692	69%	0.687	S	S	*	*	S	Bend	trans	-117	-4.9	179	-62.5	178.6	0	0	0	114.1
619	N	25.8	Very low	32.5	Very low	139 Å²	139	133.1 Å²	133.1	74%	0.743	71%	0.707	S	S	*	*	S	Bend	trans	-108.1	43.7	-177.9	-75.3	-21.8	0	0	0	115
620	H	27.5	Very low	30.9	Very low	188 Å²	188	134.4 Å²	134.4	87%	0.87	71%	0.713	S	S	*	*	S	Bend	trans	-144.9	75.8	161.8	-83.8	-57.7	0	0	0	111.7
621	K	27.3	Very low	29.5	Very low	173 Å²	173	139.3 Å²	139.3	75%	0.752	74%	0.739	S	S	*	*			trans	176	64.2	145.1	-97.5	168.2	-175.4	178.7	0	110.5	Y623	K621-Y623 VanDerWaalsContact C-N 3.3Å
622	R	23.7	Very low	28.6	Very low	254 Å²	254	138.5 Å²	138.5	96%	0.958	75%	0.75	S	S	*	*			trans	-94.2	73.1	149	-114.4	-177.3	-179	167.5	0.1	106.7
623	Y	25.5	Very low	27.9	Very low	214 Å²	214	138.6 Å²	138.6	84%	0.839	75%	0.75	S	S	*	*			trans	-90.4	112.9	164.2	-106.3	-82.3	0	0	0	107.5	K621 K625	K621-Y623 VanDerWaalsContact C-N 3.3Å; Y623-K625 PolarHBondContact O-N 2.87Å
624	N	23.5	Very low	27.4	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	77%	0.767	S	S	*	*			trans	-48.5	125.7	165.7	-72.8	-27.1	0	0	0	109.8
625	K	27.7	Very low	26.8	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.826	78%	0.784	S	S	*	*			trans	-132.6	76.9	159	-140.9	177.5	-172.8	-176.8	0	109.3	Y623 S627	Y623-K625 PolarHBondContact O-N 2.87Å; K625-S627 PolarHBondContact O-N 2.91Å
626	S	22.2	Very low	26.6	Very low	115 Å²	115	149.3 Å²	149.3	80%	0.804	79%	0.793	S	S	*	*			trans	-71.8	97.7	149.7	51.5	0	0	0	0	107.3
627	S	26.7	Very low	26.3	Very low	86 Å²	86	151.6 Å²	151.6	60%	0.601	80%	0.803	S	S	*	*			trans	-154.3	103.7	165.3	-41.1	0	0	0	0	108.8	K625	K625-S627 PolarHBondContact O-N 2.91Å
628	T	24.6	Very low	26.1	Very low	133 Å²	133	149.6 Å²	149.6	82%	0.816	80%	0.796	S	S	*	*			trans	-34.3	136.6	152.8	47.6	0	0	0	0	112.5
629	C	25.2	Very low	25.7	Very low	133 Å²	133	149.3 Å²	149.3	90%	0.899	80%	0.801	S	S	*	*				-172.5	141.9	128.3	-90.6	0	0	0	0	111.4
630	L	25.9	Very low	25.8	Very low	156 Å²	156	150 Å²	150	82%	0.817	80%	0.803	S	S	*	*			trans	-75.1	159.9	175.1	-74.4	136.8	0	0	0	112.2
631	D	25.5	Very low	25.8	Very low	161 Å²	161	149 Å²	149	86%	0.861	80%	0.799	S	S	*	*			trans	70.4	133.4	152.5	-67.2	-17.9	0	0	0	121.6
632	G	27.9	Very low	25.8	Very low	62 Å²	62	146 Å²	146	64%	0.639	80%	0.795	S	S	*	*			trans	128.8	69.2	146.7	0	0	0	0	0	117.7
633	T	25.6	Very low	26	Very low	132 Å²	132	142.7 Å²	142.7	81%	0.81	79%	0.792	S	S	*	*			trans	29.3	107.1	138.7	40.2	0	0	0	0	120.2
634	F	27.6	Very low	26.4	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.873	78%	0.782	S	S	*	*			trans	-156.3	130.7	136.1	-82.7	-72.6	0	0	0	109.4	L636	F634-L636 PolarHBondContact O-N 3.21Å
635	P	27.1	Very low	27.3	Very low	124 Å²	124	134.8 Å²	134.8	81%	0.805	77%	0.774	S	S	*	*			trans	-90.2	98.4	177.3	33.7	-26.3	0	0	0	109.6
636	L	25.8	Very low	28.2	Very low	148 Å²	148	131.8 Å²	131.8	78%	0.775	77%	0.765	S	S	*	*			trans	-99.7	92.5	163.6	-84.9	159.5	0	0	0	108.6	F634 T638	F634-L636 PolarHBondContact O-N 3.21Å; L636-T638 PolarHBondContact O-N 3.45Å
637	T	24.1	Very low	30	Very low	148 Å²	148	129.9 Å²	129.9	91%	0.908	74%	0.743	S	S	*	*			trans	-65.5	77.8	155.9	25.9	0	0	0	0	108.9
638	T	25.5	Very low	32.3	Very low	100 Å²	100	128.9 Å²	128.9	61%	0.613	73%	0.73	S	S	*	*			trans	-105.4	117.5	155.4	27.1	0	0	0	0	106.6	L636 I640	L636-T638 PolarHBondContact O-N 3.45Å; T638-I640 PolarHBondContact O-N 2.61Å
639	T	26.2	Very low	34.8	Very low	129 Å²	129	122.9 Å²	122.9	79%	0.791	69%	0.694	S	S	*	*			trans	-29.9	98.9	165.8	42.6	0	0	0	0	110.9	E641	T639-E641 PolarHBondContact O-N 3.23Å
640	I	27.9	Very low	37.5	Very low	154 Å²	154	118.7 Å²	118.7	79%	0.79	66%	0.662	S	S	*	*			trans	-67.5	85.4	158.2	-62.3	171.2	0	0	0	103.4	T638 T642	T638-I640 PolarHBondContact O-N 2.61Å; I640-T642 PolarHBondContact O-N 3.47Å
641	E	26.9	Very low	40.1	Very low	167 Å²	167	116.3 Å²	116.3	78%	0.78	65%	0.647	S	S	*	*			trans	-49	105	149	-74.5	-174.8	162.8	0	0	104.2	T639 M643	T639-E641 PolarHBondContact O-N 3.23Å; E641-M643 VanDerWaalsContact C-N 3.27Å; E641-M643 PolarHBondContact O-N 2.84Å
642	T	27.6	Very low	42.9	Very low	109 Å²	109	110.2 Å²	110.2	67%	0.669	61%	0.614	S	S	*	*			trans	-51.6	101	174.8	46.9	0	0	0	0	105.8	I640 T644	I640-T642 PolarHBondContact O-N 3.47Å; T642-T644 PolarHBondContact O-N 3.28Å
643	M	26.6	Very low	45.6	Very low	184 Å²	184	107.5 Å²	107.5	91%	0.906	59%	0.585	S	S	*	*			trans	-56.1	92.6	165.2	-84.5	179.8	94.1	0	0	104.5	E641 P645	E641-M643 VanDerWaalsContact C-N 3.27Å; E641-M643 PolarHBondContact O-N 2.84Å; M643-P645 WeakPolarHBondContact O-CD 3.39Å
644	T	34.6	Very low	48.5	Very low	102 Å²	102	102.6 Å²	102.6	63%	0.626	56%	0.556	S	S	*	*			trans	-55.4	118.4	173.1	49	0	0	0	0	104.4	T642 I646	T642-T644 PolarHBondContact O-N 3.28Å; T644-I646 PolarHBondContact O-N 2.98Å; T644-I646 VanDerWaalsContact O-N 3.13Å
645	P	41.5	Very low	51.3	Low	98 Å²	98	96.2 Å²	96.2	64%	0.636	53%	0.529	S	S	*	.			trans	-52.9	129.2	-178.2	21.8	-31.9	0	0	0	106.6	M643 K647	M643-P645 WeakPolarHBondContact O-CD 3.39Å; P645-K647 VanDerWaalsContact C-N 3.31Å; P645-K647 WeakPolarHBondContact O-CA 3.46Å; P645-K647 WeakPolarHBondContact O-CG 3.39Å; P645-K647 PolarHBondContact O-N 2.84Å
646	I	48.5	Very low	54.1	Low	127 Å²	127	90.3 Å²	90.3	65%	0.651	49%	0.491	S	S	*	.			trans	-50.1	99.4	-176.5	-63.8	168.3	0	0	0	107.1	T644 N648	T644-I646 PolarHBondContact O-N 2.98Å; T644-I646 VanDerWaalsContact O-N 3.13Å; I646-N648 PolarHBondContact O-N 3.19Å
647	K	58.5	Low	57.1	Low	75 Å²	75	83.3 Å²	83.3	33%	0.326	45%	0.454	S	S	.	.			trans	-75.5	118.6	-166.6	-69.1	-165.8	172.2	-163.6	0	107.1	L543 P645 L652 E655	L543-K647 WeakPolarHBondContact CD2-O 3.5Å; P645-K647 VanDerWaalsContact C-N 3.31Å; P645-K647 WeakPolarHBondContact O-CA 3.46Å; P645-K647 WeakPolarHBondContact O-CG 3.39Å; P645-K647 PolarHBondContact O-N 2.84Å; K647-L652 HydrophobicContact CB-CD1 4.29Å; K647-L652 HydrophobicContact CB-CD2 4.15Å; K647-L652 HydrophobicContact CB-CG 3.94Å; K647-L652 HydrophobicContact CD-CD2 3.49Å; K647-L652 VanDerWaalsContact CD-CD2 3.49Å; K647-L652 HydrophobicContact CD-CG 4.21Å; K647-L652 HydrophobicContact CG-CD2 4.47Å; K647-E655 IonicContact NZ-OE1 2.89Å; K647-E655 IonicContact NZ-OE2 3.99Å; K647-E655 PolarHBondContact NZ-OE2 3.29Å
648	N	76.1	Confident	60.1	Low	65 Å²	65	81.9 Å²	81.9	35%	0.348	43%	0.432	S	S	.	.			trans	-62.7	139	172.8	-173.7	-44.7	0	0	0	108.6	I646 L650 Q651 L652	I646-N648 PolarHBondContact O-N 3.19Å; N648-L650 PolarHBondContact O-N 2.54Å; N648-L650 WeakPolarHBondContact OD1-CB 3.34Å; N648-L650 PolarHBondContact OD1-N 2.75Å; N648-Q651 HydrophobicContact CB-CB 4.39Å; N648-Q651 HydrophobicContact CB-CG 4.11Å; N648-Q651 WeakPolarHBondContact O-CA 3.46Å; N648-Q651 WeakPolarHBondContact O-CB 3.38Å; N648-Q651 PolarHBondContact O-N 3.32Å; N648-L652 PolarHBondContact O-N 3.28Å; N648-L652 VanDerWaalsContact O-N 3.11Å
649	P	76.6	Confident	63.1	Low	8 Å²	8	80.7 Å²	80.7	5%	0.052	42%	0.422	C	S	.	.	H	α-helix	trans	-50.6	-32.9	175.5	20.1	-34.8	0	0	0	113.1	L542 T546 L607 L652 I653	L542-P649 HydrophobicContact CD2-CB 4.5Å; L542-P649 HydrophobicContact CD2-CG 3.95Å; L542-P649 HydrophobicContact CG-CB 4.42Å; L542-P649 HydrophobicContact CG-CG 4.39Å; T546-P649 HydrophobicContact CG2-CB 4.15Å; T546-P649 WeakPolarHBondContact OG1-CB 3.45Å; L607-P649 HydrophobicContact CD1-CB 4.45Å; L607-P649 HydrophobicContact CD1-CG 4.44Å; P649-L652 PolarHBondContact O-N 3.29Å; P649-I653 WeakPolarHBondContact O-CG1 3.32Å; P649-I653 PolarHBondContact O-N 3.23Å; P649-I653 VanDerWaalsContact O-N 3.16Å
650	L	81.5	Confident	66.2	Low	44 Å²	44	77.6 Å²	77.6	23%	0.23	40%	0.398	C	S	.	.	H	α-helix	trans	-68	-36.4	175.9	-63.2	-179.3	0	0	0	113.4	V603 N604 L607 N648 S654	V603-L650 HydrophobicContact CG1-CD2 4.15Å; N604-L650 WeakPolarHBondContact OD1-CD1 3.36Å; N604-L650 WeakPolarHBondContact OD1-CD2 3.4Å; L607-L650 HydrophobicContact CB-CD2 4.41Å; L607-L650 HydrophobicContact CD1-CD2 3.45Å; L607-L650 VanDerWaalsContact CD1-CD2 3.45Å; L607-L650 HydrophobicContact CD1-CG 4.16Å; N648-L650 PolarHBondContact O-N 2.54Å; N648-L650 WeakPolarHBondContact OD1-CB 3.34Å; N648-L650 PolarHBondContact OD1-N 2.75Å; L650-S654 WeakPolarHBondContact O-CB 3.15Å; L650-S654 PolarHBondContact O-N 3.5Å; L650-S654 PolarHBondContact O-OG 3.19Å
651	Q	81.8	Confident	69.3	Low	107 Å²	107	70.2 Å²	70.2	50%	0.5	36%	0.361	S	S	.	.	H	α-helix	trans	-70.2	-35.8	176	-71.5	175.5	-21.5	0	0	111.6	N648 S654 E655	N648-Q651 HydrophobicContact CB-CB 4.39Å; N648-Q651 HydrophobicContact CB-CG 4.11Å; N648-Q651 WeakPolarHBondContact O-CA 3.46Å; N648-Q651 WeakPolarHBondContact O-CB 3.38Å; N648-Q651 PolarHBondContact O-N 3.32Å; Q651-S654 WeakPolarHBondContact CA-OG 3.39Å; Q651-S654 PolarHBondContact O-N 2.83Å; Q651-S654 PolarHBondContact O-OG 3.4Å; Q651-E655 WeakPolarHBondContact O-CB 3.01Å; Q651-E655 PolarHBondContact O-N 3.19Å
652	L	83.2	Confident	72.3	Confident	33 Å²	33	62.9 Å²	62.9	17%	0.173	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-43.7	174.9	-77	171.7	0	0	0	111.7	L543 T546 K647 N648 P649 E655 S656	L543-L652 HydrophobicContact CD2-CD1 3.97Å; T546-L652 HydrophobicContact CG2-CB 3.79Å; T546-L652 HydrophobicContact CG2-CD1 4.13Å; K647-L652 HydrophobicContact CB-CD1 4.29Å; K647-L652 HydrophobicContact CB-CD2 4.15Å; K647-L652 HydrophobicContact CB-CG 3.94Å; K647-L652 HydrophobicContact CD-CD2 3.49Å; K647-L652 VanDerWaalsContact CD-CD2 3.49Å; K647-L652 HydrophobicContact CD-CG 4.21Å; K647-L652 HydrophobicContact CG-CD2 4.47Å; N648-L652 PolarHBondContact O-N 3.28Å; N648-L652 VanDerWaalsContact O-N 3.11Å; P649-L652 PolarHBondContact O-N 3.29Å; L652-E655 PolarHBondContact O-N 2.9Å; L652-S656 WeakPolarHBondContact O-CB 3.33Å; L652-S656 PolarHBondContact O-N 3.17Å
653	I	85.6	Confident	75.3	Confident	5 Å²	5	62 Å²	62	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-68.2	-40.1	178.3	-65	170.4	0	0	0	110.6	L532 T546 I553 Q600 V603 P649 S656 T657	L532-I653 HydrophobicContact CD1-CD1 4.33Å; T546-I653 HydrophobicContact CG2-CD1 4.08Å; T546-I653 HydrophobicContact CG2-CG1 3.73Å; I553-I653 HydrophobicContact CD1-CG2 4.42Å; Q600-I653 HydrophobicContact CG-CG2 4.25Å; V603-I653 HydrophobicContact CB-CD1 4.35Å; V603-I653 HydrophobicContact CG1-CD1 3.51Å; V603-I653 HydrophobicContact CG2-CD1 4.43Å; P649-I653 WeakPolarHBondContact O-CG1 3.32Å; P649-I653 PolarHBondContact O-N 3.23Å; P649-I653 VanDerWaalsContact O-N 3.16Å; I653-S656 PolarHBondContact O-N 3.03Å; I653-T657 HydrophobicContact CG2-CG2 4.37Å; I653-T657 WeakPolarHBondContact O-CG2 3.31Å; I653-T657 PolarHBondContact O-N 2.77Å; I653-T657 PolarHBondContact O-OG1 3.41Å
654	S	85.2	Confident	78.4	Confident	29 Å²	29	53.7 Å²	53.7	20%	0.203	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-41.2	176.4	70.1	0	0	0	0	112.1	L650 Q651 T657 R658	L650-S654 WeakPolarHBondContact O-CB 3.15Å; L650-S654 PolarHBondContact O-N 3.5Å; L650-S654 PolarHBondContact O-OG 3.19Å; Q651-S654 WeakPolarHBondContact CA-OG 3.39Å; Q651-S654 PolarHBondContact O-N 2.83Å; Q651-S654 PolarHBondContact O-OG 3.4Å; S654-T657 PolarHBondContact O-OG1 2.99Å; S654-R658 WeakPolarHBondContact O-CB 3.28Å; S654-R658 PolarHBondContact O-N 3.42Å
655	E	86.3	Confident	81.1	Confident	64 Å²	64	48.9 Å²	48.9	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-47	170.7	-87.2	-172.7	140	0	0	112	K647 Q651 L652 R658 N659	K647-E655 IonicContact NZ-OE1 2.89Å; K647-E655 IonicContact NZ-OE2 3.99Å; K647-E655 PolarHBondContact NZ-OE2 3.29Å; Q651-E655 WeakPolarHBondContact O-CB 3.01Å; Q651-E655 PolarHBondContact O-N 3.19Å; L652-E655 PolarHBondContact O-N 2.9Å; E655-R658 WeakPolarHBondContact O-CB 3.4Å; E655-R658 PolarHBondContact O-N 2.91Å; E655-N659 WeakPolarHBondContact O-CB 3.35Å; E655-N659 PolarHBondContact O-N 2.98Å; E655-N659 PolarHBondContact O-ND2 3.09Å; E655-N659 PolarHBondContact O-OD1 3.28Å
656	S	87.1	Confident	83.5	Confident	1 Å²	1	46 Å²	46	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-60.9	-50.1	-179	-174.9	0	0	0	0	112.2	D550 I553 L652 I653 R658 N659 H660	D550-S656 WeakPolarHBondContact CA-OG 3.14Å; D550-S656 WeakPolarHBondContact OD1-CB 3.11Å; D550-S656 PolarHBondContact OD1-OG 3.38Å; I553-S656 WeakPolarHBondContact CD1-OG 3.34Å; L652-S656 WeakPolarHBondContact O-CB 3.33Å; L652-S656 PolarHBondContact O-N 3.17Å; I653-S656 PolarHBondContact O-N 3.03Å; S656-R658 VanDerWaalsContact C-N 3.31Å; S656-R658 PolarHBondContact O-N 3.43Å; S656-N659 PolarHBondContact O-N 2.77Å; S656-H660 WeakPolarHBondContact O-CB 3.21Å; S656-H660 PolarHBondContact O-CD2 3.33Å; S656-H660 PolarHBondContact O-N 2.93Å
657	T	87.9	Confident	85.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-38.8	176.5	53	0	0	0	0	112.4	I553 Q600 I653 S654 L661 N662	I553-T657 HydrophobicContact CD1-CG2 3.99Å; Q600-T657 HydrophobicContact CG-CG2 4.35Å; Q600-T657 PolarHBondContact NE2-OG1 3.41Å; I653-T657 HydrophobicContact CG2-CG2 4.37Å; I653-T657 WeakPolarHBondContact O-CG2 3.31Å; I653-T657 PolarHBondContact O-N 2.77Å; I653-T657 PolarHBondContact O-OG1 3.41Å; S654-T657 PolarHBondContact O-OG1 2.99Å; T657-L661 HydrophobicContact CG2-CD1 3.99Å; T657-L661 WeakPolarHBondContact O-CA 3.36Å; T657-L661 VanDerWaalsContact O-CB 3.25Å; T657-L661 WeakPolarHBondContact O-CB 3.27Å; T657-L661 PolarHBondContact O-N 3.49Å; T657-N662 PolarHBondContact O-N 3.15Å; T657-N662 VanDerWaalsContact O-N 3.16Å
658	R	87.3	Confident	87	Confident	118 Å²	118	39.7 Å²	39.7	45%	0.445	20%	0.203	S	C	.	.	I	π-helix	trans	-63.9	-47.1	174.4	-174.6	176.8	59.9	135.2	-2.3	111.6	S654 E655 S656 N662 G745	S654-R658 WeakPolarHBondContact O-CB 3.28Å; S654-R658 PolarHBondContact O-N 3.42Å; E655-R658 WeakPolarHBondContact O-CB 3.4Å; E655-R658 PolarHBondContact O-N 2.91Å; S656-R658 VanDerWaalsContact C-N 3.31Å; S656-R658 PolarHBondContact O-N 3.43Å; R658-N662 WeakPolarHBondContact O-CB 3.38Å; R658-G745 WeakPolarHBondContact CA-O 3.17Å; R658-G745 VanDerWaalsContact CB-O 3.31Å; R658-G745 WeakPolarHBondContact CB-O 3.29Å
659	N	88.1	Confident	87.7	Confident	76 Å²	76	37 Å²	37	41%	0.406	19%	0.188	S	C	.	.	I	π-helix	trans	-71.5	-35.2	-174.1	-68.7	-12.7	0	0	0	112.8	E655 S656 N663	E655-N659 WeakPolarHBondContact O-CB 3.35Å; E655-N659 PolarHBondContact O-N 2.98Å; E655-N659 PolarHBondContact O-ND2 3.09Å; E655-N659 PolarHBondContact O-OD1 3.28Å; S656-N659 PolarHBondContact O-N 2.77Å; N659-N663 WeakPolarHBondContact O-CB 3.44Å; N659-N663 PolarHBondContact O-ND2 3.41Å
660	H	91.1	Very high	88.4	Confident	63 Å²	63	39.2 Å²	39.2	29%	0.292	20%	0.2	S	C	.	.	I	π-helix	trans	-99.8	-51.3	-176.7	-65.1	-61	0	0	0	112.6	D550 I553 A557 S656 L664	D550-H660 IonicContact OD1-CD2 2.98Å; D550-H660 IonicContact OD1-NE2 3.39Å; I553-H660 HydrophobicContact CG2-CB 4Å; A557-H660 HydrophobicContact CB-CB 4.11Å; S656-H660 WeakPolarHBondContact O-CB 3.21Å; S656-H660 PolarHBondContact O-CD2 3.33Å; S656-H660 PolarHBondContact O-N 2.93Å; H660-L664 WeakPolarHBondContact O-CB 3.49Å; H660-L664 PolarHBondContact O-N 2.97Å
661	L	92.9	Very high	88.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-81.5	-49	-171.7	-51.2	179.5	0	0	0	112	I553 F556 A557 L592 F595 T657 N663 L664 C665	I553-L661 HydrophobicContact CG2-CD1 4.18Å; I553-L661 HydrophobicContact CG2-CD2 3.98Å; I553-L661 HydrophobicContact CG2-CG 3.85Å; F556-L661 HydrophobicContact CD1-CD2 4.32Å; A557-L661 HydrophobicContact CB-CD2 4.16Å; L592-L661 HydrophobicContact CD2-CD2 3.72Å; F595-L661 HydrophobicContact CD1-CD1 3.78Å; F595-L661 HydrophobicContact CD1-CD2 4.18Å; F595-L661 HydrophobicContact CE1-CD1 4.31Å; T657-L661 HydrophobicContact CG2-CD1 3.99Å; T657-L661 WeakPolarHBondContact O-CA 3.36Å; T657-L661 VanDerWaalsContact O-CB 3.25Å; T657-L661 WeakPolarHBondContact O-CB 3.27Å; T657-L661 PolarHBondContact O-N 3.49Å; L661-N663 PolarHBondContact O-N 2.99Å; L661-L664 PolarHBondContact O-N 3.43Å; L661-C665 PolarHBondContact O-N 3.5Å; L661-C665 PolarHBondContact O-SG 2.9Å; L661-C665 VanDerWaalsContact O-SG 3.38Å
662	N	90.9	Very high	89.2	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.07	19%	0.189	C	C	.	.	I	π-helix	trans	-63.9	-44.4	-178.7	-67.8	4.5	0	0	0	111.7	T657 R658 L664 C665 I666 G745 C746 Y747	T657-N662 PolarHBondContact O-N 3.15Å; T657-N662 VanDerWaalsContact O-N 3.16Å; R658-N662 WeakPolarHBondContact O-CB 3.38Å; N662-L664 VanDerWaalsContact C-N 3.27Å; N662-L664 PolarHBondContact O-N 2.87Å; N662-C665 WeakPolarHBondContact O-CB 3.47Å; N662-C665 PolarHBondContact O-N 2.73Å; N662-I666 WeakPolarHBondContact O-CG1 3.45Å; N662-I666 PolarHBondContact O-N 2.81Å; N662-G745 PolarHBondContact ND2-O 3.08Å; N662-C746 WeakPolarHBondContact OD1-CA 3.37Å; N662-Y747 HydrophobicContact CB-CD2 3.82Å; N662-Y747 HydrophobicContact CB-CE2 3.31Å; N662-Y747 VanDerWaalsContact CG-CE2 3.45Å; N662-Y747 WeakPolarHBondContact OD1-CD2 3.5Å; N662-Y747 PolarHBondContact OD1-N 3.4Å
663	N	89.4	Confident	89.5	Confident	89 Å²	89	34.6 Å²	34.6	48%	0.476	18%	0.181	S	C	.	.	H	α-helix	trans	-59.8	-39.7	176.5	-72.6	-18.3	0	0	0	111.6	N659 L661 I666 S667	N659-N663 WeakPolarHBondContact O-CB 3.44Å; N659-N663 PolarHBondContact O-ND2 3.41Å; L661-N663 PolarHBondContact O-N 2.99Å; N663-I666 PolarHBondContact O-N 3.42Å; N663-S667 WeakPolarHBondContact O-CB 3.23Å; N663-S667 PolarHBondContact O-N 3.01Å
664	L	92.2	Very high	89.8	Confident	11 Å²	11	38.3 Å²	38.3	6%	0.058	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-41.6	175.6	-173.5	62.3	0	0	0	111.9	A557 T560 E561 I564 L592 H660 L661 N662 I666 S667 I668	A557-L664 HydrophobicContact CB-CD2 4Å; A557-L664 VanDerWaalsContact O-CD2 3.25Å; A557-L664 WeakPolarHBondContact O-CD2 3.48Å; T560-L664 HydrophobicContact CG2-CD2 4.31Å; E561-L664 HydrophobicContact CB-CD1 3.9Å; E561-L664 HydrophobicContact CB-CD2 4.36Å; E561-L664 HydrophobicContact CG-CD1 3.92Å; I564-L664 HydrophobicContact CD1-CD1 4Å; L592-L664 HydrophobicContact CD1-CB 4.2Å; L592-L664 HydrophobicContact CD1-CD2 3.74Å; L592-L664 HydrophobicContact CD1-CG 3.84Å; L592-L664 HydrophobicContact CD2-CD2 3.91Å; L592-L664 HydrophobicContact CG-CD2 4.49Å; H660-L664 WeakPolarHBondContact O-CB 3.49Å; H660-L664 PolarHBondContact O-N 2.97Å; L661-L664 PolarHBondContact O-N 3.43Å; N662-L664 VanDerWaalsContact C-N 3.27Å; N662-L664 PolarHBondContact O-N 2.87Å; L664-I666 VanDerWaalsContact C-N 3.34Å; L664-I666 PolarHBondContact O-N 2.89Å; L664-S667 WeakPolarHBondContact O-CB 3.3Å; L664-S667 PolarHBondContact O-N 2.91Å; L664-S667 VanDerWaalsContact O-N 3.17Å; L664-I668 HydrophobicContact CG-CD1 4.06Å; L664-I668 HydrophobicContact CG-CG1 4.49Å; L664-I668 VanDerWaalsContact O-CG1 3.27Å; L664-I668 WeakPolarHBondContact O-CG1 3.42Å; L664-I668 PolarHBondContact O-N 2.89Å
665	C	92	Very high	90	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-46.6	173.7	-70.7	0	0	0	0	111.8	V589 L592 L661 N662 S667 I668 L669 Y747 A753	V589-C665 HydrophobicContact CG1-CB 4.37Å; L592-C665 VanDerWaalsContact CB-SG 3.58Å; L661-C665 PolarHBondContact O-N 3.5Å; L661-C665 PolarHBondContact O-SG 2.9Å; L661-C665 VanDerWaalsContact O-SG 3.38Å; N662-C665 WeakPolarHBondContact O-CB 3.47Å; N662-C665 PolarHBondContact O-N 2.73Å; C665-S667 VanDerWaalsContact C-N 3.34Å; C665-I668 PolarHBondContact O-N 2.93Å; C665-L669 WeakPolarHBondContact O-CG 3.26Å; C665-L669 PolarHBondContact O-N 3.41Å; C665-Y747 HydrophobicContact CB-CD2 4.2Å; C665-Y747 HydrophobicContact CB-CE2 4.3Å; C665-A753 HydrophobicContact CB-CB 3.93Å
666	I	90.3	Very high	90.2	Very high	36 Å²	36	35 Å²	35	19%	0.185	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-44.1	176.2	-64.8	167.5	0	0	0	110.3	N662 N663 L664 I668 L669 N670 Y747 A757	N662-I666 WeakPolarHBondContact O-CG1 3.45Å; N662-I666 PolarHBondContact O-N 2.81Å; N663-I666 PolarHBondContact O-N 3.42Å; L664-I666 VanDerWaalsContact C-N 3.34Å; L664-I666 PolarHBondContact O-N 2.89Å; I666-I668 VanDerWaalsContact C-N 3.33Å; I666-I668 PolarHBondContact O-N 3.27Å; I666-L669 PolarHBondContact O-N 3.4Å; I666-N670 WeakPolarHBondContact O-CB 3.3Å; I666-N670 VanDerWaalsContact O-CG 3.28Å; I666-N670 PolarHBondContact O-N 2.99Å; I666-Y747 WeakPolarHBondContact CD1-OH 3.32Å; I666-Y747 HydrophobicContact CG1-CE2 4.43Å; I666-A757 HydrophobicContact CG1-CB 4.39Å; I666-A757 HydrophobicContact CG2-CB 4.3Å
667	S	91.4	Very high	90.4	Very high	63 Å²	63	35 Å²	35	44%	0.441	19%	0.186	S	C	.	.	H	α-helix	trans	-59.5	-41.8	179	-169.8	0	0	0	0	112.5	N663 L664 C665 P671	N663-S667 WeakPolarHBondContact O-CB 3.23Å; N663-S667 PolarHBondContact O-N 3.01Å; L664-S667 WeakPolarHBondContact O-CB 3.3Å; L664-S667 PolarHBondContact O-N 2.91Å; L664-S667 VanDerWaalsContact O-N 3.17Å; C665-S667 VanDerWaalsContact C-N 3.34Å; S667-P671 WeakPolarHBondContact O-CD 3.46Å
668	I	90.9	Very high	90.6	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-41.5	177.4	-67.1	164.2	0	0	0	111.3	I564 N585 L588 V589 L592 L664 C665 I666	I564-I668 HydrophobicContact CD1-CD1 4.12Å; I564-I668 HydrophobicContact CD1-CG1 3.48Å; I564-I668 VanDerWaalsContact CD1-CG1 3.48Å; I564-I668 HydrophobicContact CG1-CD1 4.27Å; I564-I668 HydrophobicContact CG1-CG1 3.87Å; N585-I668 HydrophobicContact CB-CG2 3.66Å; L588-I668 HydrophobicContact CB-CD1 4.22Å; V589-I668 HydrophobicContact CG2-CB 3.98Å; V589-I668 HydrophobicContact CG2-CD1 4.24Å; V589-I668 HydrophobicContact CG2-CG2 3.75Å; L592-I668 HydrophobicContact CD1-CD1 3.68Å; L664-I668 HydrophobicContact CG-CD1 4.06Å; L664-I668 HydrophobicContact CG-CG1 4.49Å; L664-I668 VanDerWaalsContact O-CG1 3.27Å; L664-I668 WeakPolarHBondContact O-CG1 3.42Å; L664-I668 PolarHBondContact O-N 2.89Å; C665-I668 PolarHBondContact O-N 2.93Å; I666-I668 VanDerWaalsContact C-N 3.33Å; I666-I668 PolarHBondContact O-N 3.27Å
669	L	91.1	Very high	90.7	Very high	8 Å²	8	38 Å²	38	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-78.1	-33.2	-176.6	-67.8	173.1	0	0	0	113	V589 C665 I666 F672 L673 A753 L754 A757	V589-L669 HydrophobicContact CG2-CD2 4.19Å; V589-L669 HydrophobicContact CG2-CG 4.08Å; C665-L669 WeakPolarHBondContact O-CG 3.26Å; C665-L669 PolarHBondContact O-N 3.41Å; I666-L669 PolarHBondContact O-N 3.4Å; L669-F672 PolarHBondContact O-N 3.2Å; L669-F672 VanDerWaalsContact O-N 3.17Å; L669-L673 HydrophobicContact CB-CD1 3.99Å; L669-L673 HydrophobicContact CB-CG 4.35Å; L669-L673 WeakPolarHBondContact O-CG 3.49Å; L669-L673 PolarHBondContact O-N 3.39Å; L669-A753 HydrophobicContact CD1-CB 4.33Å; L669-L754 HydrophobicContact CD1-CB 4.39Å; L669-A757 HydrophobicContact CB-CB 4.36Å; L669-A757 HydrophobicContact CD1-CB 4.3Å
670	N	90.9	Very high	91	Very high	55 Å²	55	34.4 Å²	34.4	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-53	-48.8	-170.8	-94.2	-10	0	0	0	115.1	I666 F672 L673 L674	I666-N670 WeakPolarHBondContact O-CB 3.3Å; I666-N670 VanDerWaalsContact O-CG 3.28Å; I666-N670 PolarHBondContact O-N 2.99Å; N670-F672 VanDerWaalsContact C-N 3.27Å; N670-F672 PolarHBondContact O-N 3.43Å; N670-L673 PolarHBondContact O-N 3.38Å; N670-L674 WeakPolarHBondContact O-CB 3.33Å; N670-L674 VanDerWaalsContact O-CG 3.27Å; N670-L674 WeakPolarHBondContact O-CG 3.48Å; N670-L674 PolarHBondContact O-N 2.99Å
671	P	89.5	Confident	90.9	Very high	66 Å²	66	34 Å²	34	43%	0.429	19%	0.187	S	C	.	.	H	α-helix	trans	-58.1	-40.6	-179.6	-25.6	34	0	0	0	112.9	V572 S667 A675	V572-P671 HydrophobicContact CG2-CB 4.16Å; S667-P671 WeakPolarHBondContact O-CD 3.46Å; P671-A675 PolarHBondContact O-N 3.14Å
672	F	89.3	Confident	90.8	Very high	19 Å²	19	39.4 Å²	39.4	8%	0.083	21%	0.213	C	C	.	.	H	α-helix	trans	-69.9	-46.9	178.7	179.9	-113.3	0	0	0	111.4	L574 Q582 L669 N670 L674 A675 I676 Y723 L724	L574-F672 HydrophobicContact CD2-CD2 4.46Å; L574-F672 HydrophobicContact CD2-CE2 3.5Å; L574-F672 VanDerWaalsContact CD2-CE2 3.5Å; L574-F672 HydrophobicContact CD2-CZ 3.83Å; Q582-F672 HydrophobicContact CG-CD2 4.49Å; Q582-F672 VanDerWaalsContact NE2-CE2 3.32Å; L669-F672 PolarHBondContact O-N 3.2Å; L669-F672 VanDerWaalsContact O-N 3.17Å; N670-F672 VanDerWaalsContact C-N 3.27Å; N670-F672 PolarHBondContact O-N 3.43Å; F672-L674 VanDerWaalsContact C-N 3.32Å; F672-L674 PolarHBondContact O-N 2.9Å; F672-A675 PolarHBondContact O-N 3.47Å; F672-I676 HydrophobicContact CD1-CD1 3.74Å; F672-I676 HydrophobicContact CE1-CD1 3.29Å; F672-I676 HydrophobicContact CE1-CG1 4.29Å; F672-I676 HydrophobicContact CE2-CD1 4.41Å; F672-I676 HydrophobicContact CG-CD1 4.45Å; F672-I676 HydrophobicContact CZ-CD1 3.64Å; F672-I676 HydrophobicContact CZ-CG1 4.2Å; F672-I676 PolarHBondContact O-N 3.28Å; F672-I676 VanDerWaalsContact O-N 3.09Å; F672-Y723 HydrophobicContact CE1-CG 4.45Å; F672-Y723 HydrophobicContact CE2-CG 4.28Å; F672-Y723 HydrophobicContact CZ-CD1 4.19Å; F672-Y723 AromaticContact CZ-CD2 3.84Å; F672-Y723 HydrophobicContact CZ-CD2 3.84Å; F672-Y723 AromaticContact CZ-CG 3.55Å; F672-Y723 HydrophobicContact CZ-CG 3.55Å; F672-L724 HydrophobicContact CD1-CD2 4.38Å; F672-L724 HydrophobicContact CE1-CD2 3.97Å
673	L	90.9	Very high	90.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-66.8	-32.6	179.4	-60	177.5	0	0	0	112.5	L669 N670 A675 I676 S677 L754 A757 L758 I761	L669-L673 HydrophobicContact CB-CD1 3.99Å; L669-L673 HydrophobicContact CB-CG 4.35Å; L669-L673 WeakPolarHBondContact O-CG 3.49Å; L669-L673 PolarHBondContact O-N 3.39Å; N670-L673 PolarHBondContact O-N 3.38Å; L673-A675 VanDerWaalsContact C-N 3.34Å; L673-I676 HydrophobicContact CD2-CD1 3.96Å; L673-I676 WeakPolarHBondContact O-CB 3.44Å; L673-I676 PolarHBondContact O-N 3.23Å; L673-S677 PolarHBondContact O-N 3.49Å; L673-L754 HydrophobicContact CD1-CD1 4.19Å; L673-L754 HydrophobicContact CD2-CD1 3.81Å; L673-A757 HydrophobicContact CD1-CB 3.63Å; L673-L758 HydrophobicContact CD1-CD2 4.31Å; L673-L758 HydrophobicContact CD1-CG 4.42Å; L673-L758 HydrophobicContact CD2-CD2 3.96Å; L673-I761 HydrophobicContact CB-CD1 3.15Å; L673-I761 HydrophobicContact CD1-CD1 4.1Å; L673-I761 HydrophobicContact CG-CD1 4.25Å
674	L	90.5	Very high	91.1	Very high	84 Å²	84	35.5 Å²	35.5	44%	0.44	19%	0.192	S	C	.	.	H	α-helix	trans	-63.9	-38.5	173.1	-77.4	172.9	0	0	0	112	N670 F672 S677 N678	N670-L674 WeakPolarHBondContact O-CB 3.33Å; N670-L674 VanDerWaalsContact O-CG 3.27Å; N670-L674 WeakPolarHBondContact O-CG 3.48Å; N670-L674 PolarHBondContact O-N 2.99Å; F672-L674 VanDerWaalsContact C-N 3.32Å; F672-L674 PolarHBondContact O-N 2.9Å; L674-S677 WeakPolarHBondContact O-CB 3.15Å; L674-S677 PolarHBondContact O-N 3.42Å; L674-N678 VanDerWaalsContact O-CG 3.26Å; L674-N678 PolarHBondContact O-N 2.92Å; L674-N678 PolarHBondContact O-ND2 2.76Å
675	A	89.8	Confident	91	Very high	18 Å²	18	36.1 Å²	36.1	15%	0.149	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-36.1	174.3	0	0	0	0	0	113	V572 L574 P671 F672 L673 S677 N678 K679	V572-A675 HydrophobicContact CG1-CB 3.05Å; L574-A675 HydrophobicContact CD1-CB 4.07Å; P671-A675 PolarHBondContact O-N 3.14Å; F672-A675 PolarHBondContact O-N 3.47Å; L673-A675 VanDerWaalsContact C-N 3.34Å; A675-S677 VanDerWaalsContact C-N 3.27Å; A675-S677 PolarHBondContact O-N 3.48Å; A675-N678 PolarHBondContact O-N 3.31Å; A675-K679 PolarHBondContact O-N 3.41Å
676	I	91	Very high	91	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-57.8	-46.1	169.6	-69.4	162.1	0	0	0	109.5	L574 F672 L673 K679 I680 F715 V719	L574-I676 HydrophobicContact CD1-CG1 4.41Å; L574-I676 HydrophobicContact CD2-CG1 3.91Å; F672-I676 HydrophobicContact CD1-CD1 3.74Å; F672-I676 HydrophobicContact CE1-CD1 3.29Å; F672-I676 HydrophobicContact CE1-CG1 4.29Å; F672-I676 HydrophobicContact CE2-CD1 4.41Å; F672-I676 HydrophobicContact CG-CD1 4.45Å; F672-I676 HydrophobicContact CZ-CD1 3.64Å; F672-I676 HydrophobicContact CZ-CG1 4.2Å; F672-I676 PolarHBondContact O-N 3.28Å; F672-I676 VanDerWaalsContact O-N 3.09Å; L673-I676 HydrophobicContact CD2-CD1 3.96Å; L673-I676 WeakPolarHBondContact O-CB 3.44Å; L673-I676 PolarHBondContact O-N 3.23Å; I676-K679 PolarHBondContact O-N 3.28Å; I676-I680 HydrophobicContact CG2-CD1 3.93Å; I676-I680 WeakPolarHBondContact O-CG1 3.27Å; I676-I680 PolarHBondContact O-N 3.36Å; I676-F715 HydrophobicContact CG2-CE1 3.97Å; I676-F715 HydrophobicContact CG2-CZ 4.35Å; I676-V719 HydrophobicContact CD1-CG1 3.57Å; I676-V719 HydrophobicContact CD1-CG2 4.37Å; I676-V719 HydrophobicContact CG1-CG1 4.26Å; I676-V719 HydrophobicContact CG1-CG2 4.18Å; I676-V719 HydrophobicContact CG2-CG2 4.33Å
677	S	91.9	Very high	91	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.3	-163.6	0	0	0	0	112.9	L673 L674 A675 K679 I680 D681 M764	L673-S677 PolarHBondContact O-N 3.49Å; L674-S677 WeakPolarHBondContact O-CB 3.15Å; L674-S677 PolarHBondContact O-N 3.42Å; A675-S677 VanDerWaalsContact C-N 3.27Å; A675-S677 PolarHBondContact O-N 3.48Å; S677-K679 VanDerWaalsContact C-N 3.28Å; S677-K679 PolarHBondContact O-N 3.5Å; S677-I680 WeakPolarHBondContact O-CB 3.34Å; S677-I680 PolarHBondContact O-N 3.1Å; S677-I680 VanDerWaalsContact O-N 3.17Å; S677-D681 PolarHBondContact O-N 2.91Å; S677-M764 WeakPolarHBondContact OG-CE 3.43Å
678	N	90.8	Very high	90.9	Very high	106 Å²	106	34.5 Å²	34.5	57%	0.567	19%	0.187	S	C	*	.	H	α-helix	trans	-60.6	-38.9	175.9	-69	-24.1	0	0	0	111.6	L674 A675 D681 E682	L674-N678 VanDerWaalsContact O-CG 3.26Å; L674-N678 PolarHBondContact O-N 2.92Å; L674-N678 PolarHBondContact O-ND2 2.76Å; A675-N678 PolarHBondContact O-N 3.31Å; N678-D681 PolarHBondContact O-N 3.43Å; N678-E682 PolarHBondContact O-N 3.3Å
679	K	91	Very high	90.7	Very high	73 Å²	73	39.7 Å²	39.7	32%	0.317	21%	0.214	S	C	.	.	H	α-helix	trans	-69.4	-37.4	176.5	-170	57.4	178.1	179.9	0	112.2	L574 A675 I676 S677 E682 I683 F715	L574-K679 HydrophobicContact CD1-CB 4.16Å; A675-K679 PolarHBondContact O-N 3.41Å; I676-K679 PolarHBondContact O-N 3.28Å; S677-K679 VanDerWaalsContact C-N 3.28Å; S677-K679 PolarHBondContact O-N 3.5Å; K679-E682 WeakPolarHBondContact CD-OE2 3.09Å; K679-E682 IonicContact NZ-OE1 2.87Å; K679-E682 PolarHBondContact NZ-OE1 3.48Å; K679-E682 IonicContact NZ-OE2 2.87Å; K679-E682 PolarHBondContact NZ-OE2 3.32Å; K679-E682 PolarHBondContact O-N 3.49Å; K679-I683 VanDerWaalsContact O-CG1 3.32Å; K679-I683 WeakPolarHBondContact O-CG1 3.47Å; K679-I683 PolarHBondContact O-N 3.32Å; K679-F715 HydrophobicContact CB-CE1 4.02Å; K679-F715 HydrophobicContact CB-CE2 4.33Å; K679-F715 HydrophobicContact CB-CZ 3.71Å; K679-F715 HydrophobicContact CG-CD2 4.3Å; K679-F715 HydrophobicContact CG-CE1 4.06Å; K679-F715 HydrophobicContact CG-CE2 3.77Å; K679-F715 HydrophobicContact CG-CZ 3.65Å
680	I	93	Very high	90.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-47	171.3	-69	168.9	0	0	0	109.9	I676 S677 E682 I683 L684 L712 F715 C765 L801	I676-I680 HydrophobicContact CG2-CD1 3.93Å; I676-I680 WeakPolarHBondContact O-CG1 3.27Å; I676-I680 PolarHBondContact O-N 3.36Å; S677-I680 WeakPolarHBondContact O-CB 3.34Å; S677-I680 PolarHBondContact O-N 3.1Å; S677-I680 VanDerWaalsContact O-N 3.17Å; I680-E682 VanDerWaalsContact C-N 3.32Å; I680-E682 PolarHBondContact O-N 2.94Å; I680-I683 PolarHBondContact O-N 2.86Å; I680-L684 HydrophobicContact CG2-CD1 4.07Å; I680-L684 HydrophobicContact CG2-CG 4.24Å; I680-L684 WeakPolarHBondContact O-CG 3.48Å; I680-L684 PolarHBondContact O-N 3.26Å; I680-L712 HydrophobicContact CB-CD1 4.28Å; I680-L712 HydrophobicContact CG1-CD1 3.9Å; I680-L712 HydrophobicContact CG2-CD1 3.82Å; I680-F715 HydrophobicContact CG1-CD1 4.08Å; I680-F715 HydrophobicContact CG1-CE1 3.91Å; I680-C765 HydrophobicContact CG2-CB 4.27Å; I680-L801 HydrophobicContact CD1-CD1 4.25Å
681	D	90.4	Very high	90.3	Very high	54 Å²	54	38.1 Å²	38.1	29%	0.289	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-34	179.9	-166.6	62.7	0	0	0	112.8	S677 N678 L684 S685 S768 R772	S677-D681 PolarHBondContact O-N 2.91Å; N678-D681 PolarHBondContact O-N 3.43Å; D681-L684 PolarHBondContact O-N 3.3Å; D681-S685 WeakPolarHBondContact O-CB 3.36Å; D681-S685 PolarHBondContact O-N 3.24Å; D681-S685 PolarHBondContact O-OG 3.31Å; D681-S768 PolarHBondContact OD1-OG 2.97Å; D681-R772 IonicContact OD1-CZ 2.66Å; D681-R772 IonicContact OD1-NE 3.63Å; D681-R772 PolarHBondContact OD1-NE 3.28Å; D681-R772 IonicContact OD1-NH2 3.08Å; D681-R772 PolarHBondContact OD1-NH2 3.43Å; D681-R772 IonicContact OD2-NH2 3.51Å; D681-R772 PolarHBondContact OD2-NH2 3.1Å
682	E	90.9	Very high	90	Very high	114 Å²	114	39 Å²	39	53%	0.533	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-46.2	171.2	-169.5	-163.9	144.7	0	0	111.5	N678 K679 I680 S685	N678-E682 PolarHBondContact O-N 3.3Å; K679-E682 WeakPolarHBondContact CD-OE2 3.09Å; K679-E682 IonicContact NZ-OE1 2.87Å; K679-E682 PolarHBondContact NZ-OE1 3.48Å; K679-E682 IonicContact NZ-OE2 2.87Å; K679-E682 PolarHBondContact NZ-OE2 3.32Å; K679-E682 PolarHBondContact O-N 3.49Å; I680-E682 VanDerWaalsContact C-N 3.32Å; I680-E682 PolarHBondContact O-N 2.94Å; E682-S685 WeakPolarHBondContact O-CB 3.43Å; E682-S685 PolarHBondContact O-N 2.98Å
683	I	92.8	Very high	89.6	Confident	20 Å²	20	41.8 Å²	41.8	10%	0.103	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-45.8	175.3	-65.5	165.8	0	0	0	109.9	K679 I680 S685 S686 Y708 D711 L712 F715	K679-I683 VanDerWaalsContact O-CG1 3.32Å; K679-I683 WeakPolarHBondContact O-CG1 3.47Å; K679-I683 PolarHBondContact O-N 3.32Å; I680-I683 PolarHBondContact O-N 2.86Å; I683-S685 VanDerWaalsContact C-N 3.27Å; I683-S685 PolarHBondContact O-N 3.33Å; I683-S686 WeakPolarHBondContact O-CB 3.49Å; I683-S686 PolarHBondContact O-N 2.92Å; I683-S686 VanDerWaalsContact O-N 3.12Å; I683-S686 PolarHBondContact O-OG 2.96Å; I683-Y708 VanDerWaalsContact CG2-O 3.3Å; I683-Y708 WeakPolarHBondContact CG2-O 3.35Å; I683-D711 HydrophobicContact CG2-CB 4.23Å; I683-L712 HydrophobicContact CG2-CB 4.07Å; I683-F715 HydrophobicContact CD1-CB 3.93Å; I683-F715 HydrophobicContact CD1-CD1 4.12Å; I683-F715 HydrophobicContact CD1-CG 4.05Å
684	L	93.2	Very high	89.1	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-33.9	177.9	-70.1	-176.9	0	0	0	112.3	I680 D681 S686 M687 Y708 L712 Y769 F794	I680-L684 HydrophobicContact CG2-CD1 4.07Å; I680-L684 HydrophobicContact CG2-CG 4.24Å; I680-L684 WeakPolarHBondContact O-CG 3.48Å; I680-L684 PolarHBondContact O-N 3.26Å; D681-L684 PolarHBondContact O-N 3.3Å; L684-S686 PolarHBondContact O-N 3.2Å; L684-M687 VanDerWaalsContact O-CB 3.25Å; L684-M687 WeakPolarHBondContact O-CB 3.37Å; L684-M687 WeakPolarHBondContact O-CG 3.43Å; L684-M687 PolarHBondContact O-N 2.9Å; L684-M687 VanDerWaalsContact O-SD 3.34Å; L684-Y708 HydrophobicContact CD2-CD2 4.3Å; L684-Y708 HydrophobicContact CD2-CE2 4.24Å; L684-L712 HydrophobicContact CD2-CD2 4.4Å; L684-Y769 HydrophobicContact CD2-CD2 3.86Å; L684-F794 HydrophobicContact CD1-CE2 4.44Å; L684-F794 HydrophobicContact CD2-CD2 4.42Å; L684-F794 HydrophobicContact CD2-CE2 4.01Å
685	S	90.4	Very high	88.4	Confident	24 Å²	24	42 Å²	42	17%	0.168	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-27.1	177.1	-60.8	0	0	0	0	112.8	D681 E682 I683 M687 R772 N881	D681-S685 WeakPolarHBondContact O-CB 3.36Å; D681-S685 PolarHBondContact O-N 3.24Å; D681-S685 PolarHBondContact O-OG 3.31Å; E682-S685 WeakPolarHBondContact O-CB 3.43Å; E682-S685 PolarHBondContact O-N 2.98Å; I683-S685 VanDerWaalsContact C-N 3.27Å; I683-S685 PolarHBondContact O-N 3.33Å; S685-M687 PolarHBondContact O-N 2.75Å; S685-R772 PolarHBondContact OG-NH1 3.33Å; S685-R772 PolarHBondContact OG-NH2 3.43Å; S685-N881 PolarHBondContact OG-OD1 3.39Å; S685-N881 VanDerWaalsContact OG-OD1 3.1Å
686	S	91.4	Very high	87.4	Confident	43 Å²	43	48.2 Å²	48.2	30%	0.301	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.8	176.3	75.7	0	0	0	0	113.8	I683 L684 H688 N689 E690 Y708	I683-S686 WeakPolarHBondContact O-CB 3.49Å; I683-S686 PolarHBondContact O-N 2.92Å; I683-S686 VanDerWaalsContact O-N 3.12Å; I683-S686 PolarHBondContact O-OG 2.96Å; L684-S686 PolarHBondContact O-N 3.2Å; S686-H688 VanDerWaalsContact C-N 3.26Å; S686-H688 PolarHBondContact O-N 3.09Å; S686-N689 PolarHBondContact O-N 3.38Å; S686-E690 PolarHBondContact O-N 3.04Å; S686-Y708 WeakPolarHBondContact OG-CB 3.46Å
687	M	91.2	Very high	86.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-37.2	-179	78.8	-166	-83	0	0	112.2	L684 S685 N689 E690 Y691 Y708 Y769 R772 I776	L684-M687 VanDerWaalsContact O-CB 3.25Å; L684-M687 WeakPolarHBondContact O-CB 3.37Å; L684-M687 WeakPolarHBondContact O-CG 3.43Å; L684-M687 PolarHBondContact O-N 2.9Å; L684-M687 VanDerWaalsContact O-SD 3.34Å; S685-M687 PolarHBondContact O-N 2.75Å; M687-N689 PolarHBondContact O-N 3.39Å; M687-E690 PolarHBondContact O-N 3.35Å; M687-Y691 WeakPolarHBondContact O-CB 3.44Å; M687-Y691 VanDerWaalsContact O-CD2 3.32Å; M687-Y691 WeakPolarHBondContact O-CD2 3.32Å; M687-Y691 PolarHBondContact O-N 3.35Å; M687-Y708 HydrophobicContact CB-CD1 4.12Å; M687-Y708 HydrophobicContact CB-CD2 4.1Å; M687-Y708 HydrophobicContact CB-CE1 4.16Å; M687-Y708 HydrophobicContact CB-CE2 4.13Å; M687-Y708 HydrophobicContact CB-CG 4.09Å; M687-Y769 HydrophobicContact CE-CD2 4.35Å; M687-Y769 HydrophobicContact CE-CE2 4.1Å; M687-R772 HydrophobicContact CE-CB 4.09Å; M687-R772 HydrophobicContact SD-CB 3.39Å; M687-R772 WeakPolarHBondContact SD-CB 3.22Å; M687-R772 HydrophobicContact SD-CG 4.32Å; M687-I776 HydrophobicContact CE-CD1 3.41Å; M687-I776 VanDerWaalsContact CE-CD1 3.41Å; M687-I776 HydrophobicContact CE-CG1 4.4Å; M687-I776 HydrophobicContact CG-CD1 4.33Å
688	H	88.4	Confident	84.8	Confident	23 Å²	23	53.7 Å²	53.7	11%	0.106	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-41.9	-179.2	-63.6	-65.6	0	0	0	111.9	S686 E690 Y691 D692 R772	S686-H688 VanDerWaalsContact C-N 3.26Å; S686-H688 PolarHBondContact O-N 3.09Å; H688-E690 PolarHBondContact O-N 3.46Å; H688-Y691 PolarHBondContact O-N 3.29Å; H688-D692 WeakPolarHBondContact O-CB 3.28Å; H688-D692 VanDerWaalsContact O-CG 3.26Å; H688-D692 PolarHBondContact O-N 3.1Å; H688-R772 PolarHBondContact CE1-O 2.91Å
689	N	86.2	Confident	83.4	Confident	116 Å²	116	53.3 Å²	53.3	62%	0.62	29%	0.294	S	S	*	.	H	α-helix	trans	-66.6	-38.4	178.6	-62.3	-25.5	0	0	0	112	S686 M687 S693	S686-N689 PolarHBondContact O-N 3.38Å; M687-N689 PolarHBondContact O-N 3.39Å; N689-S693 PolarHBondContact O-N 3.37Å; N689-S693 PolarHBondContact O-OG 2.91Å
690	E	87.1	Confident	81.9	Confident	27 Å²	27	56.5 Å²	56.5	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-45.5	178.5	-164.5	178.3	150.3	0	0	110.7	S686 M687 H688 S693 Y694 S706 K707 Y708	S686-E690 PolarHBondContact O-N 3.04Å; M687-E690 PolarHBondContact O-N 3.35Å; H688-E690 PolarHBondContact O-N 3.46Å; E690-S693 WeakPolarHBondContact O-CB 3.48Å; E690-S693 PolarHBondContact O-N 3.33Å; E690-Y694 HydrophobicContact CG-CE2 3.67Å; E690-Y694 WeakPolarHBondContact CG-OH 3.29Å; E690-Y694 WeakPolarHBondContact O-CD2 3.34Å; E690-Y694 PolarHBondContact O-N 2.98Å; E690-Y694 PolarHBondContact OE1-OH 3Å; E690-S706 WeakPolarHBondContact OE1-CA 3.44Å; E690-S706 WeakPolarHBondContact OE1-CB 3.29Å; E690-K707 PolarHBondContact OE1-N 3.14Å; E690-K707 PolarHBondContact OE2-N 3.33Å; E690-Y708 WeakPolarHBondContact OE2-CD1 3.46Å; E690-Y708 PolarHBondContact OE2-N 3.21Å
691	Y	86.5	Confident	80.3	Confident	3 Å²	3	62.7 Å²	62.7	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-70.8	-31.9	178.4	-87.2	-88.8	0	0	0	114.1	M687 H688 S693 Y694 Q695 Y708 I776 V783 K786 L787 D790	M687-Y691 WeakPolarHBondContact O-CB 3.44Å; M687-Y691 VanDerWaalsContact O-CD2 3.32Å; M687-Y691 WeakPolarHBondContact O-CD2 3.32Å; M687-Y691 PolarHBondContact O-N 3.35Å; H688-Y691 PolarHBondContact O-N 3.29Å; Y691-S693 PolarHBondContact O-N 3.01Å; Y691-Y694 HydrophobicContact CD1-CD2 4.03Å; Y691-Y694 HydrophobicContact CE1-CD2 4.37Å; Y691-Y694 HydrophobicContact CG-CD2 4.15Å; Y691-Y694 WeakPolarHBondContact O-CB 3.28Å; Y691-Y694 PolarHBondContact O-N 3.44Å; Y691-Q695 WeakPolarHBondContact O-CG 3.45Å; Y691-Q695 PolarHBondContact O-N 3.07Å; Y691-Y708 AromaticContact CE2-CE1 3.91Å; Y691-Y708 HydrophobicContact CE2-CE1 3.91Å; Y691-I776 HydrophobicContact CD1-CD1 4.19Å; Y691-I776 HydrophobicContact CD1-CG2 3.71Å; Y691-I776 HydrophobicContact CD2-CD1 3.51Å; Y691-I776 HydrophobicContact CE1-CD1 4.48Å; Y691-I776 HydrophobicContact CE1-CG2 4.48Å; Y691-I776 HydrophobicContact CE2-CD1 3.86Å; Y691-I776 HydrophobicContact CG-CD1 3.69Å; Y691-I776 HydrophobicContact CG-CG1 4.32Å; Y691-I776 HydrophobicContact CG-CG2 3.86Å; Y691-V783 HydrophobicContact CD1-CG1 3.94Å; Y691-V783 HydrophobicContact CE1-CG1 4.19Å; Y691-K786 HydrophobicContact CE1-CG 4.27Å; Y691-L787 HydrophobicContact CE1-CB 4.19Å; Y691-L787 HydrophobicContact CE1-CD1 4.3Å; Y691-L787 WeakPolarHBondContact OH-CA 3.45Å; Y691-D790 PolarHBondContact OH-OD2 2.93Å
692	D	83.2	Confident	79	Confident	86 Å²	86	60.6 Å²	60.6	46%	0.46	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-35.1	171.6	-77.5	-15.6	0	0	0	111.5	H688 Y694 Q695	H688-D692 WeakPolarHBondContact O-CB 3.28Å; H688-D692 VanDerWaalsContact O-CG 3.26Å; H688-D692 PolarHBondContact O-N 3.1Å; D692-Y694 VanDerWaalsContact C-N 3.35Å; D692-Q695 PolarHBondContact O-N 3.25Å; D692-Q695 PolarHBondContact OD1-NE2 3.48Å; D692-Q695 VanDerWaalsContact OD1-NE2 3.09Å
693	S	81.6	Confident	77.8	Confident	77 Å²	77	62.4 Å²	62.4	54%	0.538	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-37.4	174	-54.9	0	0	0	0	111.7	N689 E690 Y691 Q695 N696 V697	N689-S693 PolarHBondContact O-N 3.37Å; N689-S693 PolarHBondContact O-OG 2.91Å; E690-S693 WeakPolarHBondContact O-CB 3.48Å; E690-S693 PolarHBondContact O-N 3.33Å; Y691-S693 PolarHBondContact O-N 3.01Å; S693-Q695 PolarHBondContact O-N 3.21Å; S693-N696 PolarHBondContact O-N 3.31Å; S693-V697 WeakPolarHBondContact O-CG2 3.47Å
694	Y	79.5	Confident	76.8	Confident	37 Å²	37	64.7 Å²	64.7	15%	0.145	36%	0.363	C	S	.	.	H	α-helix	trans	-67	-19.6	177.5	-65.8	-33.4	0	0	0	114.5	E690 Y691 D692 N696 V697 L702	E690-Y694 HydrophobicContact CG-CE2 3.67Å; E690-Y694 WeakPolarHBondContact CG-OH 3.29Å; E690-Y694 WeakPolarHBondContact O-CD2 3.34Å; E690-Y694 PolarHBondContact O-N 2.98Å; E690-Y694 PolarHBondContact OE1-OH 3Å; Y691-Y694 HydrophobicContact CD1-CD2 4.03Å; Y691-Y694 HydrophobicContact CE1-CD2 4.37Å; Y691-Y694 HydrophobicContact CG-CD2 4.15Å; Y691-Y694 WeakPolarHBondContact O-CB 3.28Å; Y691-Y694 PolarHBondContact O-N 3.44Å; D692-Y694 VanDerWaalsContact C-N 3.35Å; Y694-N696 PolarHBondContact O-N 3.34Å; Y694-N696 VanDerWaalsContact O-N 3.13Å; Y694-V697 PolarHBondContact O-N 3.1Å; Y694-L702 HydrophobicContact CD1-CD2 4.2Å; Y694-L702 HydrophobicContact CD2-CD2 4.26Å; Y694-L702 HydrophobicContact CG-CD2 3.91Å
695	Q	75.4	Confident	76.1	Confident	51 Å²	51	70.6 Å²	70.6	24%	0.238	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-25.4	179.5	-62.7	-166.1	33.1	0	0	112.9	Y691 D692 S693 K780	Y691-Q695 WeakPolarHBondContact O-CG 3.45Å; Y691-Q695 PolarHBondContact O-N 3.07Å; D692-Q695 PolarHBondContact O-N 3.25Å; D692-Q695 PolarHBondContact OD1-NE2 3.48Å; D692-Q695 VanDerWaalsContact OD1-NE2 3.09Å; S693-Q695 PolarHBondContact O-N 3.21Å; Q695-K780 PolarHBondContact O-NZ 3.35Å
696	N	69.5	Low	76	Confident	149 Å²	149	69.5 Å²	69.5	80%	0.797	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	3.9	-176.2	-64.4	-36.8	0	0	0	114.2	S693 Y694	S693-N696 PolarHBondContact O-N 3.31Å; Y694-N696 PolarHBondContact O-N 3.34Å; Y694-N696 VanDerWaalsContact O-N 3.13Å
697	V	68.6	Low	75.9	Confident	45 Å²	45	73.9 Å²	73.9	27%	0.273	40%	0.395	S	S	.	.	S	Bend	trans	-104.7	144.4	-168.7	176.2	0	0	0	0	111.7	S693 Y694 E701	S693-V697 WeakPolarHBondContact O-CG2 3.47Å; Y694-V697 PolarHBondContact O-N 3.1Å; V697-E701 HydrophobicContact CG1-CB 3.56Å; V697-E701 HydrophobicContact CG1-CG 4.37Å; V697-E701 WeakPolarHBondContact CG1-OE2 3.07Å
698	S	61	Low	76	Confident	78 Å²	78	74 Å²	74	55%	0.545	40%	0.395	S	S	.	.			trans	-74.3	151.1	179.2	74.3	0	0	0	0	112.3	N700 E701	S698-N700 PolarHBondContact O-N 3.34Å; S698-E701 PolarHBondContact O-N 3.02Å; S698-E701 VanDerWaalsContact O-N 3.15Å
699	V	60.5	Low	76.1	Confident	97 Å²	97	73.2 Å²	73.2	59%	0.588	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-52.5	-30	-168.4	-177.3	0	0	0	0	114.3	E701	V699-E701 PolarHBondContact O-N 3.39Å
700	N	58.3	Low	76.4	Confident	141 Å²	141	72.5 Å²	72.5	75%	0.754	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-76.3	-19.5	-174.4	-69.4	-15.6	0	0	0	114.5	S698	S698-N700 PolarHBondContact O-N 3.34Å
701	E	59.8	Low	76.7	Confident	130 Å²	130	74.6 Å²	74.6	61%	0.607	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-88.2	-7.2	-179.5	-70.6	179.1	173	0	0	113.1	V697 S698 V699 N703	V697-E701 HydrophobicContact CG1-CB 3.56Å; V697-E701 HydrophobicContact CG1-CG 4.37Å; V697-E701 WeakPolarHBondContact CG1-OE2 3.07Å; S698-E701 PolarHBondContact O-N 3.02Å; S698-E701 VanDerWaalsContact O-N 3.15Å; V699-E701 PolarHBondContact O-N 3.39Å; E701-N703 VanDerWaalsContact C-N 3.34Å; E701-N703 PolarHBondContact O-N 2.82Å
702	L	63.8	Low	77	Confident	10 Å²	10	74.4 Å²	74.4	5%	0.052	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-82	-5.2	-176.8	-79.7	141.4	0	0	0	114.8	Y694 S704 K786	Y694-L702 HydrophobicContact CD1-CD2 4.2Å; Y694-L702 HydrophobicContact CD2-CD2 4.26Å; Y694-L702 HydrophobicContact CG-CD2 3.91Å; L702-S704 VanDerWaalsContact C-N 3.31Å; L702-S704 PolarHBondContact O-N 3.49Å; L702-K786 HydrophobicContact CD2-CB 4.15Å; L702-K786 HydrophobicContact CD2-CG 3.94Å; L702-K786 WeakPolarHBondContact O-CD 3.46Å; L702-K786 WeakPolarHBondContact O-CE 3.5Å
703	N	64.6	Low	77.5	Confident	153 Å²	153	73.8 Å²	73.8	82%	0.818	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-78	-7.4	-176.8	-82.7	-14.5	0	0	0	114.6	E701	E701-N703 VanDerWaalsContact C-N 3.34Å; E701-N703 PolarHBondContact O-N 2.82Å
704	S	72.3	Confident	78	Confident	68 Å²	68	74.1 Å²	74.1	48%	0.476	39%	0.386	S	S	.	.	S	Bend	trans	-74.5	148.3	174.8	54.1	0	0	0	0	112	L702 S706 K786	L702-S704 VanDerWaalsContact C-N 3.31Å; L702-S704 PolarHBondContact O-N 3.49Å; S704-S706 PolarHBondContact O-N 2.99Å; S704-K786 PolarHBondContact O-NZ 3.39Å
705	K	78.9	Confident	78.6	Confident	124 Å²	124	73.1 Å²	73.1	54%	0.539	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-58.4	135.3	173.2	-69.1	-168.5	175	-134.9	0	110.2	E793	K705-E793 IonicContact NZ-OE1 3.86Å; K705-E793 IonicContact NZ-OE2 2.75Å; K705-E793 PolarHBondContact NZ-OE2 3.32Å
706	S	87.9	Confident	79.5	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.007	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-66.9	136.9	-180	-51.1	0	0	0	0	110.3	E690 S704 L709 Q710 K786 D790	E690-S706 WeakPolarHBondContact OE1-CA 3.44Å; E690-S706 WeakPolarHBondContact OE1-CB 3.29Å; S704-S706 PolarHBondContact O-N 2.99Å; S706-L709 PolarHBondContact O-N 3.33Å; S706-Q710 PolarHBondContact O-N 3.16Å; S706-Q710 VanDerWaalsContact O-N 3.12Å; S706-K786 VanDerWaalsContact OG-CE 3.24Å; S706-K786 WeakPolarHBondContact OG-CE 3.23Å; S706-K786 PolarHBondContact OG-NZ 2.92Å; S706-K786 VanDerWaalsContact OG-NZ 3.16Å; S706-D790 WeakPolarHBondContact CB-OD2 3.35Å; S706-D790 PolarHBondContact OG-OD1 3.26Å; S706-D790 PolarHBondContact OG-OD2 2.87Å
707	K	89.1	Confident	80.5	Confident	136 Å²	136	65 Å²	65	59%	0.591	35%	0.345	S	S	*	.	H	α-helix	trans	-66.1	-43.5	-172.1	-174.6	179.9	176.5	-177.2	0	111.3	E690 L709 Q710 D711	E690-K707 PolarHBondContact OE1-N 3.14Å; E690-K707 PolarHBondContact OE2-N 3.33Å; K707-L709 PolarHBondContact O-N 3.31Å; K707-Q710 WeakPolarHBondContact O-CB 2.89Å; K707-Q710 PolarHBondContact O-N 3.08Å; K707-Q710 VanDerWaalsContact O-N 3.08Å; K707-D711 PolarHBondContact O-N 2.72Å
708	Y	93	Very high	81.5	Confident	1 Å²	1	68.2 Å²	68.2	0%	0.004	35%	0.352	C	S	.	.	H	α-helix	trans	-58.4	-34.2	176.9	81.9	-85	0	0	0	112.7	I683 L684 S686 M687 E690 Y691 L712 Y769 D790	I683-Y708 VanDerWaalsContact CG2-O 3.3Å; I683-Y708 WeakPolarHBondContact CG2-O 3.35Å; L684-Y708 HydrophobicContact CD2-CD2 4.3Å; L684-Y708 HydrophobicContact CD2-CE2 4.24Å; S686-Y708 WeakPolarHBondContact OG-CB 3.46Å; M687-Y708 HydrophobicContact CB-CD1 4.12Å; M687-Y708 HydrophobicContact CB-CD2 4.1Å; M687-Y708 HydrophobicContact CB-CE1 4.16Å; M687-Y708 HydrophobicContact CB-CE2 4.13Å; M687-Y708 HydrophobicContact CB-CG 4.09Å; E690-Y708 WeakPolarHBondContact OE2-CD1 3.46Å; E690-Y708 PolarHBondContact OE2-N 3.21Å; Y691-Y708 AromaticContact CE2-CE1 3.91Å; Y691-Y708 HydrophobicContact CE2-CE1 3.91Å; Y708-L712 WeakPolarHBondContact O-CB 3.43Å; Y708-L712 PolarHBondContact O-N 2.5Å; Y708-Y769 HydrophobicContact CE2-CE2 4.13Å; Y708-D790 PolarHBondContact OH-OD2 3.22Å
709	L	92.3	Very high	82.8	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	33%	0.326	C	S	.	.	H	α-helix	trans	-73.1	-37.3	176.3	-70.8	174.6	0	0	0	112.2	S706 K707 D711 L712 Q713 D790 E793 F794	S706-L709 PolarHBondContact O-N 3.33Å; K707-L709 PolarHBondContact O-N 3.31Å; L709-D711 VanDerWaalsContact C-N 3.34Å; L709-L712 PolarHBondContact O-N 3.5Å; L709-Q713 WeakPolarHBondContact O-CB 3.39Å; L709-Q713 PolarHBondContact O-N 3.15Å; L709-D790 HydrophobicContact CD1-CB 3.67Å; L709-E793 HydrophobicContact CD1-CB 3.79Å; L709-F794 HydrophobicContact CD2-CB 3.88Å; L709-F794 HydrophobicContact CD2-CD2 4.18Å
710	Q	92.3	Very high	84.2	Confident	102 Å²	102	62.3 Å²	62.3	48%	0.477	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-42.4	173.4	-170.3	174.2	21.7	0	0	110.9	S706 K707 Q713 N714	S706-Q710 PolarHBondContact O-N 3.16Å; S706-Q710 VanDerWaalsContact O-N 3.12Å; K707-Q710 WeakPolarHBondContact O-CB 2.89Å; K707-Q710 PolarHBondContact O-N 3.08Å; K707-Q710 VanDerWaalsContact O-N 3.08Å; Q710-Q713 PolarHBondContact O-N 3.29Å; Q710-N714 WeakPolarHBondContact O-CB 3.22Å; Q710-N714 PolarHBondContact O-N 3.44Å; Q710-N714 PolarHBondContact O-ND2 3Å; Q710-N714 VanDerWaalsContact O-ND2 3.13Å
711	D	92.1	Very high	85.5	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.6	-70.6	-21	0	0	0	111.3	I683 K707 L709 F715	I683-D711 HydrophobicContact CG2-CB 4.23Å; K707-D711 PolarHBondContact O-N 2.72Å; L709-D711 VanDerWaalsContact C-N 3.34Å; D711-F715 VanDerWaalsContact O-CB 3.3Å; D711-F715 WeakPolarHBondContact O-CB 3.24Å; D711-F715 PolarHBondContact O-N 3.18Å
712	L	93.9	Very high	86.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-48.9	174.9	-177.4	63.5	0	0	0	111.9	I680 I683 L684 Y708 L709 N714 F715 T716 F794 A797	I680-L712 HydrophobicContact CB-CD1 4.28Å; I680-L712 HydrophobicContact CG1-CD1 3.9Å; I680-L712 HydrophobicContact CG2-CD1 3.82Å; I683-L712 HydrophobicContact CG2-CB 4.07Å; L684-L712 HydrophobicContact CD2-CD2 4.4Å; Y708-L712 WeakPolarHBondContact O-CB 3.43Å; Y708-L712 PolarHBondContact O-N 2.5Å; L709-L712 PolarHBondContact O-N 3.5Å; L712-N714 VanDerWaalsContact C-N 3.33Å; L712-N714 PolarHBondContact O-N 3.45Å; L712-F715 PolarHBondContact O-N 3.15Å; L712-T716 HydrophobicContact CD1-CG2 4.17Å; L712-T716 HydrophobicContact CG-CG2 4.48Å; L712-T716 WeakPolarHBondContact O-CG2 3.34Å; L712-T716 PolarHBondContact O-N 3.26Å; L712-T716 PolarHBondContact O-OG1 2.95Å; L712-F794 HydrophobicContact CD2-CD2 3.59Å; L712-F794 HydrophobicContact CD2-CE2 3.63Å; L712-A797 HydrophobicContact CB-CB 4.44Å; L712-A797 HydrophobicContact CD2-CB 3.87Å; L712-A797 HydrophobicContact CG-CB 3.99Å
713	Q	93.4	Very high	87.7	Confident	73 Å²	73	59.8 Å²	59.8	34%	0.341	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-41.4	179.9	-174.5	178	18.4	0	0	111.7	L709 Q710 F715 T716 A717 A797	L709-Q713 WeakPolarHBondContact O-CB 3.39Å; L709-Q713 PolarHBondContact O-N 3.15Å; Q710-Q713 PolarHBondContact O-N 3.29Å; Q713-F715 VanDerWaalsContact C-N 3.34Å; Q713-T716 PolarHBondContact O-OG1 2.99Å; Q713-A717 VanDerWaalsContact O-CB 3.27Å; Q713-A717 WeakPolarHBondContact O-CB 3.4Å; Q713-A717 PolarHBondContact O-N 2.94Å; Q713-A717 VanDerWaalsContact O-N 3.12Å; Q713-A797 HydrophobicContact CB-CB 4.09Å
714	N	92	Very high	88.6	Confident	83 Å²	83	52.6 Å²	52.6	44%	0.444	25%	0.252	S	S	.	.	H	α-helix	trans	-65.2	-39.6	175.7	-71.9	-26.5	0	0	0	111.5	Q710 L712 R718	Q710-N714 WeakPolarHBondContact O-CB 3.22Å; Q710-N714 PolarHBondContact O-N 3.44Å; Q710-N714 PolarHBondContact O-ND2 3Å; Q710-N714 VanDerWaalsContact O-ND2 3.13Å; L712-N714 VanDerWaalsContact C-N 3.33Å; L712-N714 PolarHBondContact O-N 3.45Å; N714-R718 WeakPolarHBondContact O-CB 3.49Å; N714-R718 PolarHBondContact O-N 3.36Å
715	F	93	Very high	89.1	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-48.5	178.9	177.5	-109.4	0	0	0	112.3	L574 I676 K679 I680 I683 D711 L712 Q713 A717 R718 V719	L574-F715 HydrophobicContact CD1-CZ 4.16Å; I676-F715 HydrophobicContact CG2-CE1 3.97Å; I676-F715 HydrophobicContact CG2-CZ 4.35Å; K679-F715 HydrophobicContact CB-CE1 4.02Å; K679-F715 HydrophobicContact CB-CE2 4.33Å; K679-F715 HydrophobicContact CB-CZ 3.71Å; K679-F715 HydrophobicContact CG-CD2 4.3Å; K679-F715 HydrophobicContact CG-CE1 4.06Å; K679-F715 HydrophobicContact CG-CE2 3.77Å; K679-F715 HydrophobicContact CG-CZ 3.65Å; I680-F715 HydrophobicContact CG1-CD1 4.08Å; I680-F715 HydrophobicContact CG1-CE1 3.91Å; I683-F715 HydrophobicContact CD1-CB 3.93Å; I683-F715 HydrophobicContact CD1-CD1 4.12Å; I683-F715 HydrophobicContact CD1-CG 4.05Å; D711-F715 VanDerWaalsContact O-CB 3.3Å; D711-F715 WeakPolarHBondContact O-CB 3.24Å; D711-F715 PolarHBondContact O-N 3.18Å; L712-F715 PolarHBondContact O-N 3.15Å; Q713-F715 VanDerWaalsContact C-N 3.34Å; F715-A717 PolarHBondContact O-N 3.02Å; F715-R718 WeakPolarHBondContact O-CB 3.42Å; F715-R718 PolarHBondContact O-N 2.97Å; F715-V719 HydrophobicContact CD1-CG2 4.39Å; F715-V719 HydrophobicContact CD2-CG2 4.4Å; F715-V719 HydrophobicContact CE1-CG2 3.95Å; F715-V719 HydrophobicContact CE2-CG2 3.96Å; F715-V719 HydrophobicContact CZ-CG2 3.7Å; F715-V719 WeakPolarHBondContact O-CG2 3.4Å; F715-V719 PolarHBondContact O-N 3.44Å
716	T	92.3	Very high	89.4	Confident	1 Å²	1	52 Å²	52	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-38.7	179.8	56.4	0	0	0	0	112.1	L712 Q713 R718 V719 R720 A797 L801	L712-T716 HydrophobicContact CD1-CG2 4.17Å; L712-T716 HydrophobicContact CG-CG2 4.48Å; L712-T716 WeakPolarHBondContact O-CG2 3.34Å; L712-T716 PolarHBondContact O-N 3.26Å; L712-T716 PolarHBondContact O-OG1 2.95Å; Q713-T716 PolarHBondContact O-OG1 2.99Å; T716-R718 VanDerWaalsContact C-N 3.35Å; T716-V719 PolarHBondContact O-N 2.72Å; T716-R720 PolarHBondContact O-N 2.89Å; T716-A797 WeakPolarHBondContact CB-O 3.29Å; T716-A797 WeakPolarHBondContact CG2-O 3.39Å; T716-A797 PolarHBondContact OG1-O 3.35Å; T716-L801 HydrophobicContact CG2-CD1 3.99Å; T716-L801 HydrophobicContact CG2-CG 4.14Å
717	A	90.6	Very high	89.3	Confident	29 Å²	29	52.2 Å²	52.2	24%	0.24	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-43.2	172.7	0	0	0	0	0	111.6	Q713 F715 R720 Q721	Q713-A717 VanDerWaalsContact O-CB 3.27Å; Q713-A717 WeakPolarHBondContact O-CB 3.4Å; Q713-A717 PolarHBondContact O-N 2.94Å; Q713-A717 VanDerWaalsContact O-N 3.12Å; F715-A717 PolarHBondContact O-N 3.02Å; A717-R720 PolarHBondContact O-N 3.11Å; A717-Q721 WeakPolarHBondContact O-CB 3.2Å; A717-Q721 WeakPolarHBondContact O-CG 3.22Å; A717-Q721 PolarHBondContact O-N 3.03Å
718	R	89.5	Confident	89.1	Confident	111 Å²	111	47.6 Å²	47.6	42%	0.419	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-43.4	175.3	-171.9	-176	-57	175.9	3.4	111.7	N714 F715 T716 R720 Q721 Q722	N714-R718 WeakPolarHBondContact O-CB 3.49Å; N714-R718 PolarHBondContact O-N 3.36Å; F715-R718 WeakPolarHBondContact O-CB 3.42Å; F715-R718 PolarHBondContact O-N 2.97Å; T716-R718 VanDerWaalsContact C-N 3.35Å; R718-R720 VanDerWaalsContact C-N 3.3Å; R718-R720 PolarHBondContact O-N 3.32Å; R718-Q721 PolarHBondContact O-N 2.67Å; R718-Q722 VanDerWaalsContact CD-OE1 3.29Å; R718-Q722 HydrophobicContact CG-CB 4.36Å; R718-Q722 VanDerWaalsContact CG-CD 3.5Å; R718-Q722 HydrophobicContact CG-CG 4Å; R718-Q722 WeakPolarHBondContact O-CB 3.47Å; R718-Q722 PolarHBondContact O-N 3.44Å
719	V	89.7	Confident	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.257	C	S	.	.	I	π-helix	trans	-57.2	-46.1	178.8	167.6	0	0	0	0	111.4	I676 F715 T716 Y723 L724 L801	I676-V719 HydrophobicContact CD1-CG1 3.57Å; I676-V719 HydrophobicContact CD1-CG2 4.37Å; I676-V719 HydrophobicContact CG1-CG1 4.26Å; I676-V719 HydrophobicContact CG1-CG2 4.18Å; I676-V719 HydrophobicContact CG2-CG2 4.33Å; F715-V719 HydrophobicContact CD1-CG2 4.39Å; F715-V719 HydrophobicContact CD2-CG2 4.4Å; F715-V719 HydrophobicContact CE1-CG2 3.95Å; F715-V719 HydrophobicContact CE2-CG2 3.96Å; F715-V719 HydrophobicContact CZ-CG2 3.7Å; F715-V719 WeakPolarHBondContact O-CG2 3.4Å; F715-V719 PolarHBondContact O-N 3.44Å; T716-V719 PolarHBondContact O-N 2.72Å; V719-Y723 HydrophobicContact CB-CD2 4.4Å; V719-Y723 HydrophobicContact CG2-CD2 4.18Å; V719-Y723 PolarHBondContact O-N 3.24Å; V719-L724 HydrophobicContact CG1-CD1 3.78Å; V719-L724 HydrophobicContact CG1-CG 4.22Å; V719-L724 PolarHBondContact O-N 3.36Å; V719-L724 VanDerWaalsContact O-N 3.16Å; V719-L801 HydrophobicContact CB-CD2 4.2Å; V719-L801 HydrophobicContact CG1-CD2 3.85Å
720	R	88.9	Confident	87.6	Confident	52 Å²	52	53.3 Å²	53.3	20%	0.196	26%	0.258	C	S	.	.	I	π-helix	trans	-65	-43.8	178.3	-170.6	66.5	176.7	175.1	12.2	112.5	T716 A717 R718 E751 P800 S803	T716-R720 PolarHBondContact O-N 2.89Å; A717-R720 PolarHBondContact O-N 3.11Å; R718-R720 VanDerWaalsContact C-N 3.3Å; R718-R720 PolarHBondContact O-N 3.32Å; R720-E751 IonicContact CZ-OE1 3.29Å; R720-E751 IonicContact CZ-OE2 2.75Å; R720-E751 VanDerWaalsContact CZ-OE2 3.29Å; R720-E751 VanDerWaalsContact NH1-CD 3.35Å; R720-E751 IonicContact NH1-OE1 2.79Å; R720-E751 PolarHBondContact NH1-OE1 3.16Å; R720-E751 IonicContact NH1-OE2 3.53Å; R720-E751 PolarHBondContact NH1-OE2 3.27Å; R720-E751 VanDerWaalsContact NH2-CD 3.27Å; R720-E751 IonicContact NH2-OE1 2.9Å; R720-E751 PolarHBondContact NH2-OE1 3.48Å; R720-E751 IonicContact NH2-OE2 2.96Å; R720-E751 PolarHBondContact NH2-OE2 3.16Å; R720-P800 WeakPolarHBondContact CB-O 3.05Å; R720-P800 VanDerWaalsContact CD-O 3.25Å; R720-P800 WeakPolarHBondContact CD-O 3.48Å; R720-P800 VanDerWaalsContact CG-O 3.3Å; R720-P800 WeakPolarHBondContact CG-O 3.2Å; R720-S803 PolarHBondContact NH2-OG 2.99Å; R720-S803 VanDerWaalsContact NH2-OG 3.1Å
721	Q	86.9	Confident	86.4	Confident	143 Å²	143	52.3 Å²	52.3	67%	0.668	26%	0.26	S	S	*	.	I	π-helix	trans	-78.5	-36.5	-174.4	-70.9	176.7	0.1	0	0	113.7	A717 R718 F725	A717-Q721 WeakPolarHBondContact O-CB 3.2Å; A717-Q721 WeakPolarHBondContact O-CG 3.22Å; A717-Q721 PolarHBondContact O-N 3.03Å; R718-Q721 PolarHBondContact O-N 2.67Å; Q721-F725 WeakPolarHBondContact O-CD1 3.46Å
722	Q	84.5	Confident	84.9	Confident	82 Å²	82	59.1 Å²	59.1	38%	0.383	29%	0.286	S	S	.	.	I	π-helix	trans	-100	-38.5	-172.9	-66.3	-172.7	-21.1	0	0	112.5	Q578 R718 F725	Q578-Q722 WeakPolarHBondContact CG-O 3.44Å; Q578-Q722 PolarHBondContact NE2-O 3.3Å; R718-Q722 VanDerWaalsContact CD-OE1 3.29Å; R718-Q722 HydrophobicContact CG-CB 4.36Å; R718-Q722 VanDerWaalsContact CG-CD 3.5Å; R718-Q722 HydrophobicContact CG-CG 4Å; R718-Q722 WeakPolarHBondContact O-CB 3.47Å; R718-Q722 PolarHBondContact O-N 3.44Å; Q722-F725 WeakPolarHBondContact O-CD1 3.27Å; Q722-F725 WeakPolarHBondContact O-CE1 3.36Å
723	Y	83.8	Confident	83	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.008	32%	0.32	C	S	.	.	I	π-helix	trans	-105.9	-27.7	-171.5	-55	-60.9	0	0	0	115.2	L574 D576 Q578 I586 F672 V719	L574-Y723 HydrophobicContact CD2-CD2 4.12Å; L574-Y723 HydrophobicContact CD2-CE2 3.9Å; L574-Y723 PolarHBondContact O-OH 3.16Å; D576-Y723 WeakPolarHBondContact O-CE1 3.39Å; D576-Y723 VanDerWaalsContact O-CZ 3.29Å; D576-Y723 PolarHBondContact O-OH 2.88Å; Q578-Y723 HydrophobicContact CG-CD1 4.03Å; Q578-Y723 VanDerWaalsContact NE2-C 3.35Å; Q578-Y723 PolarHBondContact NE2-O 3.38Å; Q578-Y723 VanDerWaalsContact NE2-O 3.11Å; I586-Y723 WeakPolarHBondContact CD1-O 3.2Å; F672-Y723 HydrophobicContact CE1-CG 4.45Å; F672-Y723 HydrophobicContact CE2-CG 4.28Å; F672-Y723 HydrophobicContact CZ-CD1 4.19Å; F672-Y723 AromaticContact CZ-CD2 3.84Å; F672-Y723 HydrophobicContact CZ-CD2 3.84Å; F672-Y723 AromaticContact CZ-CG 3.55Å; F672-Y723 HydrophobicContact CZ-CG 3.55Å; V719-Y723 HydrophobicContact CB-CD2 4.4Å; V719-Y723 HydrophobicContact CG2-CD2 4.18Å; V719-Y723 PolarHBondContact O-N 3.24Å
724	L	85.1	Confident	81	Confident	3 Å²	3	65 Å²	65	2%	0.016	31%	0.313	C	S	.	.	S	Bend	trans	-109.6	4.2	-173.4	-61.2	176	0	0	0	113.6	F672 V719 D726 L727 L754	F672-L724 HydrophobicContact CD1-CD2 4.38Å; F672-L724 HydrophobicContact CE1-CD2 3.97Å; V719-L724 HydrophobicContact CG1-CD1 3.78Å; V719-L724 HydrophobicContact CG1-CG 4.22Å; V719-L724 PolarHBondContact O-N 3.36Å; V719-L724 VanDerWaalsContact O-N 3.16Å; L724-D726 VanDerWaalsContact C-N 3.31Å; L724-D726 PolarHBondContact O-N 3.24Å; L724-L727 HydrophobicContact CB-CD1 4.25Å; L724-L727 HydrophobicContact CD2-CD1 3.95Å; L724-L727 PolarHBondContact O-N 3.46Å; L724-L754 HydrophobicContact CD1-CD1 3.98Å; L724-L754 HydrophobicContact CD1-CD2 3.88Å; L724-L754 HydrophobicContact CD2-CD1 4.08Å
725	F	82.9	Confident	78.9	Confident	113 Å²	113	67.6 Å²	67.6	50%	0.496	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.4	-172.9	79.4	-92.6	0	0	0	113.8	Q578 Q721 Q722 L727	Q578-F725 VanDerWaalsContact NE2-CD1 3.29Å; Q721-F725 WeakPolarHBondContact O-CD1 3.46Å; Q722-F725 WeakPolarHBondContact O-CD1 3.27Å; Q722-F725 WeakPolarHBondContact O-CE1 3.36Å; F725-L727 VanDerWaalsContact C-N 3.28Å; F725-L727 PolarHBondContact O-N 3.49Å
726	D	84	Confident	76.5	Confident	66 Å²	66	73 Å²	73	35%	0.353	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-4.6	-178.4	-77.5	-42.6	0	0	0	113.7	Q578 I586 N590 L724 S728	Q578-D726 PolarHBondContact OE1-OD2 2.98Å; I586-D726 HydrophobicContact CG2-CB 3.7Å; N590-D726 PolarHBondContact ND2-O 2.9Å; L724-D726 VanDerWaalsContact C-N 3.31Å; L724-D726 PolarHBondContact O-N 3.24Å; D726-S728 PolarHBondContact O-N 3.38Å
727	L	86.5	Confident	74.2	Confident	6 Å²	6	76.4 Å²	76.4	3%	0.031	38%	0.379	C	S	.	.	S	Bend	trans	-66.6	133.6	174.4	-75.6	166.6	0	0	0	110.3	I586 V589 L724 F725 Q729 L754	I586-L727 HydrophobicContact CG2-CD2 3.94Å; I586-L727 HydrophobicContact CG2-CG 4.03Å; V589-L727 HydrophobicContact CB-CD2 4.42Å; V589-L727 HydrophobicContact CG1-CD2 4.01Å; L724-L727 HydrophobicContact CB-CD1 4.25Å; L724-L727 HydrophobicContact CD2-CD1 3.95Å; L724-L727 PolarHBondContact O-N 3.46Å; F725-L727 VanDerWaalsContact C-N 3.28Å; F725-L727 PolarHBondContact O-N 3.49Å; L727-Q729 PolarHBondContact O-N 3.29Å; L727-L754 HydrophobicContact CD1-CB 3.91Å; L727-L754 HydrophobicContact CD1-CD1 4.34Å; L727-L754 HydrophobicContact CD1-CD2 3.74Å; L727-L754 HydrophobicContact CD1-CG 4.2Å
728	S	84.4	Confident	71.9	Confident	38 Å²	38	77.7 Å²	77.7	27%	0.266	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-59.3	129.8	178.3	50.7	0	0	0	0	110.5	N590 D726 C749 G750 E751	N590-S728 VanDerWaalsContact OD1-CB 3.24Å; N590-S728 WeakPolarHBondContact OD1-CB 3.47Å; N590-S728 PolarHBondContact OD1-N 2.82Å; N590-S728 PolarHBondContact OD1-OG 3.26Å; D726-S728 PolarHBondContact O-N 3.38Å; S728-C749 WeakPolarHBondContact O-CB 3.24Å; S728-G750 PolarHBondContact O-N 3.3Å; S728-G750 PolarHBondContact OG-N 3.35Å; S728-E751 PolarHBondContact O-N 3.34Å; S728-E751 VanDerWaalsContact O-N 3.12Å
729	Q	81.5	Confident	69.6	Low	122 Å²	122	78.9 Å²	78.9	57%	0.57	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-90.7	148.7	179.5	-66.3	-175.2	-0.7	0	0	110.5	L727	L727-Q729 PolarHBondContact O-N 3.29Å
730	P	72.6	Confident	67.4	Low	7 Å²	7	83.2 Å²	83.2	5%	0.045	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-63	143.3	176.2	27.2	-33.8	0	0	0	110.2	V734 F752 Y806	P730-V734 HydrophobicContact CB-CG2 4.13Å; P730-F752 HydrophobicContact CB-CE1 4.08Å; P730-F752 HydrophobicContact CB-CZ 3.86Å; P730-F752 HydrophobicContact CG-CE1 4.11Å; P730-F752 HydrophobicContact CG-CZ 4.37Å; P730-Y806 HydrophobicContact CG-CD1 3.48Å; P730-Y806 VanDerWaalsContact CG-CD1 3.48Å; P730-Y806 HydrophobicContact CG-CD2 3.72Å; P730-Y806 HydrophobicContact CG-CE1 3.36Å; P730-Y806 HydrophobicContact CG-CE2 3.62Å; P730-Y806 HydrophobicContact CG-CG 3.66Å; P730-Y806 VanDerWaalsContact CG-CZ 3.42Å
731	P	66.4	Low	65.2	Low	80 Å²	80	83.2 Å²	83.2	52%	0.519	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-59.5	144.7	178.6	21.1	-28.9	0	0	0	110.5	F733 V734	P731-F733 PolarHBondContact O-N 2.96Å; P731-V734 HydrophobicContact CG-CG2 3.84Å; P731-V734 WeakPolarHBondContact O-CG2 3.2Å; P731-V734 PolarHBondContact O-N 3.43Å
732	K	60.4	Low	63.2	Low	213 Å²	213	81.5 Å²	81.5	93%	0.926	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-6.2	-171.5	-64.1	-178.5	180	179	0	115.7
733	F	53.9	Low	61.4	Low	164 Å²	164	85.4 Å²	85.4	72%	0.719	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	12.4	-175.4	-70.1	-80.8	0	0	0	115.5	P731 N735	P731-F733 PolarHBondContact O-N 2.96Å; F733-N735 VanDerWaalsContact C-N 3.28Å; F733-N735 PolarHBondContact O-N 3.37Å
734	V	51.6	Low	59.9	Low	32 Å²	32	86.1 Å²	86.1	19%	0.194	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-69.6	-16.9	-173.2	173.1	0	0	0	0	114.9	P730 P731 T736 I737 S738 F752	P730-V734 HydrophobicContact CB-CG2 4.13Å; P731-V734 HydrophobicContact CG-CG2 3.84Å; P731-V734 WeakPolarHBondContact O-CG2 3.2Å; P731-V734 PolarHBondContact O-N 3.43Å; V734-T736 PolarHBondContact O-N 3.12Å; V734-I737 PolarHBondContact O-N 3.35Å; V734-S738 PolarHBondContact O-N 2.93Å; V734-S738 PolarHBondContact O-OG 3.15Å; V734-F752 HydrophobicContact CG1-CZ 4.42Å
735	N	47.5	Very low	59	Low	138 Å²	138	86.8 Å²	86.8	74%	0.738	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-62.5	-17.9	179.8	-71.7	-2.7	0	0	0	113.9	F733	F733-N735 VanDerWaalsContact C-N 3.28Å; F733-N735 PolarHBondContact O-N 3.37Å
736	T	44.4	Very low	58.8	Low	130 Å²	130	81.7 Å²	81.7	80%	0.798	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-105.3	-9.9	179.8	-5.3	0	0	0	0	114.3	V734	V734-T736 PolarHBondContact O-N 3.12Å
737	I	43.3	Very low	58.8	Low	73 Å²	73	79.8 Å²	79.8	37%	0.374	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	12.9	-174.6	-37.9	179.5	0	0	0	111.7	V734 N739 V740 F741	V734-I737 PolarHBondContact O-N 3.35Å; I737-N739 PolarHBondContact O-N 2.72Å; I737-V740 HydrophobicContact CG2-CB 3.88Å; I737-V740 HydrophobicContact CG2-CG2 4Å; I737-V740 PolarHBondContact O-N 3.49Å; I737-F741 HydrophobicContact CB-CD2 4.36Å; I737-F741 HydrophobicContact CG2-CD2 3.71Å; I737-F741 HydrophobicContact CG2-CE2 3.79Å
738	S	41.2	Very low	58.6	Low	57 Å²	57	80.8 Å²	80.8	40%	0.399	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-9.9	-178.3	-76.3	0	0	0	0	114.8	V734 T742	V734-S738 PolarHBondContact O-N 2.93Å; V734-S738 PolarHBondContact O-OG 3.15Å; S738-T742 WeakPolarHBondContact O-CB 3.47Å; S738-T742 WeakPolarHBondContact O-CG2 3.3Å; S738-T742 PolarHBondContact O-OG1 3.09Å
739	N	42.4	Very low	58.6	Low	135 Å²	135	79.1 Å²	79.1	72%	0.722	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-17.5	175.8	-74.6	-4.8	0	0	0	115.1	I737	I737-N739 PolarHBondContact O-N 2.72Å
740	V	42.8	Very low	58.8	Low	92 Å²	92	73.3 Å²	73.3	56%	0.558	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-35.3	-179.8	-175.6	0	0	0	0	111.1	I737	I737-V740 HydrophobicContact CG2-CB 3.88Å; I737-V740 HydrophobicContact CG2-CG2 4Å; I737-V740 PolarHBondContact O-N 3.49Å
741	F	42.6	Very low	59.5	Low	51 Å²	51	73.1 Å²	73.1	22%	0.224	39%	0.392	C	S	.	.	S	Bend	trans	-96.3	-19.5	-175.9	-70.7	-78.5	0	0	0	114.8	T597 L601 I737 Q743 S744 V748	T597-F741 HydrophobicContact CG2-CE1 4.15Å; L601-F741 HydrophobicContact CD1-CE1 4.33Å; L601-F741 HydrophobicContact CD1-CZ 4.24Å; L601-F741 HydrophobicContact CD2-CE1 3.91Å; L601-F741 HydrophobicContact CD2-CZ 3.76Å; L601-F741 HydrophobicContact CG-CE1 4.2Å; L601-F741 HydrophobicContact CG-CZ 4.35Å; I737-F741 HydrophobicContact CB-CD2 4.36Å; I737-F741 HydrophobicContact CG2-CD2 3.71Å; I737-F741 HydrophobicContact CG2-CE2 3.79Å; F741-Q743 VanDerWaalsContact C-N 3.27Å; F741-S744 VanDerWaalsContact CA-OG 3.24Å; F741-S744 WeakPolarHBondContact CA-OG 3.22Å; F741-S744 WeakPolarHBondContact O-CB 3.47Å; F741-S744 PolarHBondContact O-N 2.97Å; F741-S744 VanDerWaalsContact O-N 3.15Å; F741-S744 PolarHBondContact O-OG 3.29Å; F741-V748 HydrophobicContact CB-CG2 3.76Å; F741-V748 HydrophobicContact CD1-CG2 3.66Å; F741-V748 HydrophobicContact CE1-CG2 4.46Å; F741-V748 HydrophobicContact CG-CG2 3.88Å
742	T	45	Very low	60.5	Low	107 Å²	107	70.6 Å²	70.6	66%	0.656	37%	0.373	S	S	*	.	S	Bend	trans	-76.1	-18.8	172.6	56	0	0	0	0	112.6	S738	S738-T742 WeakPolarHBondContact O-CB 3.47Å; S738-T742 WeakPolarHBondContact O-CG2 3.3Å; S738-T742 PolarHBondContact O-OG1 3.09Å
743	Q	47.9	Very low	61.9	Low	164 Å²	164	60.4 Å²	60.4	77%	0.766	33%	0.329	S	S	*	.	S	Bend	trans	-88.9	-11.5	166.4	-67.1	-176.5	-6.3	0	0	112.7	F741 G745	F741-Q743 VanDerWaalsContact C-N 3.27Å; Q743-G745 PolarHBondContact O-N 3.42Å
744	S	52.3	Low	63.6	Low	17 Å²	17	52.6 Å²	52.6	12%	0.119	29%	0.294	C	S	.	.	S	Bend	trans	-83.8	116.5	177.8	81.8	0	0	0	0	108.3	Q600 F741 C746	Q600-S744 VanDerWaalsContact OE1-CB 3.27Å; F741-S744 VanDerWaalsContact CA-OG 3.24Å; F741-S744 WeakPolarHBondContact CA-OG 3.22Å; F741-S744 WeakPolarHBondContact O-CB 3.47Å; F741-S744 PolarHBondContact O-N 2.97Å; F741-S744 VanDerWaalsContact O-N 3.15Å; F741-S744 PolarHBondContact O-OG 3.29Å; S744-C746 PolarHBondContact O-N 3.2Å
745	G	66.1	Low	65.4	Low	17 Å²	17	51.1 Å²	51.1	18%	0.175	29%	0.285	C	S	.	.	S	Bend	trans	-64.9	-1.9	-168.6	0	0	0	0	0	115.9	R658 N662 Q743	R658-G745 WeakPolarHBondContact CA-O 3.17Å; R658-G745 VanDerWaalsContact CB-O 3.31Å; R658-G745 WeakPolarHBondContact CB-O 3.29Å; N662-G745 PolarHBondContact ND2-O 3.08Å; Q743-G745 PolarHBondContact O-N 3.42Å
746	C	77.6	Confident	67.3	Low	6 Å²	6	47 Å²	47	4%	0.041	26%	0.263	C	S	.	.	S	Bend	trans	-108	146.8	-177.5	-171.2	0	0	0	0	111.7	N662 S744 V748	N662-C746 WeakPolarHBondContact OD1-CA 3.37Å; S744-C746 PolarHBondContact O-N 3.2Å; C746-V748 PolarHBondContact O-N 2.91Å
747	Y	84.9	Confident	69.5	Low	26 Å²	26	40.9 Å²	40.9	10%	0.102	23%	0.226	C	C	.	.			trans	-63.9	126.9	168.4	-58.3	-54.6	0	0	0	111.1	C593 T597 N662 C665 I666 C749 F752 A753 D756	C593-Y747 WeakPolarHBondContact CB-O 3.46Å; T597-Y747 PolarHBondContact OG1-O 3Å; N662-Y747 HydrophobicContact CB-CD2 3.82Å; N662-Y747 HydrophobicContact CB-CE2 3.31Å; N662-Y747 VanDerWaalsContact CG-CE2 3.45Å; N662-Y747 WeakPolarHBondContact OD1-CD2 3.5Å; N662-Y747 PolarHBondContact OD1-N 3.4Å; C665-Y747 HydrophobicContact CB-CD2 4.2Å; C665-Y747 HydrophobicContact CB-CE2 4.3Å; I666-Y747 WeakPolarHBondContact CD1-OH 3.32Å; I666-Y747 HydrophobicContact CG1-CE2 4.43Å; Y747-C749 VanDerWaalsContact C-N 3.3Å; Y747-C749 PolarHBondContact O-N 3.17Å; Y747-F752 HydrophobicContact CD1-CB 4.08Å; Y747-A753 HydrophobicContact CD2-CB 3.46Å; Y747-A753 VanDerWaalsContact CD2-CB 3.46Å; Y747-A753 HydrophobicContact CE2-CB 3.84Å; Y747-A753 HydrophobicContact CG-CB 3.89Å; Y747-D756 HydrophobicContact CE1-CB 3.94Å; Y747-D756 WeakPolarHBondContact OH-CB 3.35Å; Y747-D756 PolarHBondContact OH-OD2 3.36Å
748	V	81.2	Confident	71.8	Confident	27 Å²	27	37.6 Å²	37.6	16%	0.164	21%	0.209	C	C	.	.	S	Bend	trans	-67.2	-34.3	178.2	-179.4	0	0	0	0	111.7	T597 F741 C746 F752	T597-V748 HydrophobicContact CG2-CG1 4.42Å; T597-V748 WeakPolarHBondContact OG1-CA 3.45Å; F741-V748 HydrophobicContact CB-CG2 3.76Å; F741-V748 HydrophobicContact CD1-CG2 3.66Å; F741-V748 HydrophobicContact CE1-CG2 4.46Å; F741-V748 HydrophobicContact CG-CG2 3.88Å; C746-V748 PolarHBondContact O-N 2.91Å; V748-F752 HydrophobicContact CB-CD2 3.91Å; V748-F752 HydrophobicContact CB-CE2 3.89Å; V748-F752 HydrophobicContact CG2-CD2 4.26Å; V748-F752 HydrophobicContact CG2-CE2 4.12Å
749	C	85.5	Confident	74.1	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.027	21%	0.206	C	C	.	.	S	Bend	trans	-152.3	164.2	-178.5	63.8	0	0	0	0	110.9	C593 S728 Y747 E751 F752 A753	C593-C749 VanDerWaalsContact SG-C 3.58Å; S728-C749 WeakPolarHBondContact O-CB 3.24Å; Y747-C749 VanDerWaalsContact C-N 3.3Å; Y747-C749 PolarHBondContact O-N 3.17Å; C749-E751 PolarHBondContact O-N 3.42Å; C749-F752 PolarHBondContact O-N 3.49Å; C749-A753 PolarHBondContact O-N 2.99Å
750	G	85.6	Confident	76.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.9	-29.8	-179	0	0	0	0	0	113.1	S728 F752 A753 L754	S728-G750 PolarHBondContact O-N 3.3Å; S728-G750 PolarHBondContact OG-N 3.35Å; G750-F752 VanDerWaalsContact C-N 3.32Å; G750-F752 PolarHBondContact O-N 3.49Å; G750-A753 PolarHBondContact O-N 3.45Å; G750-L754 WeakPolarHBondContact O-CB 3.43Å; G750-L754 PolarHBondContact O-N 2.89Å
751	E	87.6	Confident	78.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-39.9	173.8	-174	62.1	-144.6	0	0	112.1	R720 S728 C749 L754 Q755 S803 Y806	R720-E751 IonicContact CZ-OE1 3.29Å; R720-E751 IonicContact CZ-OE2 2.75Å; R720-E751 VanDerWaalsContact CZ-OE2 3.29Å; R720-E751 VanDerWaalsContact NH1-CD 3.35Å; R720-E751 IonicContact NH1-OE1 2.79Å; R720-E751 PolarHBondContact NH1-OE1 3.16Å; R720-E751 IonicContact NH1-OE2 3.53Å; R720-E751 PolarHBondContact NH1-OE2 3.27Å; R720-E751 VanDerWaalsContact NH2-CD 3.27Å; R720-E751 IonicContact NH2-OE1 2.9Å; R720-E751 PolarHBondContact NH2-OE1 3.48Å; R720-E751 IonicContact NH2-OE2 2.96Å; R720-E751 PolarHBondContact NH2-OE2 3.16Å; S728-E751 PolarHBondContact O-N 3.34Å; S728-E751 VanDerWaalsContact O-N 3.12Å; C749-E751 PolarHBondContact O-N 3.42Å; E751-L754 WeakPolarHBondContact O-CB 3.49Å; E751-L754 PolarHBondContact O-N 3.04Å; E751-Q755 VanDerWaalsContact O-CG 3.29Å; E751-Q755 WeakPolarHBondContact O-CG 3.39Å; E751-Q755 PolarHBondContact O-N 3.35Å; E751-Q755 PolarHBondContact OE1-NE2 3.08Å; E751-S803 VanDerWaalsContact CD-OG 3.29Å; E751-S803 WeakPolarHBondContact OE1-CB 3.33Å; E751-S803 PolarHBondContact OE1-OG 3.41Å; E751-Y806 HydrophobicContact CG-CD2 4.25Å; E751-Y806 HydrophobicContact CG-CE2 4.44Å
752	F	87.1	Confident	81	Confident	27 Å²	27	29.4 Å²	29.4	12%	0.118	16%	0.161	C	C	.	.	H	α-helix	trans	-69.4	-38.7	178.3	-66.2	-10.7	0	0	0	111.8	P730 V734 Y747 V748 C749 G750 L754 Q755 D756 Y808	P730-F752 HydrophobicContact CB-CE1 4.08Å; P730-F752 HydrophobicContact CB-CZ 3.86Å; P730-F752 HydrophobicContact CG-CE1 4.11Å; P730-F752 HydrophobicContact CG-CZ 4.37Å; V734-F752 HydrophobicContact CG1-CZ 4.42Å; Y747-F752 HydrophobicContact CD1-CB 4.08Å; V748-F752 HydrophobicContact CB-CD2 3.91Å; V748-F752 HydrophobicContact CB-CE2 3.89Å; V748-F752 HydrophobicContact CG2-CD2 4.26Å; V748-F752 HydrophobicContact CG2-CE2 4.12Å; C749-F752 PolarHBondContact O-N 3.49Å; G750-F752 VanDerWaalsContact C-N 3.32Å; G750-F752 PolarHBondContact O-N 3.49Å; F752-L754 VanDerWaalsContact C-N 3.32Å; F752-L754 PolarHBondContact O-N 3.4Å; F752-Q755 PolarHBondContact O-N 2.74Å; F752-D756 PolarHBondContact O-N 2.93Å; F752-D756 VanDerWaalsContact O-N 3.12Å; F752-Y808 AromaticContact CD1-CE2 3.5Å; F752-Y808 HydrophobicContact CD1-CE2 3.5Å; F752-Y808 AromaticContact CD1-CZ 3.92Å; F752-Y808 AromaticContact CE1-CE2 3.65Å; F752-Y808 HydrophobicContact CE1-CE2 3.65Å; F752-Y808 HydrophobicContact CG-CE2 4.47Å
753	A	88.7	Confident	83.2	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.9	-42.5	173.3	0	0	0	0	0	111.6	V589 C665 L669 Y747 C749 G750 D756 A757	V589-A753 HydrophobicContact CG1-CB 4.22Å; C665-A753 HydrophobicContact CB-CB 3.93Å; L669-A753 HydrophobicContact CD1-CB 4.33Å; Y747-A753 HydrophobicContact CD2-CB 3.46Å; Y747-A753 VanDerWaalsContact CD2-CB 3.46Å; Y747-A753 HydrophobicContact CE2-CB 3.84Å; Y747-A753 HydrophobicContact CG-CB 3.89Å; C749-A753 PolarHBondContact O-N 2.99Å; G750-A753 PolarHBondContact O-N 3.45Å; A753-D756 PolarHBondContact O-N 3.42Å; A753-A757 WeakPolarHBondContact O-CB 3.5Å; A753-A757 PolarHBondContact O-N 3.45Å
754	L	90.7	Very high	85.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-48.4	175.5	173.6	70.6	0	0	0	111.8	L669 L673 L724 L727 G750 E751 F752 D756 A757 L758	L669-L754 HydrophobicContact CD1-CB 4.39Å; L673-L754 HydrophobicContact CD1-CD1 4.19Å; L673-L754 HydrophobicContact CD2-CD1 3.81Å; L724-L754 HydrophobicContact CD1-CD1 3.98Å; L724-L754 HydrophobicContact CD1-CD2 3.88Å; L724-L754 HydrophobicContact CD2-CD1 4.08Å; L727-L754 HydrophobicContact CD1-CB 3.91Å; L727-L754 HydrophobicContact CD1-CD1 4.34Å; L727-L754 HydrophobicContact CD1-CD2 3.74Å; L727-L754 HydrophobicContact CD1-CG 4.2Å; G750-L754 WeakPolarHBondContact O-CB 3.43Å; G750-L754 PolarHBondContact O-N 2.89Å; E751-L754 WeakPolarHBondContact O-CB 3.49Å; E751-L754 PolarHBondContact O-N 3.04Å; F752-L754 VanDerWaalsContact C-N 3.32Å; F752-L754 PolarHBondContact O-N 3.4Å; L754-D756 VanDerWaalsContact C-N 3.28Å; L754-D756 PolarHBondContact O-N 2.98Å; L754-A757 PolarHBondContact O-N 2.88Å; L754-L758 HydrophobicContact CD1-CD1 3.95Å; L754-L758 HydrophobicContact CD1-CG 3.98Å; L754-L758 HydrophobicContact CD2-CD1 4.32Å; L754-L758 HydrophobicContact CG-CD1 3.79Å; L754-L758 HydrophobicContact CG-CG 4.22Å; L754-L758 WeakPolarHBondContact O-CB 3.05Å; L754-L758 VanDerWaalsContact O-CG 3.28Å; L754-L758 WeakPolarHBondContact O-CG 3.29Å; L754-L758 PolarHBondContact O-N 3.17Å
755	Q	90.1	Very high	87.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-35.7	-178.1	-66	-59.1	-43.5	0	0	111.9	E751 F752 K759 L801 Y808 L813	E751-Q755 VanDerWaalsContact O-CG 3.29Å; E751-Q755 WeakPolarHBondContact O-CG 3.39Å; E751-Q755 PolarHBondContact O-N 3.35Å; E751-Q755 PolarHBondContact OE1-NE2 3.08Å; F752-Q755 PolarHBondContact O-N 2.74Å; Q755-K759 PolarHBondContact O-N 3.07Å; Q755-L801 PolarHBondContact NE2-O 2.86Å; Q755-Y808 HydrophobicContact CB-CD1 3.75Å; Q755-Y808 HydrophobicContact CB-CD2 4.23Å; Q755-Y808 HydrophobicContact CB-CE1 3.9Å; Q755-Y808 HydrophobicContact CB-CE2 4.39Å; Q755-Y808 HydrophobicContact CB-CG 3.9Å; Q755-Y808 HydrophobicContact CG-CD1 4.12Å; Q755-Y808 HydrophobicContact CG-CD2 3.78Å; Q755-Y808 HydrophobicContact CG-CE2 4.22Å; Q755-Y808 HydrophobicContact CG-CG 3.71Å; Q755-L813 HydrophobicContact CB-CD2 4.41Å
756	D	86.7	Confident	88.5	Confident	51 Å²	51	20.5 Å²	20.5	27%	0.273	11%	0.11	S	C	.	.	H	α-helix	trans	-71.2	-42.4	175	-151.3	30.1	0	0	0	112	Y747 F752 A753 L754 L758 K759	Y747-D756 HydrophobicContact CE1-CB 3.94Å; Y747-D756 WeakPolarHBondContact OH-CB 3.35Å; Y747-D756 PolarHBondContact OH-OD2 3.36Å; F752-D756 PolarHBondContact O-N 2.93Å; F752-D756 VanDerWaalsContact O-N 3.12Å; A753-D756 PolarHBondContact O-N 3.42Å; L754-D756 VanDerWaalsContact C-N 3.28Å; L754-D756 PolarHBondContact O-N 2.98Å; D756-L758 VanDerWaalsContact C-N 3.28Å; D756-L758 PolarHBondContact O-N 2.95Å; D756-K759 WeakPolarHBondContact O-CB 3.49Å; D756-K759 PolarHBondContact O-N 2.91Å; D756-K759 WeakPolarHBondContact OD1-CD 3.33Å; D756-K759 VanDerWaalsContact OD1-CE 3.22Å; D756-K759 WeakPolarHBondContact OD1-CE 3.47Å; D756-K759 IonicContact OD1-NZ 3.99Å; D756-K759 PolarHBondContact OD1-NZ 3.23Å
757	A	90.2	Very high	89.2	Confident	2 Å²	2	21.7 Å²	21.7	2%	0.017	12%	0.115	C	C	.	.	H	α-helix	trans	-66	-28.2	175.4	0	0	0	0	0	113.1	I666 L669 L673 A753 L754 P760	I666-A757 HydrophobicContact CG1-CB 4.39Å; I666-A757 HydrophobicContact CG2-CB 4.3Å; L669-A757 HydrophobicContact CB-CB 4.36Å; L669-A757 HydrophobicContact CD1-CB 4.3Å; L673-A757 HydrophobicContact CD1-CB 3.63Å; A753-A757 WeakPolarHBondContact O-CB 3.5Å; A753-A757 PolarHBondContact O-N 3.45Å; L754-A757 PolarHBondContact O-N 2.88Å; A757-P760 WeakPolarHBondContact O-CD 3.43Å
758	L	90.7	Very high	89.5	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.021	11%	0.112	C	C	.	.	H	α-helix	trans	-74.2	-22.9	177	-81.1	174	0	0	0	113.4	L673 L754 D756 I761 L762 L801	L673-L758 HydrophobicContact CD1-CD2 4.31Å; L673-L758 HydrophobicContact CD1-CG 4.42Å; L673-L758 HydrophobicContact CD2-CD2 3.96Å; L754-L758 HydrophobicContact CD1-CD1 3.95Å; L754-L758 HydrophobicContact CD1-CG 3.98Å; L754-L758 HydrophobicContact CD2-CD1 4.32Å; L754-L758 HydrophobicContact CG-CD1 3.79Å; L754-L758 HydrophobicContact CG-CG 4.22Å; L754-L758 WeakPolarHBondContact O-CB 3.05Å; L754-L758 VanDerWaalsContact O-CG 3.28Å; L754-L758 WeakPolarHBondContact O-CG 3.29Å; L754-L758 PolarHBondContact O-N 3.17Å; D756-L758 VanDerWaalsContact C-N 3.28Å; D756-L758 PolarHBondContact O-N 2.95Å; L758-I761 PolarHBondContact O-N 2.93Å; L758-I761 VanDerWaalsContact O-N 3.11Å; L758-L762 HydrophobicContact CB-CD1 4.04Å; L758-L762 HydrophobicContact CB-CG 4.29Å; L758-L762 WeakPolarHBondContact O-CB 3.42Å; L758-L762 WeakPolarHBondContact O-CG 3.36Å; L758-L762 PolarHBondContact O-N 3.22Å; L758-L801 HydrophobicContact CD1-CB 4.41Å; L758-L801 VanDerWaalsContact CD1-O 3.3Å; L758-L801 WeakPolarHBondContact CD1-O 3.35Å
759	K	90.5	Very high	90.1	Very high	76 Å²	76	19.4 Å²	19.4	33%	0.33	10%	0.104	S	C	.	.	H	α-helix	trans	-50.8	-56.6	-177.8	-71.3	176.3	-177.9	167.6	0	114	Q755 D756 I761 T763 L813 I814	Q755-K759 PolarHBondContact O-N 3.07Å; D756-K759 WeakPolarHBondContact O-CB 3.49Å; D756-K759 PolarHBondContact O-N 2.91Å; D756-K759 WeakPolarHBondContact OD1-CD 3.33Å; D756-K759 VanDerWaalsContact OD1-CE 3.22Å; D756-K759 WeakPolarHBondContact OD1-CE 3.47Å; D756-K759 IonicContact OD1-NZ 3.99Å; D756-K759 PolarHBondContact OD1-NZ 3.23Å; K759-I761 PolarHBondContact O-N 2.85Å; K759-T763 WeakPolarHBondContact O-CB 3.31Å; K759-T763 PolarHBondContact O-N 3.37Å; K759-T763 PolarHBondContact O-OG1 2.92Å; K759-L813 HydrophobicContact CD-CD2 4.45Å; K759-L813 HydrophobicContact CG-CB 4.36Å; K759-L813 HydrophobicContact CG-CD2 3.8Å; K759-I814 WeakPolarHBondContact O-CG2 3.48Å
760	P	90.2	Very high	90.5	Very high	79 Å²	79	19.2 Å²	19.2	51%	0.513	10%	0.103	S	C	.	.	H	α-helix	trans	-63.9	-32.4	180	24.7	-34.7	0	0	0	112.2	A757 T763 M764	A757-P760 WeakPolarHBondContact O-CD 3.43Å; P760-T763 WeakPolarHBondContact O-CB 3.4Å; P760-M764 WeakPolarHBondContact O-CB 3.48Å; P760-M764 PolarHBondContact O-N 3.4Å
761	I	90.5	Very high	90.9	Very high	8 Å²	8	19.4 Å²	19.4	4%	0.041	10%	0.104	C	C	.	.	H	α-helix	trans	-75.4	-43.8	-176.2	-66.9	171.9	0	0	0	111.3	L673 L758 K759 T763 M764 C765	L673-I761 HydrophobicContact CB-CD1 3.15Å; L673-I761 HydrophobicContact CD1-CD1 4.1Å; L673-I761 HydrophobicContact CG-CD1 4.25Å; L758-I761 PolarHBondContact O-N 2.93Å; L758-I761 VanDerWaalsContact O-N 3.11Å; K759-I761 PolarHBondContact O-N 2.85Å; I761-T763 VanDerWaalsContact C-N 3.32Å; I761-M764 PolarHBondContact O-N 3.43Å; I761-C765 PolarHBondContact O-N 2.92Å; I761-C765 PolarHBondContact O-SG 2.99Å
762	L	92.2	Very high	91.1	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-63.7	-40.3	173.4	-70.1	173.7	0	0	0	111	L758 M764 C765 V766 L801 L810 L813 I814	L758-L762 HydrophobicContact CB-CD1 4.04Å; L758-L762 HydrophobicContact CB-CG 4.29Å; L758-L762 WeakPolarHBondContact O-CB 3.42Å; L758-L762 WeakPolarHBondContact O-CG 3.36Å; L758-L762 PolarHBondContact O-N 3.22Å; L762-M764 VanDerWaalsContact C-N 3.31Å; L762-M764 PolarHBondContact O-N 3.43Å; L762-C765 PolarHBondContact O-N 3.36Å; L762-V766 WeakPolarHBondContact O-CB 3.48Å; L762-V766 WeakPolarHBondContact O-CG2 3.4Å; L762-V766 PolarHBondContact O-N 3.2Å; L762-L801 HydrophobicContact CD2-CD1 4.23Å; L762-L810 HydrophobicContact CD1-CD2 4.17Å; L762-L810 HydrophobicContact CD2-CD2 4.49Å; L762-L813 HydrophobicContact CD1-CD1 3.94Å; L762-I814 HydrophobicContact CB-CD1 4.23Å; L762-I814 HydrophobicContact CB-CG2 4.34Å
763	T	91.8	Very high	91.3	Very high	44 Å²	44	18.1 Å²	18.1	27%	0.27	10%	0.098	S	C	.	.	H	α-helix	trans	-55.9	-48.7	172.6	-54.7	0	0	0	0	110.4	K759 P760 I761 V766 N767 I814	K759-T763 WeakPolarHBondContact O-CB 3.31Å; K759-T763 PolarHBondContact O-N 3.37Å; K759-T763 PolarHBondContact O-OG1 2.92Å; P760-T763 WeakPolarHBondContact O-CB 3.4Å; I761-T763 VanDerWaalsContact C-N 3.32Å; T763-V766 PolarHBondContact O-N 3.3Å; T763-N767 VanDerWaalsContact O-CB 3.29Å; T763-N767 WeakPolarHBondContact O-CB 3.38Å; T763-N767 PolarHBondContact O-N 2.94Å; T763-N767 PolarHBondContact O-ND2 3.43Å; T763-I814 WeakPolarHBondContact OG1-CG2 3.4Å
764	M	90.5	Very high	91.4	Very high	69 Å²	69	18.1 Å²	18.1	34%	0.34	10%	0.098	S	C	.	.	H	α-helix	trans	-64.2	-43.4	179.2	-168	172.8	69.8	0	0	112.5	S677 P760 I761 L762 S768 V888	S677-M764 WeakPolarHBondContact OG-CE 3.43Å; P760-M764 WeakPolarHBondContact O-CB 3.48Å; P760-M764 PolarHBondContact O-N 3.4Å; I761-M764 PolarHBondContact O-N 3.43Å; L762-M764 VanDerWaalsContact C-N 3.31Å; L762-M764 PolarHBondContact O-N 3.43Å; M764-S768 VanDerWaalsContact O-CB 3.27Å; M764-S768 WeakPolarHBondContact O-CB 3.25Å; M764-S768 PolarHBondContact O-N 2.63Å; M764-V888 HydrophobicContact CG-CG1 3.91Å
765	C	92.1	Very high	91.4	Very high	4 Å²	4	18.5 Å²	18.5	3%	0.027	10%	0.101	C	C	.	.	H	α-helix	trans	-63.6	-45	178.3	-69.5	0	0	0	0	112.1	I680 I761 L762 S768 Y769	I680-C765 HydrophobicContact CG2-CB 4.27Å; I761-C765 PolarHBondContact O-N 2.92Å; I761-C765 PolarHBondContact O-SG 2.99Å; L762-C765 PolarHBondContact O-N 3.36Å; C765-S768 PolarHBondContact O-N 3.46Å; C765-Y769 PolarHBondContact O-N 3.43Å
766	V	93.7	Very high	91.4	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-66.4	-45.8	178.3	172.7	0	0	0	0	110.6	L762 T763 S768 Y769 L770 F794 L798 I814 L821	L762-V766 WeakPolarHBondContact O-CB 3.48Å; L762-V766 WeakPolarHBondContact O-CG2 3.4Å; L762-V766 PolarHBondContact O-N 3.2Å; T763-V766 PolarHBondContact O-N 3.3Å; V766-S768 VanDerWaalsContact C-N 3.35Å; V766-S768 PolarHBondContact O-N 2.89Å; V766-Y769 PolarHBondContact O-N 3.45Å; V766-L770 HydrophobicContact CG1-CD1 4.05Å; V766-L770 HydrophobicContact CG1-CG 4.38Å; V766-L770 WeakPolarHBondContact O-CG 3.26Å; V766-L770 PolarHBondContact O-N 3.37Å; V766-F794 HydrophobicContact CG2-CE1 4.19Å; V766-L798 HydrophobicContact CG2-CD1 3.81Å; V766-I814 HydrophobicContact CB-CD1 4.23Å; V766-I814 HydrophobicContact CG2-CD1 3.65Å; V766-L821 HydrophobicContact CG1-CB 4.12Å; V766-L821 HydrophobicContact CG1-CD1 4.38Å; V766-L821 HydrophobicContact CG1-CD2 4.31Å
767	N	91.9	Very high	91.4	Very high	30 Å²	30	17.3 Å²	17.3	16%	0.16	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-40.8	177	-69.8	-10.5	0	0	0	111.6	T763 Y769 L770 W771 S817 V888	T763-N767 VanDerWaalsContact O-CB 3.29Å; T763-N767 WeakPolarHBondContact O-CB 3.38Å; T763-N767 PolarHBondContact O-N 2.94Å; T763-N767 PolarHBondContact O-ND2 3.43Å; N767-Y769 PolarHBondContact O-N 2.85Å; N767-L770 PolarHBondContact O-N 3.18Å; N767-W771 WeakPolarHBondContact O-CB 3.3Å; N767-W771 PolarHBondContact O-N 3.3Å; N767-S817 WeakPolarHBondContact OD1-CB 3.34Å; N767-S817 PolarHBondContact OD1-OG 3.28Å; N767-V888 HydrophobicContact CB-CG1 4.49Å; N767-V888 HydrophobicContact CB-CG2 4.38Å
768	S	92.2	Very high	91.1	Very high	5 Å²	5	17.2 Å²	17.2	4%	0.035	9%	0.092	C	C	.	.	H	α-helix	trans	-60.3	-44.8	174.9	-175.4	0	0	0	0	111.3	D681 M764 C765 V766 W771 R772	D681-S768 PolarHBondContact OD1-OG 2.97Å; M764-S768 VanDerWaalsContact O-CB 3.27Å; M764-S768 WeakPolarHBondContact O-CB 3.25Å; M764-S768 PolarHBondContact O-N 2.63Å; C765-S768 PolarHBondContact O-N 3.46Å; V766-S768 VanDerWaalsContact C-N 3.35Å; V766-S768 PolarHBondContact O-N 2.89Å; S768-W771 PolarHBondContact O-N 3.06Å; S768-R772 WeakPolarHBondContact O-CB 3.48Å; S768-R772 WeakPolarHBondContact O-CG 3.48Å; S768-R772 PolarHBondContact O-N 3.41Å; S768-R772 PolarHBondContact OG-NE 3.31Å
769	Y	94.4	Very high	90.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.5	-48.8	175.9	178.8	-104.2	0	0	0	112.5	L684 M687 Y708 C765 V766 N767 W771 R772 S773 Y791 F794 L821	L684-Y769 HydrophobicContact CD2-CD2 3.86Å; M687-Y769 HydrophobicContact CE-CD2 4.35Å; M687-Y769 HydrophobicContact CE-CE2 4.1Å; Y708-Y769 HydrophobicContact CE2-CE2 4.13Å; C765-Y769 PolarHBondContact O-N 3.43Å; V766-Y769 PolarHBondContact O-N 3.45Å; N767-Y769 PolarHBondContact O-N 2.85Å; Y769-W771 PolarHBondContact O-N 3.4Å; Y769-R772 PolarHBondContact O-N 2.95Å; Y769-S773 WeakPolarHBondContact O-CB 3.47Å; Y769-S773 PolarHBondContact O-N 3.15Å; Y769-Y791 HydrophobicContact CE1-CD1 4.12Å; Y769-Y791 AromaticContact CE1-CD2 3.68Å; Y769-Y791 HydrophobicContact CE1-CD2 3.68Å; Y769-Y791 HydrophobicContact CE1-CE1 4.09Å; Y769-Y791 AromaticContact CE1-CE2 3.62Å; Y769-Y791 HydrophobicContact CE1-CE2 3.62Å; Y769-Y791 AromaticContact CE1-CG 3.94Å; Y769-Y791 HydrophobicContact CE1-CG 3.94Å; Y769-Y791 AromaticContact CE1-CZ 3.85Å; Y769-Y791 AromaticContact CZ-CD2 3.94Å; Y769-Y791 WeakPolarHBondContact OH-CD2 3.35Å; Y769-F794 HydrophobicContact CD1-CB 4.48Å; Y769-F794 AromaticContact CD1-CD1 3.45Å; Y769-F794 HydrophobicContact CD1-CD1 3.45Å; Y769-F794 VanDerWaalsContact CD1-CD1 3.45Å; Y769-F794 HydrophobicContact CD1-CD2 4.29Å; Y769-F794 AromaticContact CD1-CE1 3.6Å; Y769-F794 HydrophobicContact CD1-CE1 3.6Å; Y769-F794 HydrophobicContact CD1-CE2 4.43Å; Y769-F794 AromaticContact CD1-CG 3.81Å; Y769-F794 HydrophobicContact CD1-CG 3.81Å; Y769-F794 HydrophobicContact CD1-CZ 4.1Å; Y769-F794 HydrophobicContact CD2-CD1 4.37Å; Y769-F794 AromaticContact CD2-CD2 3.71Å; Y769-F794 HydrophobicContact CD2-CD2 3.71Å; Y769-F794 HydrophobicContact CD2-CE1 4.46Å; Y769-F794 AromaticContact CD2-CE2 3.84Å; Y769-F794 HydrophobicContact CD2-CE2 3.84Å; Y769-F794 AromaticContact CD2-CG 3.99Å; Y769-F794 HydrophobicContact CD2-CG 3.99Å; Y769-F794 HydrophobicContact CD2-CZ 4.21Å; Y769-F794 HydrophobicContact CE1-CB 3.98Å; Y769-F794 AromaticContact CE1-CD1 3.74Å; Y769-F794 HydrophobicContact CE1-CD1 3.74Å; Y769-F794 HydrophobicContact CE1-CE1 4.36Å; Y769-F794 AromaticContact CE1-CG 3.82Å; Y769-F794 HydrophobicContact CE1-CG 3.82Å; Y769-F794 HydrophobicContact CE2-CB 4.2Å; Y769-F794 AromaticContact CE2-CD2 3.97Å; Y769-F794 HydrophobicContact CE2-CD2 3.97Å; Y769-F794 HydrophobicContact CE2-CG 4.01Å; Y769-F794 AromaticContact CG-CD1 3.78Å; Y769-F794 HydrophobicContact CG-CD1 3.78Å; Y769-F794 AromaticContact CG-CD2 3.87Å; Y769-F794 HydrophobicContact CG-CD2 3.87Å; Y769-F794 AromaticContact CG-CE1 3.64Å; Y769-F794 HydrophobicContact CG-CE1 3.64Å; Y769-F794 AromaticContact CG-CE2 3.76Å; Y769-F794 HydrophobicContact CG-CE2 3.76Å; Y769-F794 AromaticContact CG-CG 3.88Å; Y769-F794 HydrophobicContact CG-CG 3.88Å; Y769-F794 AromaticContact CG-CZ 3.63Å; Y769-F794 HydrophobicContact CG-CZ 3.63Å; Y769-F794 AromaticContact CZ-CG 3.91Å; Y769-L821 HydrophobicContact CD1-CD1 3.81Å; Y769-L821 HydrophobicContact CE1-CD1 4.03Å
770	L	93.5	Very high	90.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-54.2	-54	176.9	-75	173	0	0	0	110.8	V766 N767 R772 S773 T774 Y791 Q820 L821 F824 M856	V766-L770 HydrophobicContact CG1-CD1 4.05Å; V766-L770 HydrophobicContact CG1-CG 4.38Å; V766-L770 WeakPolarHBondContact O-CG 3.26Å; V766-L770 PolarHBondContact O-N 3.37Å; N767-L770 PolarHBondContact O-N 3.18Å; L770-R772 PolarHBondContact O-N 3.42Å; L770-S773 WeakPolarHBondContact O-CB 3.32Å; L770-S773 PolarHBondContact O-N 2.96Å; L770-S773 PolarHBondContact O-OG 2.94Å; L770-T774 VanDerWaalsContact O-CG2 3.29Å; L770-T774 WeakPolarHBondContact O-CG2 3.4Å; L770-T774 PolarHBondContact O-N 2.82Å; L770-Y791 HydrophobicContact CD2-CE1 3.7Å; L770-Q820 HydrophobicContact CD1-CB 3.82Å; L770-L821 HydrophobicContact CD2-CD1 4.06Å; L770-L821 HydrophobicContact CG-CD1 4.45Å; L770-F824 HydrophobicContact CD2-CB 4.37Å; L770-M856 HydrophobicContact CB-CE 3.78Å; L770-M856 HydrophobicContact CB-SD 4.04Å; L770-M856 HydrophobicContact CD1-CE 4.31Å
771	W	92.9	Very high	89.9	Confident	4 Å²	4	23.7 Å²	23.7	2%	0.015	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-44.2	-179.5	-75	119.1	0	0	0	113	N767 S768 Y769 S773 T774 L775 L853 S855 M856 Q859 V884 L887	N767-W771 WeakPolarHBondContact O-CB 3.3Å; N767-W771 PolarHBondContact O-N 3.3Å; S768-W771 PolarHBondContact O-N 3.06Å; Y769-W771 PolarHBondContact O-N 3.4Å; W771-S773 VanDerWaalsContact C-N 3.29Å; W771-S773 PolarHBondContact O-N 3.45Å; W771-T774 PolarHBondContact O-N 2.93Å; W771-T774 PolarHBondContact O-OG1 2.95Å; W771-L775 PolarHBondContact O-N 3.11Å; W771-L853 HydrophobicContact CZ2-CD1 4.29Å; W771-S855 VanDerWaalsContact CH2-OG 3.29Å; W771-S855 WeakPolarHBondContact CH2-OG 3.25Å; W771-M856 HydrophobicContact CD2-CE 3.78Å; W771-M856 VanDerWaalsContact CE2-CE 3.49Å; W771-M856 HydrophobicContact CE3-CE 4.18Å; W771-M856 HydrophobicContact CE3-CG 4.26Å; W771-M856 HydrophobicContact CG-CE 4.32Å; W771-M856 HydrophobicContact CH2-CB 3.63Å; W771-M856 HydrophobicContact CH2-CE 4.01Å; W771-M856 HydrophobicContact CH2-CG 4.14Å; W771-M856 HydrophobicContact CZ2-CB 4.34Å; W771-M856 HydrophobicContact CZ2-CE 3.61Å; W771-M856 VanDerWaalsContact CZ3-CA 3.49Å; W771-M856 HydrophobicContact CZ3-CB 3.8Å; W771-M856 HydrophobicContact CZ3-CE 4.31Å; W771-M856 HydrophobicContact CZ3-CG 3.95Å; W771-Q859 HydrophobicContact CZ3-CB 4.36Å; W771-V884 HydrophobicContact CB-CG1 4.37Å; W771-L887 HydrophobicContact CB-CD1 4.32Å; W771-L887 HydrophobicContact CD2-CB 3.97Å; W771-L887 HydrophobicContact CD2-CD1 3.91Å; W771-L887 HydrophobicContact CD2-CG 4.37Å; W771-L887 HydrophobicContact CE3-CB 4.46Å; W771-L887 HydrophobicContact CE3-CD1 3.65Å; W771-L887 HydrophobicContact CE3-CD2 4.3Å; W771-L887 HydrophobicContact CE3-CG 4.37Å; W771-L887 HydrophobicContact CG-CB 4.03Å; W771-L887 HydrophobicContact CG-CD1 4.2Å; W771-L887 HydrophobicContact CH2-CD2 4.38Å; W771-L887 HydrophobicContact CZ3-CD1 4.26Å; W771-L887 HydrophobicContact CZ3-CD2 4.19Å
772	R	92.7	Very high	89.5	Confident	1 Å²	1	24.7 Å²	24.7	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-62.8	-38.3	176.6	-71.6	171.1	-174.1	-75.3	5.4	111.7	D681 S685 M687 H688 S768 Y769 L770 T774 L775 N881 V884	D681-R772 IonicContact OD1-CZ 2.66Å; D681-R772 IonicContact OD1-NE 3.63Å; D681-R772 PolarHBondContact OD1-NE 3.28Å; D681-R772 IonicContact OD1-NH2 3.08Å; D681-R772 PolarHBondContact OD1-NH2 3.43Å; D681-R772 IonicContact OD2-NH2 3.51Å; D681-R772 PolarHBondContact OD2-NH2 3.1Å; S685-R772 PolarHBondContact OG-NH1 3.33Å; S685-R772 PolarHBondContact OG-NH2 3.43Å; M687-R772 HydrophobicContact CE-CB 4.09Å; M687-R772 HydrophobicContact SD-CB 3.39Å; M687-R772 WeakPolarHBondContact SD-CB 3.22Å; M687-R772 HydrophobicContact SD-CG 4.32Å; H688-R772 PolarHBondContact CE1-O 2.91Å; S768-R772 WeakPolarHBondContact O-CB 3.48Å; S768-R772 WeakPolarHBondContact O-CG 3.48Å; S768-R772 PolarHBondContact O-N 3.41Å; S768-R772 PolarHBondContact OG-NE 3.31Å; Y769-R772 PolarHBondContact O-N 2.95Å; L770-R772 PolarHBondContact O-N 3.42Å; R772-T774 VanDerWaalsContact C-N 3.27Å; R772-T774 PolarHBondContact O-N 3.15Å; R772-L775 WeakPolarHBondContact O-CB 3.19Å; R772-L775 PolarHBondContact O-N 2.68Å; R772-N881 PolarHBondContact NH1-OD1 3.03Å; R772-N881 PolarHBondContact NH2-OD1 3.01Å; R772-V884 HydrophobicContact CG-CB 4.36Å; R772-V884 HydrophobicContact CG-CG1 3.89Å; R772-V884 HydrophobicContact CG-CG2 3.68Å
773	S	91.4	Very high	89.2	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-36.1	177.3	84.3	0	0	0	0	112.3	Y769 L770 W771 L775 I776 Y791	Y769-S773 WeakPolarHBondContact O-CB 3.47Å; Y769-S773 PolarHBondContact O-N 3.15Å; L770-S773 WeakPolarHBondContact O-CB 3.32Å; L770-S773 PolarHBondContact O-N 2.96Å; L770-S773 PolarHBondContact O-OG 2.94Å; W771-S773 VanDerWaalsContact C-N 3.29Å; W771-S773 PolarHBondContact O-N 3.45Å; S773-L775 PolarHBondContact O-N 3.2Å; S773-I776 PolarHBondContact O-N 3.41Å; S773-Y791 PolarHBondContact OG-OH 2.83Å
774	T	90.9	Very high	89	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-69.3	-14.6	176.9	71.4	0	0	0	0	113.6	L770 W771 R772 F824 M856 Q859 H860 S863	L770-T774 VanDerWaalsContact O-CG2 3.29Å; L770-T774 WeakPolarHBondContact O-CG2 3.4Å; L770-T774 PolarHBondContact O-N 2.82Å; W771-T774 PolarHBondContact O-N 2.93Å; W771-T774 PolarHBondContact O-OG1 2.95Å; R772-T774 VanDerWaalsContact C-N 3.27Å; R772-T774 PolarHBondContact O-N 3.15Å; T774-F824 HydrophobicContact CG2-CE1 4.17Å; T774-F824 HydrophobicContact CG2-CE2 4.12Å; T774-F824 HydrophobicContact CG2-CZ 3.47Å; T774-F824 VanDerWaalsContact CG2-CZ 3.47Å; T774-M856 HydrophobicContact CG2-CG 3.53Å; T774-M856 HydrophobicContact CG2-SD 4.45Å; T774-Q859 VanDerWaalsContact OG1-CG 3.25Å; T774-Q859 WeakPolarHBondContact OG1-CG 3.45Å; T774-H860 HydrophobicContact CG2-CB 4.48Å; T774-S863 WeakPolarHBondContact O-CB 3.25Å
775	L	90.7	Very high	88.8	Confident	9 Å²	9	25.4 Å²	25.4	5%	0.047	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-7.6	177.9	-67.3	170.9	0	0	0	113.2	W771 R772 S773 Q859 Y871 T880 Y883 V884	W771-L775 PolarHBondContact O-N 3.11Å; R772-L775 WeakPolarHBondContact O-CB 3.19Å; R772-L775 PolarHBondContact O-N 2.68Å; S773-L775 PolarHBondContact O-N 3.2Å; L775-Q859 HydrophobicContact CD2-CG 4.2Å; L775-Q859 VanDerWaalsContact CD2-NE2 3.34Å; L775-Y871 HydrophobicContact CD2-CD1 4.31Å; L775-Y871 HydrophobicContact CD2-CE1 4.48Å; L775-Y871 PolarHBondContact O-OH 2.59Å; L775-T880 HydrophobicContact CD1-CG2 3.94Å; L775-Y883 HydrophobicContact CD1-CD1 3.95Å; L775-Y883 HydrophobicContact CD1-CE1 4.39Å; L775-Y883 HydrophobicContact CD2-CD1 4.13Å; L775-Y883 HydrophobicContact CD2-CE1 3.94Å; L775-V884 HydrophobicContact CD1-CG2 3.6Å
776	I	89.3	Confident	88.5	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.026	13%	0.133	C	C	.	.	S	Bend	trans	-73.1	129.4	173.5	-67.4	171.1	0	0	0	109.2	M687 Y691 S773 S778 V783 L787 S863	M687-I776 HydrophobicContact CE-CD1 3.41Å; M687-I776 VanDerWaalsContact CE-CD1 3.41Å; M687-I776 HydrophobicContact CE-CG1 4.4Å; M687-I776 HydrophobicContact CG-CD1 4.33Å; Y691-I776 HydrophobicContact CD1-CD1 4.19Å; Y691-I776 HydrophobicContact CD1-CG2 3.71Å; Y691-I776 HydrophobicContact CD2-CD1 3.51Å; Y691-I776 HydrophobicContact CE1-CD1 4.48Å; Y691-I776 HydrophobicContact CE1-CG2 4.48Å; Y691-I776 HydrophobicContact CE2-CD1 3.86Å; Y691-I776 HydrophobicContact CG-CD1 3.69Å; Y691-I776 HydrophobicContact CG-CG1 4.32Å; Y691-I776 HydrophobicContact CG-CG2 3.86Å; S773-I776 PolarHBondContact O-N 3.41Å; I776-S778 PolarHBondContact O-N 3.47Å; I776-V783 HydrophobicContact CG2-CG1 4.2Å; I776-L787 HydrophobicContact CB-CD1 3.9Å; I776-L787 HydrophobicContact CD1-CD1 3.59Å; I776-L787 HydrophobicContact CG1-CD1 4.31Å; I776-L787 HydrophobicContact CG2-CD1 4.04Å; I776-S863 VanDerWaalsContact O-CB 3.26Å; I776-S863 WeakPolarHBondContact O-CB 3.3Å; I776-S863 PolarHBondContact O-OG 2.85Å
777	R	87.1	Confident	88.3	Confident	20 Å²	20	26.3 Å²	26.3	8%	0.075	13%	0.134	C	C	.	.			trans	-65.1	116	177.7	-162.7	62	160	-177.5	-12.5	110.1	F862 S863 A865 P866 D867 Y871	R777-F862 PolarHBondContact NH1-O 3.25Å; R777-S863 WeakPolarHBondContact CD-O 3.33Å; R777-A865 PolarHBondContact NE-O 2.8Å; R777-A865 PolarHBondContact NH1-O 3.44Å; R777-A865 VanDerWaalsContact NH1-O 3.14Å; R777-A865 PolarHBondContact NH2-O 3Å; R777-P866 PolarHBondContact NH2-O 3.37Å; R777-D867 IonicContact CZ-OD1 3.03Å; R777-D867 IonicContact NE-OD1 3.29Å; R777-D867 PolarHBondContact NE-OD1 3.49Å; R777-D867 IonicContact NH2-OD1 3.42Å; R777-D867 PolarHBondContact NH2-OD1 3.19Å; R777-Y871 PolarHBondContact N-OH 3.1Å
778	S	84	Confident	88.2	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.007	13%	0.134	C	C	.	.			trans	-124	29.4	-166.7	75.4	0	0	0	0	113.6	I776 K780 R784 H860 S863 R864	I776-S778 PolarHBondContact O-N 3.47Å; S778-K780 VanDerWaalsContact C-N 3.27Å; S778-K780 PolarHBondContact O-N 3.46Å; S778-R784 PolarHBondContact O-NH1 3.44Å; S778-H860 PolarHBondContact OG-CE1 3.49Å; S778-S863 WeakPolarHBondContact CB-OG 3.4Å; S778-S863 PolarHBondContact N-O 3.12Å; S778-S863 PolarHBondContact OG-OG 3.4Å; S778-R864 VanDerWaalsContact OG-CG 3.32Å; S778-R864 WeakPolarHBondContact OG-CG 3.34Å
779	S	80.1	Confident	88	Confident	65 Å²	65	28.3 Å²	28.3	46%	0.455	16%	0.155	S	C	.	.			trans	-57.8	-39.1	177.3	58.2	0	0	0	0	112.2	R784	S779-R784 PolarHBondContact O-NH1 2.95Å
780	K	82.9	Confident	87.9	Confident	103 Å²	103	28.4 Å²	28.4	45%	0.448	16%	0.156	S	C	.	.	S	Bend	trans	-82.3	135.6	176.2	-63.1	-178.6	-178.3	179.7	0	111.9	Q695 S778 S782 V783 R784	Q695-K780 PolarHBondContact O-NZ 3.35Å; S778-K780 VanDerWaalsContact C-N 3.27Å; S778-K780 PolarHBondContact O-N 3.46Å; K780-S782 VanDerWaalsContact C-N 3.32Å; K780-S782 PolarHBondContact O-N 3.15Å; K780-V783 HydrophobicContact CB-CG2 4.13Å; K780-V783 PolarHBondContact O-N 3.32Å; K780-R784 PolarHBondContact O-N 3.48Å
781	E	82.7	Confident	87.9	Confident	127 Å²	127	28.6 Å²	28.6	59%	0.593	16%	0.156	S	C	*	.	H	α-helix	trans	-63.1	-36.3	176.8	-172.4	176.1	172.9	0	0	113	V783 R784 L785	E781-V783 VanDerWaalsContact C-N 3.25Å; E781-V783 PolarHBondContact O-N 3.35Å; E781-R784 PolarHBondContact O-N 3.23Å; E781-R784 VanDerWaalsContact O-N 3.09Å; E781-L785 HydrophobicContact CG-CD1 4.26Å; E781-L785 HydrophobicContact CG-CG 4.4Å; E781-L785 PolarHBondContact O-N 2.95Å
782	S	82.5	Confident	87.7	Confident	28 Å²	28	35 Å²	35	20%	0.196	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-37	176.6	56.8	0	0	0	0	112.9	K780 K786	K780-S782 VanDerWaalsContact C-N 3.32Å; K780-S782 PolarHBondContact O-N 3.15Å; S782-K786 WeakPolarHBondContact O-CB 3.29Å; S782-K786 PolarHBondContact O-N 3.39Å; S782-K786 VanDerWaalsContact O-N 3.09Å
783	V	85.8	Confident	87.6	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-70.3	-39.5	177.1	178.4	0	0	0	0	110.7	Y691 I776 K780 E781 K786 L787	Y691-V783 HydrophobicContact CD1-CG1 3.94Å; Y691-V783 HydrophobicContact CE1-CG1 4.19Å; I776-V783 HydrophobicContact CG2-CG1 4.2Å; K780-V783 HydrophobicContact CB-CG2 4.13Å; K780-V783 PolarHBondContact O-N 3.32Å; E781-V783 VanDerWaalsContact C-N 3.25Å; E781-V783 PolarHBondContact O-N 3.35Å; V783-K786 PolarHBondContact O-N 2.91Å; V783-L787 VanDerWaalsContact O-CB 3.31Å; V783-L787 WeakPolarHBondContact O-CB 3.49Å; V783-L787 PolarHBondContact O-N 3.37Å
784	R	87.5	Confident	87.7	Confident	29 Å²	29	37.5 Å²	37.5	11%	0.109	20%	0.196	C	C	.	.	H	α-helix	trans	-65.1	-43.9	176.9	-68.2	-169	-51.3	-88.3	0.6	112.2	S778 S779 K780 E781 K786 L787 A788 L828	S778-R784 PolarHBondContact O-NH1 3.44Å; S779-R784 PolarHBondContact O-NH1 2.95Å; K780-R784 PolarHBondContact O-N 3.48Å; E781-R784 PolarHBondContact O-N 3.23Å; E781-R784 VanDerWaalsContact O-N 3.09Å; R784-K786 VanDerWaalsContact C-N 3.35Å; R784-L787 PolarHBondContact O-N 2.9Å; R784-A788 WeakPolarHBondContact O-CB 3.39Å; R784-A788 PolarHBondContact O-N 2.92Å; R784-L828 VanDerWaalsContact CD-O 3.23Å; R784-L828 WeakPolarHBondContact CD-O 3.27Å; R784-L828 PolarHBondContact NE-O 3Å
785	L	85.5	Confident	87.7	Confident	97 Å²	97	39 Å²	39	51%	0.508	20%	0.203	S	C	.	.	H	α-helix	trans	-63.8	-41	176.8	-70.3	174.4	0	0	0	111.8	E781 A788 A789	E781-L785 HydrophobicContact CG-CD1 4.26Å; E781-L785 HydrophobicContact CG-CG 4.4Å; E781-L785 PolarHBondContact O-N 2.95Å; L785-A788 PolarHBondContact O-N 2.82Å; L785-A789 PolarHBondContact O-N 3.46Å
786	K	87.2	Confident	87.7	Confident	21 Å²	21	42 Å²	42	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-61.6	-48.2	174.5	177.7	54.1	172.3	161.7	0	111.5	Y691 L702 S704 S706 S782 V783 R784 A788 A789 D790	Y691-K786 HydrophobicContact CE1-CG 4.27Å; L702-K786 HydrophobicContact CD2-CB 4.15Å; L702-K786 HydrophobicContact CD2-CG 3.94Å; L702-K786 WeakPolarHBondContact O-CD 3.46Å; L702-K786 WeakPolarHBondContact O-CE 3.5Å; S704-K786 PolarHBondContact O-NZ 3.39Å; S706-K786 VanDerWaalsContact OG-CE 3.24Å; S706-K786 WeakPolarHBondContact OG-CE 3.23Å; S706-K786 PolarHBondContact OG-NZ 2.92Å; S706-K786 VanDerWaalsContact OG-NZ 3.16Å; S782-K786 WeakPolarHBondContact O-CB 3.29Å; S782-K786 PolarHBondContact O-N 3.39Å; S782-K786 VanDerWaalsContact O-N 3.09Å; V783-K786 PolarHBondContact O-N 2.91Å; R784-K786 VanDerWaalsContact C-N 3.35Å; K786-A788 VanDerWaalsContact C-N 3.32Å; K786-A788 PolarHBondContact O-N 3.1Å; K786-A789 WeakPolarHBondContact O-CB 3.5Å; K786-A789 PolarHBondContact O-N 3.45Å; K786-A789 VanDerWaalsContact O-N 3.13Å; K786-D790 WeakPolarHBondContact CE-OD1 3.1Å; K786-D790 IonicContact NZ-OD1 3.07Å; K786-D790 PolarHBondContact NZ-OD1 2.89Å; K786-D790 PolarHBondContact O-N 2.84Å
787	L	89.2	Confident	87.8	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-39.1	178.7	-165.1	148.7	0	0	0	111.3	Y691 I776 V783 R784 A789 D790 Y791 L828	Y691-L787 HydrophobicContact CE1-CB 4.19Å; Y691-L787 HydrophobicContact CE1-CD1 4.3Å; Y691-L787 WeakPolarHBondContact OH-CA 3.45Å; I776-L787 HydrophobicContact CB-CD1 3.9Å; I776-L787 HydrophobicContact CD1-CD1 3.59Å; I776-L787 HydrophobicContact CG1-CD1 4.31Å; I776-L787 HydrophobicContact CG2-CD1 4.04Å; V783-L787 VanDerWaalsContact O-CB 3.31Å; V783-L787 WeakPolarHBondContact O-CB 3.49Å; V783-L787 PolarHBondContact O-N 3.37Å; R784-L787 PolarHBondContact O-N 2.9Å; L787-A789 PolarHBondContact O-N 2.8Å; L787-D790 PolarHBondContact O-N 3.49Å; L787-Y791 HydrophobicContact CD2-CD2 4.02Å; L787-Y791 HydrophobicContact CD2-CE2 3.47Å; L787-Y791 VanDerWaalsContact CD2-CE2 3.47Å; L787-Y791 HydrophobicContact CG-CE2 4.45Å; L787-Y791 VanDerWaalsContact O-CD2 3.22Å; L787-Y791 WeakPolarHBondContact O-CD2 3.38Å; L787-Y791 PolarHBondContact O-N 2.93Å; L787-L828 HydrophobicContact CB-CD1 4.48Å; L787-L828 HydrophobicContact CD2-CD1 3.16Å; L787-L828 HydrophobicContact CD2-CD2 3.84Å; L787-L828 HydrophobicContact CD2-CG 4.13Å; L787-L828 HydrophobicContact CG-CD1 4.42Å
788	A	89.9	Confident	88.1	Confident	21 Å²	21	40.9 Å²	40.9	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-36.9	173.6	0	0	0	0	0	113.3	R784 L785 K786 P825 L828	R784-A788 WeakPolarHBondContact O-CB 3.39Å; R784-A788 PolarHBondContact O-N 2.92Å; L785-A788 PolarHBondContact O-N 2.82Å; K786-A788 VanDerWaalsContact C-N 3.32Å; K786-A788 PolarHBondContact O-N 3.1Å; A788-P825 HydrophobicContact CB-CB 4.3Å; A788-L828 HydrophobicContact CB-CD1 4.1Å
789	A	88.5	Confident	88.3	Confident	56 Å²	56	44.2 Å²	44.2	46%	0.463	23%	0.231	S	C	.	.	H	α-helix	trans	-67.8	-40.5	173.8	0	0	0	0	0	112	L785 K786 L787 Y791 K792 E793	L785-A789 PolarHBondContact O-N 3.46Å; K786-A789 WeakPolarHBondContact O-CB 3.5Å; K786-A789 PolarHBondContact O-N 3.45Å; K786-A789 VanDerWaalsContact O-N 3.13Å; L787-A789 PolarHBondContact O-N 2.8Å; A789-Y791 VanDerWaalsContact C-N 3.25Å; A789-Y791 PolarHBondContact O-N 3.03Å; A789-K792 PolarHBondContact O-N 3.42Å; A789-E793 PolarHBondContact O-N 3.29Å
790	D	92	Very high	88.7	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-27.2	-179.5	-82.5	12	0	0	0	112.9	Y691 S706 Y708 L709 K786 L787 K792 E793 F794	Y691-D790 PolarHBondContact OH-OD2 2.93Å; S706-D790 WeakPolarHBondContact CB-OD2 3.35Å; S706-D790 PolarHBondContact OG-OD1 3.26Å; S706-D790 PolarHBondContact OG-OD2 2.87Å; Y708-D790 PolarHBondContact OH-OD2 3.22Å; L709-D790 HydrophobicContact CD1-CB 3.67Å; K786-D790 WeakPolarHBondContact CE-OD1 3.1Å; K786-D790 IonicContact NZ-OD1 3.07Å; K786-D790 PolarHBondContact NZ-OD1 2.89Å; K786-D790 PolarHBondContact O-N 2.84Å; L787-D790 PolarHBondContact O-N 3.49Å; D790-K792 VanDerWaalsContact C-N 3.33Å; D790-K792 PolarHBondContact O-N 3.23Å; D790-E793 PolarHBondContact O-N 2.78Å; D790-F794 WeakPolarHBondContact O-CB 3.43Å; D790-F794 PolarHBondContact O-N 3.34Å
791	Y	92.4	Very high	88.9	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-41.1	173	-93.7	-116.9	0	0	0	113.3	Y769 L770 S773 L787 A789 F794 E795 L821 F824 P825 L828	Y769-Y791 HydrophobicContact CE1-CD1 4.12Å; Y769-Y791 AromaticContact CE1-CD2 3.68Å; Y769-Y791 HydrophobicContact CE1-CD2 3.68Å; Y769-Y791 HydrophobicContact CE1-CE1 4.09Å; Y769-Y791 AromaticContact CE1-CE2 3.62Å; Y769-Y791 HydrophobicContact CE1-CE2 3.62Å; Y769-Y791 AromaticContact CE1-CG 3.94Å; Y769-Y791 HydrophobicContact CE1-CG 3.94Å; Y769-Y791 AromaticContact CE1-CZ 3.85Å; Y769-Y791 AromaticContact CZ-CD2 3.94Å; Y769-Y791 WeakPolarHBondContact OH-CD2 3.35Å; L770-Y791 HydrophobicContact CD2-CE1 3.7Å; S773-Y791 PolarHBondContact OG-OH 2.83Å; L787-Y791 HydrophobicContact CD2-CD2 4.02Å; L787-Y791 HydrophobicContact CD2-CE2 3.47Å; L787-Y791 VanDerWaalsContact CD2-CE2 3.47Å; L787-Y791 HydrophobicContact CG-CE2 4.45Å; L787-Y791 VanDerWaalsContact O-CD2 3.22Å; L787-Y791 WeakPolarHBondContact O-CD2 3.38Å; L787-Y791 PolarHBondContact O-N 2.93Å; A789-Y791 VanDerWaalsContact C-N 3.25Å; A789-Y791 PolarHBondContact O-N 3.03Å; Y791-F794 PolarHBondContact O-N 3.27Å; Y791-E795 PolarHBondContact O-N 2.66Å; Y791-L821 HydrophobicContact CD1-CD1 3.6Å; Y791-L821 HydrophobicContact CD1-CG 4.24Å; Y791-L821 WeakPolarHBondContact CD1-O 3.32Å; Y791-L821 HydrophobicContact CE1-CD1 3.71Å; Y791-F824 HydrophobicContact CE1-CB 3.66Å; Y791-F824 AromaticContact CE1-CD1 4Å; Y791-F824 HydrophobicContact CE1-CD1 4Å; Y791-F824 HydrophobicContact CE1-CG 4.19Å; Y791-F824 HydrophobicContact CE2-CD1 4.33Å; Y791-F824 AromaticContact CZ-CD1 3.52Å; Y791-F824 WeakPolarHBondContact OH-CD1 3.45Å; Y791-F824 WeakPolarHBondContact OH-CE1 3.15Å; Y791-P825 HydrophobicContact CD1-CG 3.61Å; Y791-P825 HydrophobicContact CE1-CG 4.42Å; Y791-P825 HydrophobicContact CG-CG 3.76Å; Y791-L828 HydrophobicContact CE2-CD1 4.3Å
792	K	88.8	Confident	89.1	Confident	139 Å²	139	32.4 Å²	32.4	60%	0.604	17%	0.174	S	C	*	.	H	α-helix	trans	-70	-38.5	177.8	-172.3	176.4	179.5	-179.1	0	111.3	A789 D790 E795 L796	A789-K792 PolarHBondContact O-N 3.42Å; D790-K792 VanDerWaalsContact C-N 3.33Å; D790-K792 PolarHBondContact O-N 3.23Å; K792-E795 PolarHBondContact O-N 2.79Å; K792-L796 WeakPolarHBondContact O-CG 3.33Å; K792-L796 PolarHBondContact O-N 3.04Å; K792-L796 VanDerWaalsContact O-N 3.13Å
793	E	90.5	Very high	89.2	Confident	53 Å²	53	31.4 Å²	31.4	25%	0.248	17%	0.167	C	C	.	.	H	α-helix	trans	-69.4	-34	175.7	-68	-69.3	134.1	0	0	111.6	K705 L709 A789 D790 L796 A797	K705-E793 IonicContact NZ-OE1 3.86Å; K705-E793 IonicContact NZ-OE2 2.75Å; K705-E793 PolarHBondContact NZ-OE2 3.32Å; L709-E793 HydrophobicContact CD1-CB 3.79Å; A789-E793 PolarHBondContact O-N 3.29Å; D790-E793 PolarHBondContact O-N 2.78Å; E793-L796 PolarHBondContact O-N 3.23Å; E793-A797 WeakPolarHBondContact O-CB 3.46Å; E793-A797 PolarHBondContact O-N 2.91Å
794	F	93.7	Very high	88.8	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-44.4	172.3	177.5	-103.5	0	0	0	112.1	L684 L709 L712 V766 Y769 D790 Y791 L796 A797 L798 L821	L684-F794 HydrophobicContact CD1-CE2 4.44Å; L684-F794 HydrophobicContact CD2-CD2 4.42Å; L684-F794 HydrophobicContact CD2-CE2 4.01Å; L709-F794 HydrophobicContact CD2-CB 3.88Å; L709-F794 HydrophobicContact CD2-CD2 4.18Å; L712-F794 HydrophobicContact CD2-CD2 3.59Å; L712-F794 HydrophobicContact CD2-CE2 3.63Å; V766-F794 HydrophobicContact CG2-CE1 4.19Å; Y769-F794 HydrophobicContact CD1-CB 4.48Å; Y769-F794 AromaticContact CD1-CD1 3.45Å; Y769-F794 HydrophobicContact CD1-CD1 3.45Å; Y769-F794 VanDerWaalsContact CD1-CD1 3.45Å; Y769-F794 HydrophobicContact CD1-CD2 4.29Å; Y769-F794 AromaticContact CD1-CE1 3.6Å; Y769-F794 HydrophobicContact CD1-CE1 3.6Å; Y769-F794 HydrophobicContact CD1-CE2 4.43Å; Y769-F794 AromaticContact CD1-CG 3.81Å; Y769-F794 HydrophobicContact CD1-CG 3.81Å; Y769-F794 HydrophobicContact CD1-CZ 4.1Å; Y769-F794 HydrophobicContact CD2-CD1 4.37Å; Y769-F794 AromaticContact CD2-CD2 3.71Å; Y769-F794 HydrophobicContact CD2-CD2 3.71Å; Y769-F794 HydrophobicContact CD2-CE1 4.46Å; Y769-F794 AromaticContact CD2-CE2 3.84Å; Y769-F794 HydrophobicContact CD2-CE2 3.84Å; Y769-F794 AromaticContact CD2-CG 3.99Å; Y769-F794 HydrophobicContact CD2-CG 3.99Å; Y769-F794 HydrophobicContact CD2-CZ 4.21Å; Y769-F794 HydrophobicContact CE1-CB 3.98Å; Y769-F794 AromaticContact CE1-CD1 3.74Å; Y769-F794 HydrophobicContact CE1-CD1 3.74Å; Y769-F794 HydrophobicContact CE1-CE1 4.36Å; Y769-F794 AromaticContact CE1-CG 3.82Å; Y769-F794 HydrophobicContact CE1-CG 3.82Å; Y769-F794 HydrophobicContact CE2-CB 4.2Å; Y769-F794 AromaticContact CE2-CD2 3.97Å; Y769-F794 HydrophobicContact CE2-CD2 3.97Å; Y769-F794 HydrophobicContact CE2-CG 4.01Å; Y769-F794 AromaticContact CG-CD1 3.78Å; Y769-F794 HydrophobicContact CG-CD1 3.78Å; Y769-F794 AromaticContact CG-CD2 3.87Å; Y769-F794 HydrophobicContact CG-CD2 3.87Å; Y769-F794 AromaticContact CG-CE1 3.64Å; Y769-F794 HydrophobicContact CG-CE1 3.64Å; Y769-F794 AromaticContact CG-CE2 3.76Å; Y769-F794 HydrophobicContact CG-CE2 3.76Å; Y769-F794 AromaticContact CG-CG 3.88Å; Y769-F794 HydrophobicContact CG-CG 3.88Å; Y769-F794 AromaticContact CG-CZ 3.63Å; Y769-F794 HydrophobicContact CG-CZ 3.63Å; Y769-F794 AromaticContact CZ-CG 3.91Å; D790-F794 WeakPolarHBondContact O-CB 3.43Å; D790-F794 PolarHBondContact O-N 3.34Å; Y791-F794 PolarHBondContact O-N 3.27Å; F794-L796 VanDerWaalsContact C-N 3.29Å; F794-L796 PolarHBondContact O-N 3.4Å; F794-A797 WeakPolarHBondContact O-CB 3.3Å; F794-A797 PolarHBondContact O-N 3.41Å; F794-A797 VanDerWaalsContact O-N 3.11Å; F794-L798 HydrophobicContact CD1-CD1 4.5Å; F794-L798 HydrophobicContact CE1-CD1 3.75Å; F794-L798 HydrophobicContact CE1-CG 4.47Å; F794-L798 HydrophobicContact CE2-CD1 4.36Å; F794-L798 HydrophobicContact CE2-CG 4.43Å; F794-L798 HydrophobicContact CZ-CD1 3.66Å; F794-L798 HydrophobicContact CZ-CG 4.21Å; F794-L798 PolarHBondContact O-N 2.88Å; F794-L821 HydrophobicContact CD1-CD1 3.96Å; F794-L821 HydrophobicContact CD1-CD2 4.16Å; F794-L821 HydrophobicContact CE1-CD1 4.21Å; F794-L821 HydrophobicContact CE1-CD2 4.35Å
795	E	91.5	Very high	88.3	Confident	31 Å²	31	38.9 Å²	38.9	15%	0.145	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-45.9	173	-176.2	-178.1	177.7	0	0	111	Y791 K792 A797 L798 M799 L810 Y818 R822	Y791-E795 PolarHBondContact O-N 2.66Å; K792-E795 PolarHBondContact O-N 2.79Å; E795-A797 VanDerWaalsContact C-N 3.32Å; E795-A797 PolarHBondContact O-N 2.95Å; E795-L798 PolarHBondContact O-N 3.06Å; E795-M799 WeakPolarHBondContact O-CG 3.28Å; E795-M799 PolarHBondContact O-N 2.58Å; E795-L810 HydrophobicContact CG-CD1 4.11Å; E795-Y818 HydrophobicContact CG-CE2 4.26Å; E795-Y818 WeakPolarHBondContact OE1-CE2 3.16Å; E795-Y818 PolarHBondContact OE1-OH 3.09Å; E795-R822 IonicContact OE1-NH1 3.86Å; E795-R822 IonicContact OE2-CZ 3.18Å; E795-R822 IonicContact OE2-NH1 3.99Å; E795-R822 PolarHBondContact OE2-NH1 3.18Å
796	L	90.3	Very high	87.6	Confident	74 Å²	74	37.8 Å²	37.8	39%	0.387	20%	0.201	S	C	.	.	H	α-helix	trans	-64.7	-34.3	176.3	-69	174.1	0	0	0	112.8	K792 E793 F794 L798 M799	K792-L796 WeakPolarHBondContact O-CG 3.33Å; K792-L796 PolarHBondContact O-N 3.04Å; K792-L796 VanDerWaalsContact O-N 3.13Å; E793-L796 PolarHBondContact O-N 3.23Å; F794-L796 VanDerWaalsContact C-N 3.29Å; F794-L796 PolarHBondContact O-N 3.4Å; L796-L798 VanDerWaalsContact C-N 3.31Å; L796-L798 PolarHBondContact O-N 2.87Å; L796-M799 HydrophobicContact CD2-SD 4.49Å; L796-M799 PolarHBondContact O-N 3.17Å
797	A	92.3	Very high	87	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.2	-27.9	179.1	0	0	0	0	0	112.9	L712 Q713 T716 E793 F794 E795 P800	L712-A797 HydrophobicContact CB-CB 4.44Å; L712-A797 HydrophobicContact CD2-CB 3.87Å; L712-A797 HydrophobicContact CG-CB 3.99Å; Q713-A797 HydrophobicContact CB-CB 4.09Å; T716-A797 WeakPolarHBondContact CB-O 3.29Å; T716-A797 WeakPolarHBondContact CG2-O 3.39Å; T716-A797 PolarHBondContact OG1-O 3.35Å; E793-A797 WeakPolarHBondContact O-CB 3.46Å; E793-A797 PolarHBondContact O-N 2.91Å; F794-A797 WeakPolarHBondContact O-CB 3.3Å; F794-A797 PolarHBondContact O-N 3.41Å; F794-A797 VanDerWaalsContact O-N 3.11Å; E795-A797 VanDerWaalsContact C-N 3.32Å; E795-A797 PolarHBondContact O-N 2.95Å; A797-P800 WeakPolarHBondContact O-CD 3.46Å
798	L	92.3	Very high	86.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-85.7	-18.1	176.8	-65.7	-176.9	0	0	0	113.7	V766 F794 E795 L796 P800 L801 L810	V766-L798 HydrophobicContact CG2-CD1 3.81Å; F794-L798 HydrophobicContact CD1-CD1 4.5Å; F794-L798 HydrophobicContact CE1-CD1 3.75Å; F794-L798 HydrophobicContact CE1-CG 4.47Å; F794-L798 HydrophobicContact CE2-CD1 4.36Å; F794-L798 HydrophobicContact CE2-CG 4.43Å; F794-L798 HydrophobicContact CZ-CD1 3.66Å; F794-L798 HydrophobicContact CZ-CG 4.21Å; F794-L798 PolarHBondContact O-N 2.88Å; E795-L798 PolarHBondContact O-N 3.06Å; L796-L798 VanDerWaalsContact C-N 3.31Å; L796-L798 PolarHBondContact O-N 2.87Å; L798-P800 VanDerWaalsContact C-N 3.33Å; L798-L801 PolarHBondContact O-N 2.92Å; L798-L810 HydrophobicContact CB-CD1 4.37Å
799	M	88.9	Confident	86.4	Confident	72 Å²	72	42.2 Å²	42.2	36%	0.355	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-53.3	-37.3	-178.1	-74.8	-140.9	76.8	0	0	115.3	E795 L796 L801 C802 P804	E795-M799 WeakPolarHBondContact O-CG 3.28Å; E795-M799 PolarHBondContact O-N 2.58Å; L796-M799 HydrophobicContact CD2-SD 4.49Å; L796-M799 PolarHBondContact O-N 3.17Å; M799-L801 PolarHBondContact O-N 3.36Å; M799-L801 VanDerWaalsContact O-N 3.15Å; M799-C802 PolarHBondContact O-N 3.04Å; M799-C802 VanDerWaalsContact O-O 3.05Å; M799-P804 HydrophobicContact CE-CB 4.35Å; M799-P804 HydrophobicContact CE-CG 4.14Å
800	P	88.3	Confident	86.3	Confident	37 Å²	37	40 Å²	40	24%	0.24	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-60.1	-22.2	177.6	-26.3	36.1	0	0	0	115.1	R720 A797 L798	R720-P800 WeakPolarHBondContact CB-O 3.05Å; R720-P800 VanDerWaalsContact CD-O 3.25Å; R720-P800 WeakPolarHBondContact CD-O 3.48Å; R720-P800 VanDerWaalsContact CG-O 3.3Å; R720-P800 WeakPolarHBondContact CG-O 3.2Å; A797-P800 WeakPolarHBondContact O-CD 3.46Å; L798-P800 VanDerWaalsContact C-N 3.33Å
801	L	87.2	Confident	86	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-82	-23.3	176.4	-59.4	178.8	0	0	0	112.2	I680 T716 V719 Q755 L758 L762 L798 M799	I680-L801 HydrophobicContact CD1-CD1 4.25Å; T716-L801 HydrophobicContact CG2-CD1 3.99Å; T716-L801 HydrophobicContact CG2-CG 4.14Å; V719-L801 HydrophobicContact CB-CD2 4.2Å; V719-L801 HydrophobicContact CG1-CD2 3.85Å; Q755-L801 PolarHBondContact NE2-O 2.86Å; L758-L801 HydrophobicContact CD1-CB 4.41Å; L758-L801 VanDerWaalsContact CD1-O 3.3Å; L758-L801 WeakPolarHBondContact CD1-O 3.35Å; L762-L801 HydrophobicContact CD2-CD1 4.23Å; L798-L801 PolarHBondContact O-N 2.92Å; M799-L801 PolarHBondContact O-N 3.36Å; M799-L801 VanDerWaalsContact O-N 3.15Å
802	C	87.6	Confident	85.6	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.041	26%	0.256	C	S	.	.	S	Bend	trans	-89.8	153.3	177.8	-60.6	0	0	0	0	110.7	M799 P804 L810	M799-C802 PolarHBondContact O-N 3.04Å; M799-C802 VanDerWaalsContact O-O 3.05Å; C802-P804 VanDerWaalsContact C-CD 3.49Å; C802-P804 WeakPolarHBondContact O-CD 3.1Å; C802-L810 VanDerWaalsContact SG-CD2 3.54Å
803	S	83.9	Confident	85.4	Confident	7 Å²	7	43.2 Å²	43.2	5%	0.049	23%	0.23	C	C	.	.			trans	-113.4	78.8	175.9	-78.2	0	0	0	0	111.4	R720 E751 N805 Y806 Y808	R720-S803 PolarHBondContact NH2-OG 2.99Å; R720-S803 VanDerWaalsContact NH2-OG 3.1Å; E751-S803 VanDerWaalsContact CD-OG 3.29Å; E751-S803 WeakPolarHBondContact OE1-CB 3.33Å; E751-S803 PolarHBondContact OE1-OG 3.41Å; S803-N805 PolarHBondContact O-N 2.79Å; S803-Y806 PolarHBondContact O-N 2.87Å; S803-Y806 VanDerWaalsContact O-N 3.08Å; S803-Y808 CarbonylContact C-O 3.51Å; S803-Y808 VanDerWaalsContact C-O 3.32Å; S803-Y808 PolarHBondContact O-N 3.23Å
804	P	76.4	Confident	85.3	Confident	57 Å²	57	41 Å²	41	37%	0.37	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-62.8	-28.6	-175.4	25.4	-34.7	0	0	0	112.7	M799 C802 Y806 G807 T809	M799-P804 HydrophobicContact CE-CB 4.35Å; M799-P804 HydrophobicContact CE-CG 4.14Å; C802-P804 VanDerWaalsContact C-CD 3.49Å; C802-P804 WeakPolarHBondContact O-CD 3.1Å; P804-Y806 PolarHBondContact O-N 3.06Å; P804-G807 PolarHBondContact O-N 3.26Å; P804-T809 HydrophobicContact CB-CG2 4.25Å
805	N	77	Confident	85	Confident	132 Å²	132	44.1 Å²	44.1	71%	0.706	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-58.1	-21.4	176.9	-65.4	-15.9	0	0	0	113.4	S803	S803-N805 PolarHBondContact O-N 2.79Å
806	Y	71.1	Confident	84.7	Confident	73 Å²	73	49.6 Å²	49.6	29%	0.286	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-113.8	17.6	-179.6	-49.3	-53.6	0	0	0	112.4	P730 E751 S803 P804 Y808	P730-Y806 HydrophobicContact CG-CD1 3.48Å; P730-Y806 VanDerWaalsContact CG-CD1 3.48Å; P730-Y806 HydrophobicContact CG-CD2 3.72Å; P730-Y806 HydrophobicContact CG-CE1 3.36Å; P730-Y806 HydrophobicContact CG-CE2 3.62Å; P730-Y806 HydrophobicContact CG-CG 3.66Å; P730-Y806 VanDerWaalsContact CG-CZ 3.42Å; E751-Y806 HydrophobicContact CG-CD2 4.25Å; E751-Y806 HydrophobicContact CG-CE2 4.44Å; S803-Y806 PolarHBondContact O-N 2.87Å; S803-Y806 VanDerWaalsContact O-N 3.08Å; P804-Y806 PolarHBondContact O-N 3.06Å; Y806-Y808 VanDerWaalsContact C-N 3.31Å; Y806-Y808 PolarHBondContact O-N 3.15Å
807	G	74.9	Confident	84.6	Confident	28 Å²	28	46.5 Å²	46.5	29%	0.289	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	5	176.7	0	0	0	0	0	115	P804 T809 K812	P804-G807 PolarHBondContact O-N 3.26Å; G807-T809 PolarHBondContact O-N 3.16Å; G807-K812 VanDerWaalsContact O-CD 3.29Å; G807-K812 WeakPolarHBondContact O-CD 3.14Å; G807-K812 WeakPolarHBondContact O-CE 3.04Å; G807-K812 PolarHBondContact O-NZ 3.44Å; G807-K812 VanDerWaalsContact O-NZ 3.1Å
808	Y	81.4	Confident	84.5	Confident	62 Å²	62	48.5 Å²	48.5	24%	0.243	26%	0.258	C	S	.	.			trans	-88.7	93.6	172.6	-63.1	-78.5	0	0	0	110	F752 Q755 S803 Y806 L813	F752-Y808 AromaticContact CD1-CE2 3.5Å; F752-Y808 HydrophobicContact CD1-CE2 3.5Å; F752-Y808 AromaticContact CD1-CZ 3.92Å; F752-Y808 AromaticContact CE1-CE2 3.65Å; F752-Y808 HydrophobicContact CE1-CE2 3.65Å; F752-Y808 HydrophobicContact CG-CE2 4.47Å; Q755-Y808 HydrophobicContact CB-CD1 3.75Å; Q755-Y808 HydrophobicContact CB-CD2 4.23Å; Q755-Y808 HydrophobicContact CB-CE1 3.9Å; Q755-Y808 HydrophobicContact CB-CE2 4.39Å; Q755-Y808 HydrophobicContact CB-CG 3.9Å; Q755-Y808 HydrophobicContact CG-CD1 4.12Å; Q755-Y808 HydrophobicContact CG-CD2 3.78Å; Q755-Y808 HydrophobicContact CG-CE2 4.22Å; Q755-Y808 HydrophobicContact CG-CG 3.71Å; S803-Y808 CarbonylContact C-O 3.51Å; S803-Y808 VanDerWaalsContact C-O 3.32Å; S803-Y808 PolarHBondContact O-N 3.23Å; Y806-Y808 VanDerWaalsContact C-N 3.31Å; Y806-Y808 PolarHBondContact O-N 3.15Å; Y808-L813 HydrophobicContact CD1-CD2 3.74Å; Y808-L813 HydrophobicContact CD1-CG 4.45Å; Y808-L813 HydrophobicContact CE1-CD2 4.5Å
809	T	85.7	Confident	84.4	Confident	48 Å²	48	52.2 Å²	52.2	29%	0.294	28%	0.275	S	S	.	.			trans	-107.7	159	170.6	55.7	0	0	0	0	109.4	P804 G807 S811 K812 L813	P804-T809 HydrophobicContact CB-CG2 4.25Å; G807-T809 PolarHBondContact O-N 3.16Å; T809-S811 PolarHBondContact O-N 3.3Å; T809-K812 PolarHBondContact O-N 3.12Å; T809-L813 PolarHBondContact O-N 2.7Å
810	L	85.7	Confident	84.4	Confident	9 Å²	9	49.7 Å²	49.7	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-51.7	-41.4	177	-69.7	171	0	0	0	111.8	L762 E795 L798 C802 K812 L813 I814 Y818	L762-L810 HydrophobicContact CD1-CD2 4.17Å; L762-L810 HydrophobicContact CD2-CD2 4.49Å; E795-L810 HydrophobicContact CG-CD1 4.11Å; L798-L810 HydrophobicContact CB-CD1 4.37Å; C802-L810 VanDerWaalsContact SG-CD2 3.54Å; L810-K812 VanDerWaalsContact C-N 3.28Å; L810-K812 PolarHBondContact O-N 2.86Å; L810-L813 PolarHBondContact O-N 3.11Å; L810-I814 HydrophobicContact CD2-CD1 4.21Å; L810-I814 HydrophobicContact CD2-CG1 4.47Å; L810-I814 VanDerWaalsContact O-CG1 3.23Å; L810-I814 WeakPolarHBondContact O-CG1 3.25Å; L810-I814 PolarHBondContact O-N 2.81Å; L810-Y818 HydrophobicContact CB-CD2 3.55Å; L810-Y818 HydrophobicContact CB-CE2 3.81Å; L810-Y818 HydrophobicContact CB-CG 4.29Å; L810-Y818 HydrophobicContact CD1-CD2 4.41Å; L810-Y818 HydrophobicContact CD1-CE2 4.31Å
811	S	86.5	Confident	84.6	Confident	60 Å²	60	48.1 Å²	48.1	42%	0.42	25%	0.252	S	S	.	.	H	α-helix	trans	-55.3	-35.9	175.4	168.3	0	0	0	0	114.4	T809 P815	T809-S811 PolarHBondContact O-N 3.3Å; S811-P815 WeakPolarHBondContact O-CA 3.45Å
812	K	83.8	Confident	84.7	Confident	144 Å²	144	54.4 Å²	54.4	63%	0.626	28%	0.275	S	S	*	.	H	α-helix	trans	-88.4	-29.6	178.9	-64.7	-162.9	-159.9	159.6	0	113.5	G807 T809 L810	G807-K812 VanDerWaalsContact O-CD 3.29Å; G807-K812 WeakPolarHBondContact O-CD 3.14Å; G807-K812 WeakPolarHBondContact O-CE 3.04Å; G807-K812 PolarHBondContact O-NZ 3.44Å; G807-K812 VanDerWaalsContact O-NZ 3.1Å; T809-K812 PolarHBondContact O-N 3.12Å; L810-K812 VanDerWaalsContact C-N 3.28Å; L810-K812 PolarHBondContact O-N 2.86Å
813	L	85.2	Confident	84.7	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-76.7	-41.9	-178.7	-71.8	172.4	0	0	0	111.5	Q755 K759 L762 Y808 T809 L810	Q755-L813 HydrophobicContact CB-CD2 4.41Å; K759-L813 HydrophobicContact CD-CD2 4.45Å; K759-L813 HydrophobicContact CG-CB 4.36Å; K759-L813 HydrophobicContact CG-CD2 3.8Å; L762-L813 HydrophobicContact CD1-CD1 3.94Å; Y808-L813 HydrophobicContact CD1-CD2 3.74Å; Y808-L813 HydrophobicContact CD1-CG 4.45Å; Y808-L813 HydrophobicContact CE1-CD2 4.5Å; T809-L813 PolarHBondContact O-N 2.7Å; L810-L813 PolarHBondContact O-N 3.11Å
814	I	88.4	Confident	85	Confident	6 Å²	6	55.6 Å²	55.6	3%	0.031	28%	0.279	C	S	.	.	S	Bend	trans	-138.5	65.2	-172	52.4	160.5	0	0	0	110.8	K759 L762 T763 V766 L810 E816 Y818	K759-I814 WeakPolarHBondContact O-CG2 3.48Å; L762-I814 HydrophobicContact CB-CD1 4.23Å; L762-I814 HydrophobicContact CB-CG2 4.34Å; T763-I814 WeakPolarHBondContact OG1-CG2 3.4Å; V766-I814 HydrophobicContact CB-CD1 4.23Å; V766-I814 HydrophobicContact CG2-CD1 3.65Å; L810-I814 HydrophobicContact CD2-CD1 4.21Å; L810-I814 HydrophobicContact CD2-CG1 4.47Å; L810-I814 VanDerWaalsContact O-CG1 3.23Å; L810-I814 WeakPolarHBondContact O-CG1 3.25Å; L810-I814 PolarHBondContact O-N 2.81Å; I814-E816 PolarHBondContact O-N 2.84Å; I814-Y818 WeakPolarHBondContact O-CB 3.24Å; I814-Y818 PolarHBondContact O-N 3.44Å
815	P	86.5	Confident	85.6	Confident	65 Å²	65	54.3 Å²	54.3	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-55.1	-50.1	-170.8	20.3	-31.9	0	0	0	112.9	S811 Y818 E819	S811-P815 WeakPolarHBondContact O-CA 3.45Å; P815-Y818 PolarHBondContact O-N 2.67Å; P815-E819 WeakPolarHBondContact O-CG 3.47Å; P815-E819 PolarHBondContact O-N 3.27Å
816	E	86.1	Confident	86.1	Confident	147 Å²	147	51.2 Å²	51.2	69%	0.687	26%	0.26	S	S	*	.	H	α-helix	trans	-64.5	-54	-175.8	-62.5	175	-176.3	0	0	112.6	I814 Y818 E819 Q820	I814-E816 PolarHBondContact O-N 2.84Å; E816-Y818 VanDerWaalsContact C-N 3.27Å; E816-Y818 PolarHBondContact O-N 3.45Å; E816-E819 PolarHBondContact O-N 2.88Å; E816-Q820 WeakPolarHBondContact O-CG 3.48Å; E816-Q820 PolarHBondContact O-N 3.35Å; E816-Q820 VanDerWaalsContact O-N 3.15Å
817	S	88.5	Confident	86.9	Confident	9 Å²	9	47.8 Å²	47.8	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-31.7	178.4	-67.1	0	0	0	0	112.6	N767 L821	N767-S817 WeakPolarHBondContact OD1-CB 3.34Å; N767-S817 PolarHBondContact OD1-OG 3.28Å; S817-L821 PolarHBondContact O-N 3.23Å
818	Y	89.9	Confident	87.5	Confident	42 Å²	42	46.5 Å²	46.5	17%	0.165	23%	0.233	C	C	.	.	H	α-helix	trans	-71.5	-41	177.1	-177.8	-102.6	0	0	0	111.9	E795 L810 I814 P815 E816 Q820 L821 R822	E795-Y818 HydrophobicContact CG-CE2 4.26Å; E795-Y818 WeakPolarHBondContact OE1-CE2 3.16Å; E795-Y818 PolarHBondContact OE1-OH 3.09Å; L810-Y818 HydrophobicContact CB-CD2 3.55Å; L810-Y818 HydrophobicContact CB-CE2 3.81Å; L810-Y818 HydrophobicContact CB-CG 4.29Å; L810-Y818 HydrophobicContact CD1-CD2 4.41Å; L810-Y818 HydrophobicContact CD1-CE2 4.31Å; I814-Y818 WeakPolarHBondContact O-CB 3.24Å; I814-Y818 PolarHBondContact O-N 3.44Å; P815-Y818 PolarHBondContact O-N 2.67Å; E816-Y818 VanDerWaalsContact C-N 3.27Å; E816-Y818 PolarHBondContact O-N 3.45Å; Y818-Q820 VanDerWaalsContact C-N 3.31Å; Y818-Q820 PolarHBondContact O-N 3.34Å; Y818-L821 WeakPolarHBondContact O-CB 3.32Å; Y818-L821 PolarHBondContact O-N 2.83Å; Y818-R822 HydrophobicContact CD1-CG 4.12Å; Y818-R822 HydrophobicContact CE1-CG 3.7Å; Y818-R822 HydrophobicContact CE2-CG 4.18Å; Y818-R822 WeakPolarHBondContact O-CG 3.3Å; Y818-R822 PolarHBondContact O-N 2.92Å
819	E	89.4	Confident	87.6	Confident	78 Å²	78	47.1 Å²	47.1	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-44.6	173.8	-75.6	169.8	165.6	0	0	110.9	P815 E816 L821 R822 E823 H851	P815-E819 WeakPolarHBondContact O-CG 3.47Å; P815-E819 PolarHBondContact O-N 3.27Å; E816-E819 PolarHBondContact O-N 2.88Å; E819-L821 PolarHBondContact O-N 3.23Å; E819-R822 PolarHBondContact O-N 3.37Å; E819-R822 VanDerWaalsContact O-N 3.11Å; E819-E823 WeakPolarHBondContact O-CB 3.38Å; E819-E823 PolarHBondContact O-N 3.43Å; E819-H851 HydrophobicContact CB-CB 4.11Å; E819-H851 IonicContact OE1-CE1 3.94Å; E819-H851 IonicContact OE2-CD2 3.27Å; E819-H851 IonicContact OE2-CE1 3.49Å; E819-H851 PolarHBondContact OE2-CE1 2.87Å; E819-H851 IonicContact OE2-CG 2.79Å; E819-H851 IonicContact OE2-ND1 2.8Å; E819-H851 PolarHBondContact OE2-ND1 3.23Å; E819-H851 IonicContact OE2-NE2 2.87Å
820	Q	90	Very high	87.6	Confident	19 Å²	19	46.7 Å²	46.7	9%	0.089	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-45.7	173.7	-68.5	178.8	-5.2	0	0	112.5	L770 E816 Y818 R822 E823 F824 H851 V852	L770-Q820 HydrophobicContact CD1-CB 3.82Å; E816-Q820 WeakPolarHBondContact O-CG 3.48Å; E816-Q820 PolarHBondContact O-N 3.35Å; E816-Q820 VanDerWaalsContact O-N 3.15Å; Y818-Q820 VanDerWaalsContact C-N 3.31Å; Y818-Q820 PolarHBondContact O-N 3.34Å; Q820-R822 PolarHBondContact O-N 3.04Å; Q820-E823 PolarHBondContact O-N 2.88Å; Q820-F824 WeakPolarHBondContact O-CB 3.41Å; Q820-F824 PolarHBondContact O-N 3.46Å; Q820-H851 VanDerWaalsContact CG-O 3.22Å; Q820-H851 WeakPolarHBondContact CG-O 3.34Å; Q820-H851 PolarHBondContact NE2-O 2.63Å; Q820-V852 HydrophobicContact CB-CG2 4.47Å; Q820-V852 HydrophobicContact CG-CG2 4.31Å
821	L	90.5	Very high	87.6	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-33.6	176.5	-172.6	72.8	0	0	0	112.6	V766 Y769 L770 Y791 F794 S817 Y818 E819 P825	V766-L821 HydrophobicContact CG1-CB 4.12Å; V766-L821 HydrophobicContact CG1-CD1 4.38Å; V766-L821 HydrophobicContact CG1-CD2 4.31Å; Y769-L821 HydrophobicContact CD1-CD1 3.81Å; Y769-L821 HydrophobicContact CE1-CD1 4.03Å; L770-L821 HydrophobicContact CD2-CD1 4.06Å; L770-L821 HydrophobicContact CG-CD1 4.45Å; Y791-L821 HydrophobicContact CD1-CD1 3.6Å; Y791-L821 HydrophobicContact CD1-CG 4.24Å; Y791-L821 WeakPolarHBondContact CD1-O 3.32Å; Y791-L821 HydrophobicContact CE1-CD1 3.71Å; F794-L821 HydrophobicContact CD1-CD1 3.96Å; F794-L821 HydrophobicContact CD1-CD2 4.16Å; F794-L821 HydrophobicContact CE1-CD1 4.21Å; F794-L821 HydrophobicContact CE1-CD2 4.35Å; S817-L821 PolarHBondContact O-N 3.23Å; Y818-L821 WeakPolarHBondContact O-CB 3.32Å; Y818-L821 PolarHBondContact O-N 2.83Å; E819-L821 PolarHBondContact O-N 3.23Å; L821-P825 VanDerWaalsContact O-CD 3.25Å; L821-P825 WeakPolarHBondContact O-CD 3.06Å
822	R	90.4	Very high	87.3	Confident	135 Å²	135	50.8 Å²	50.8	51%	0.509	26%	0.255	S	S	.	.	H	α-helix	trans	-81.3	-32	-179.7	-69.2	-61.5	-58.1	-169.4	-1.4	113.2	E795 Y818 E819 Q820	E795-R822 IonicContact OE1-NH1 3.86Å; E795-R822 IonicContact OE2-CZ 3.18Å; E795-R822 IonicContact OE2-NH1 3.99Å; E795-R822 PolarHBondContact OE2-NH1 3.18Å; Y818-R822 HydrophobicContact CD1-CG 4.12Å; Y818-R822 HydrophobicContact CE1-CG 3.7Å; Y818-R822 HydrophobicContact CE2-CG 4.18Å; Y818-R822 WeakPolarHBondContact O-CG 3.3Å; Y818-R822 PolarHBondContact O-N 2.92Å; E819-R822 PolarHBondContact O-N 3.37Å; E819-R822 VanDerWaalsContact O-N 3.11Å; Q820-R822 PolarHBondContact O-N 3.04Å
823	E	88	Confident	87.2	Confident	38 Å²	38	49.6 Å²	49.6	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-78.2	-39.3	180	-165.5	-178.7	151.5	0	0	111.8	E819 Q820 P825 S826 I827 Y839 V852	E819-E823 WeakPolarHBondContact O-CB 3.38Å; E819-E823 PolarHBondContact O-N 3.43Å; Q820-E823 PolarHBondContact O-N 2.88Å; E823-P825 VanDerWaalsContact C-CD 3.48Å; E823-S826 WeakPolarHBondContact O-CB 3.27Å; E823-S826 PolarHBondContact O-N 3.19Å; E823-S826 PolarHBondContact O-OG 3.14Å; E823-I827 HydrophobicContact CG-CD1 4.39Å; E823-Y839 PolarHBondContact OE1-OH 3.06Å; E823-V852 HydrophobicContact CB-CG2 4.03Å; E823-V852 HydrophobicContact CG-CG2 4.16Å
824	F	89.7	Confident	87.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-35.3	-170.8	-152	-95.9	0	0	0	116.4	L770 T774 Y791 Q820 S826 I827 L828 V852 M856 H860	L770-F824 HydrophobicContact CD2-CB 4.37Å; T774-F824 HydrophobicContact CG2-CE1 4.17Å; T774-F824 HydrophobicContact CG2-CE2 4.12Å; T774-F824 HydrophobicContact CG2-CZ 3.47Å; T774-F824 VanDerWaalsContact CG2-CZ 3.47Å; Y791-F824 HydrophobicContact CE1-CB 3.66Å; Y791-F824 AromaticContact CE1-CD1 4Å; Y791-F824 HydrophobicContact CE1-CD1 4Å; Y791-F824 HydrophobicContact CE1-CG 4.19Å; Y791-F824 HydrophobicContact CE2-CD1 4.33Å; Y791-F824 AromaticContact CZ-CD1 3.52Å; Y791-F824 WeakPolarHBondContact OH-CD1 3.45Å; Y791-F824 WeakPolarHBondContact OH-CE1 3.15Å; Q820-F824 WeakPolarHBondContact O-CB 3.41Å; Q820-F824 PolarHBondContact O-N 3.46Å; F824-S826 PolarHBondContact O-N 3.04Å; F824-I827 HydrophobicContact CD2-CD1 4.05Å; F824-I827 WeakPolarHBondContact O-CB 3.3Å; F824-I827 PolarHBondContact O-N 3.18Å; F824-L828 HydrophobicContact CD1-CD1 4.13Å; F824-L828 HydrophobicContact CD1-CD2 4.19Å; F824-L828 HydrophobicContact CD1-CG 3.91Å; F824-L828 HydrophobicContact CE1-CD1 4.46Å; F824-L828 HydrophobicContact CE1-CD2 3.74Å; F824-L828 HydrophobicContact CE1-CG 3.98Å; F824-L828 WeakPolarHBondContact O-CG 3.48Å; F824-L828 PolarHBondContact O-N 3.4Å; F824-V852 HydrophobicContact CD2-CG1 4.34Å; F824-M856 HydrophobicContact CD2-SD 4.18Å; F824-M856 HydrophobicContact CE2-CG 3.83Å; F824-M856 HydrophobicContact CE2-SD 3.98Å; F824-M856 HydrophobicContact CZ-CG 4.43Å; F824-H860 HydrophobicContact CZ-CB 4.07Å
825	P	89.9	Confident	86.8	Confident	31 Å²	31	53.1 Å²	53.1	20%	0.201	27%	0.268	C	S	.	.	H	α-helix	trans	-56.3	-32.7	173.7	-28.8	37.2	0	0	0	114.3	A788 Y791 L821 E823 S829	A788-P825 HydrophobicContact CB-CB 4.3Å; Y791-P825 HydrophobicContact CD1-CG 3.61Å; Y791-P825 HydrophobicContact CE1-CG 4.42Å; Y791-P825 HydrophobicContact CG-CG 3.76Å; L821-P825 VanDerWaalsContact O-CD 3.25Å; L821-P825 WeakPolarHBondContact O-CD 3.06Å; E823-P825 VanDerWaalsContact C-CD 3.48Å; P825-S829 PolarHBondContact O-OG 3.13Å
826	S	87.6	Confident	86.6	Confident	67 Å²	67	50.3 Å²	50.3	47%	0.469	25%	0.249	S	C	.	.	H	α-helix	trans	-71.5	-40.2	175.1	71.3	0	0	0	0	111.4	E823 F824 L828 S829 M830	E823-S826 WeakPolarHBondContact O-CB 3.27Å; E823-S826 PolarHBondContact O-N 3.19Å; E823-S826 PolarHBondContact O-OG 3.14Å; F824-S826 PolarHBondContact O-N 3.04Å; S826-L828 VanDerWaalsContact C-N 3.32Å; S826-L828 PolarHBondContact O-N 2.95Å; S826-S829 WeakPolarHBondContact O-CB 3.26Å; S826-S829 PolarHBondContact O-N 2.73Å; S826-M830 WeakPolarHBondContact O-CG 2.96Å; S826-M830 PolarHBondContact O-N 3.17Å
827	I	87.1	Confident	86.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-41.2	176.6	-59.3	179.9	0	0	0	111.2	E823 F824 S829 M830 L835 Y839 V852	E823-I827 HydrophobicContact CG-CD1 4.39Å; F824-I827 HydrophobicContact CD2-CD1 4.05Å; F824-I827 WeakPolarHBondContact O-CB 3.3Å; F824-I827 PolarHBondContact O-N 3.18Å; I827-S829 PolarHBondContact O-N 2.93Å; I827-M830 PolarHBondContact O-N 3.17Å; I827-L835 HydrophobicContact CB-CD2 4.45Å; I827-L835 HydrophobicContact CG2-CD2 3.59Å; I827-Y839 HydrophobicContact CD1-CE2 4.42Å; I827-Y839 VanDerWaalsContact CD1-OH 3.3Å; I827-Y839 WeakPolarHBondContact CD1-OH 3.4Å; I827-Y839 HydrophobicContact CG1-CE2 4.48Å; I827-V852 HydrophobicContact CD1-CB 4.18Å; I827-V852 HydrophobicContact CD1-CG1 4.03Å; I827-V852 HydrophobicContact CD1-CG2 3.85Å
828	L	87	Confident	86	Confident	1 Å²	1	51 Å²	51	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-26.2	176.7	-67.9	169.2	0	0	0	113.6	R784 L787 A788 Y791 F824 S826 H860	R784-L828 VanDerWaalsContact CD-O 3.23Å; R784-L828 WeakPolarHBondContact CD-O 3.27Å; R784-L828 PolarHBondContact NE-O 3Å; L787-L828 HydrophobicContact CB-CD1 4.48Å; L787-L828 HydrophobicContact CD2-CD1 3.16Å; L787-L828 HydrophobicContact CD2-CD2 3.84Å; L787-L828 HydrophobicContact CD2-CG 4.13Å; L787-L828 HydrophobicContact CG-CD1 4.42Å; A788-L828 HydrophobicContact CB-CD1 4.1Å; Y791-L828 HydrophobicContact CE2-CD1 4.3Å; F824-L828 HydrophobicContact CD1-CD1 4.13Å; F824-L828 HydrophobicContact CD1-CD2 4.19Å; F824-L828 HydrophobicContact CD1-CG 3.91Å; F824-L828 HydrophobicContact CE1-CD1 4.46Å; F824-L828 HydrophobicContact CE1-CD2 3.74Å; F824-L828 HydrophobicContact CE1-CG 3.98Å; F824-L828 WeakPolarHBondContact O-CG 3.48Å; F824-L828 PolarHBondContact O-N 3.4Å; S826-L828 VanDerWaalsContact C-N 3.32Å; S826-L828 PolarHBondContact O-N 2.95Å; L828-H860 VanDerWaalsContact CD2-CE1 3.44Å; L828-H860 WeakPolarHBondContact CD2-CE1 3.16Å
829	S	84.5	Confident	85.4	Confident	76 Å²	76	50.1 Å²	50.1	53%	0.531	25%	0.252	S	S	.	.	H	α-helix	trans	-90.9	-17.2	-177.3	-54.5	0	0	0	0	112.7	P825 S826 I827	P825-S829 PolarHBondContact O-OG 3.13Å; S826-S829 WeakPolarHBondContact O-CB 3.26Å; S826-S829 PolarHBondContact O-N 2.73Å; I827-S829 PolarHBondContact O-N 2.93Å
830	M	85.6	Confident	84.6	Confident	38 Å²	38	46.6 Å²	46.6	19%	0.187	24%	0.236	C	C	.	.	S	Bend	trans	-71.4	153.9	-179.5	-68.8	173.6	72.7	0	0	112.3	S826 I827 Q834 L835 R864	S826-M830 WeakPolarHBondContact O-CG 2.96Å; S826-M830 PolarHBondContact O-N 3.17Å; I827-M830 PolarHBondContact O-N 3.17Å; M830-Q834 HydrophobicContact CE-CB 3.96Å; M830-L835 HydrophobicContact CB-CD2 3.82Å; M830-L835 HydrophobicContact CB-CG 3.97Å; M830-L835 HydrophobicContact CE-CD2 4.16Å; M830-L835 HydrophobicContact CG-CD2 4.42Å; M830-L835 HydrophobicContact SD-CD2 3.83Å; M830-R864 PolarHBondContact O-NH1 3.15Å; M830-R864 PolarHBondContact O-NH2 3.08Å; M830-R864 VanDerWaalsContact O-NH2 3.15Å
831	E	84.1	Confident	83.3	Confident	125 Å²	125	51.7 Å²	51.7	58%	0.584	26%	0.258	S	S	*	.			trans	-77.8	153.9	169.9	-68.4	-170.7	165.2	0	0	111.6	E833 Q834 L835	E831-E833 VanDerWaalsContact C-N 3.25Å; E831-E833 PolarHBondContact O-N 2.87Å; E831-Q834 HydrophobicContact CB-CG 4.45Å; E831-Q834 PolarHBondContact O-N 3.46Å; E831-Q834 VanDerWaalsContact O-N 3.13Å; E831-L835 PolarHBondContact O-N 3.35Å
832	N	82.2	Confident	81.4	Confident	31 Å²	31	57.6 Å²	57.6	17%	0.166	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-36.4	-175.9	-66.7	-19.2	0	0	0	113	L835 V836 R864 I922 Q925	N832-L835 PolarHBondContact O-N 3.34Å; N832-V836 PolarHBondContact O-N 3.35Å; N832-R864 WeakPolarHBondContact OD1-CD 3.34Å; N832-R864 PolarHBondContact OD1-NE 3.18Å; N832-R864 PolarHBondContact OD1-NH1 2.7Å; N832-I922 VanDerWaalsContact ND2-CD1 3.35Å; N832-I922 WeakPolarHBondContact ND2-CD1 3.5Å; N832-Q925 PolarHBondContact ND2-OE1 2.87Å
833	E	80.5	Confident	78.9	Confident	118 Å²	118	59.5 Å²	59.5	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-66.2	-40.4	178.9	-65.1	-177.8	-175.9	0	0	111.6	E831 V836 Q837 Q925	E831-E833 VanDerWaalsContact C-N 3.25Å; E831-E833 PolarHBondContact O-N 2.87Å; E833-V836 PolarHBondContact O-N 3.03Å; E833-Q837 VanDerWaalsContact O-CG 3.28Å; E833-Q837 WeakPolarHBondContact O-CG 3.5Å; E833-Q837 PolarHBondContact O-N 2.83Å; E833-Q925 VanDerWaalsContact CG-NE2 3.32Å
834	Q	82.7	Confident	76.6	Confident	92 Å²	92	60.6 Å²	60.6	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-39.6	176.7	-65.6	176.5	-13.9	0	0	111	M830 E831 V836 Q837 T838	M830-Q834 HydrophobicContact CE-CB 3.96Å; E831-Q834 HydrophobicContact CB-CG 4.45Å; E831-Q834 PolarHBondContact O-N 3.46Å; E831-Q834 VanDerWaalsContact O-N 3.13Å; Q834-V836 PolarHBondContact O-N 2.72Å; Q834-Q837 PolarHBondContact O-N 2.91Å; Q834-T838 WeakPolarHBondContact O-CB 3.32Å; Q834-T838 PolarHBondContact O-N 3.22Å; Q834-T838 PolarHBondContact O-OG1 2.92Å
835	L	82.5	Confident	74	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-59.1	-46.4	175.8	-71.5	175.8	0	0	0	112.3	I827 M830 E831 N832 Q837 Y839	I827-L835 HydrophobicContact CB-CD2 4.45Å; I827-L835 HydrophobicContact CG2-CD2 3.59Å; M830-L835 HydrophobicContact CB-CD2 3.82Å; M830-L835 HydrophobicContact CB-CG 3.97Å; M830-L835 HydrophobicContact CE-CD2 4.16Å; M830-L835 HydrophobicContact CG-CD2 4.42Å; M830-L835 HydrophobicContact SD-CD2 3.83Å; E831-L835 PolarHBondContact O-N 3.35Å; N832-L835 PolarHBondContact O-N 3.34Å; L835-Q837 VanDerWaalsContact C-N 3.34Å; L835-Y839 HydrophobicContact CD2-CD2 4.44Å; L835-Y839 HydrophobicContact CD2-CE2 4.25Å; L835-Y839 WeakPolarHBondContact O-CD2 3.29Å; L835-Y839 PolarHBondContact O-N 2.93Å
836	V	82	Confident	71.2	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.03	39%	0.389	C	S	.	.	H	α-helix	trans	-65.9	-39.2	177.4	178.4	0	0	0	0	110.7	N832 E833 Q834 A840 M861 Q925 E928	N832-V836 PolarHBondContact O-N 3.35Å; E833-V836 PolarHBondContact O-N 3.03Å; Q834-V836 PolarHBondContact O-N 2.72Å; V836-A840 HydrophobicContact CG1-CB 4.01Å; V836-A840 VanDerWaalsContact O-CA 3.29Å; V836-A840 WeakPolarHBondContact O-CA 3.35Å; V836-A840 WeakPolarHBondContact O-CB 3.33Å; V836-A840 PolarHBondContact O-N 2.71Å; V836-M861 HydrophobicContact CG2-CE 3.61Å; V836-M861 HydrophobicContact CG2-SD 4.28Å; V836-Q925 HydrophobicContact CG2-CB 4.09Å; V836-E928 HydrophobicContact CG1-CG 4.2Å
837	Q	80.8	Confident	68.8	Low	111 Å²	111	71.5 Å²	71.5	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-64.3	-48.9	177.5	-71.9	172.1	19.7	0	0	112.2	E833 Q834 L835 K841	E833-Q837 VanDerWaalsContact O-CG 3.28Å; E833-Q837 WeakPolarHBondContact O-CG 3.5Å; E833-Q837 PolarHBondContact O-N 2.83Å; Q834-Q837 PolarHBondContact O-N 2.91Å; L835-Q837 VanDerWaalsContact C-N 3.34Å; Q837-K841 WeakPolarHBondContact O-CB 3.48Å; Q837-K841 PolarHBondContact O-N 3.23Å
838	T	80.7	Confident	66.6	Low	60 Å²	60	76.8 Å²	76.8	37%	0.368	44%	0.435	S	S	.	.	H	α-helix	trans	-67	-39.1	-177.3	-55.8	0	0	0	0	112.5	Q834	Q834-T838 WeakPolarHBondContact O-CB 3.32Å; Q834-T838 PolarHBondContact O-N 3.22Å; Q834-T838 PolarHBondContact O-OG1 2.92Å
839	Y	78.5	Confident	64.8	Low	24 Å²	24	80.2 Å²	80.2	9%	0.094	46%	0.46	C	S	.	.	H	α-helix	trans	-108.5	-3.8	-171.8	-64.7	-81.6	0	0	0	114.8	E823 I827 L835 I857 H933	E823-Y839 PolarHBondContact OE1-OH 3.06Å; I827-Y839 HydrophobicContact CD1-CE2 4.42Å; I827-Y839 VanDerWaalsContact CD1-OH 3.3Å; I827-Y839 WeakPolarHBondContact CD1-OH 3.4Å; I827-Y839 HydrophobicContact CG1-CE2 4.48Å; L835-Y839 HydrophobicContact CD2-CD2 4.44Å; L835-Y839 HydrophobicContact CD2-CE2 4.25Å; L835-Y839 WeakPolarHBondContact O-CD2 3.29Å; L835-Y839 PolarHBondContact O-N 2.93Å; Y839-I857 HydrophobicContact CD1-CD1 3.25Å; Y839-I857 HydrophobicContact CD2-CD1 3.63Å; Y839-I857 HydrophobicContact CE1-CD1 3.53Å; Y839-I857 HydrophobicContact CE2-CD1 3.88Å; Y839-I857 HydrophobicContact CG-CD1 3.29Å; Y839-H933 PolarHBondContact O-CE1 3.12Å; Y839-H933 PolarHBondContact O-NE2 3.15Å
840	A	73.2	Confident	63.6	Low	3 Å²	3	81.2 Å²	81.2	3%	0.025	46%	0.459	C	S	.	.	H	α-helix	trans	-119.7	1.6	172.8	0	0	0	0	0	114	V836 F929 Y932	V836-A840 HydrophobicContact CG1-CB 4.01Å; V836-A840 VanDerWaalsContact O-CA 3.29Å; V836-A840 WeakPolarHBondContact O-CA 3.35Å; V836-A840 WeakPolarHBondContact O-CB 3.33Å; V836-A840 PolarHBondContact O-N 2.71Å; A840-F929 HydrophobicContact CB-CD2 4.13Å; A840-Y932 HydrophobicContact CB-CD1 3.95Å; A840-Y932 HydrophobicContact CB-CE1 4.49Å; A840-Y932 HydrophobicContact CB-CG 4.05Å; A840-Y932 VanDerWaalsContact O-CD2 3.27Å; A840-Y932 WeakPolarHBondContact O-CD2 3.46Å; A840-Y932 WeakPolarHBondContact O-CE2 3.34Å; A840-Y932 VanDerWaalsContact O-CZ 3.23Å
841	K	61.4	Low	62.9	Low	126 Å²	126	83 Å²	83	55%	0.548	47%	0.467	S	S	.	.			trans	-142.3	85.5	176.6	-66.5	178.2	-177.4	151.7	0	112	Q837 E928	Q837-K841 WeakPolarHBondContact O-CB 3.48Å; Q837-K841 PolarHBondContact O-N 3.23Å; K841-E928 WeakPolarHBondContact CE-OE1 3.41Å; K841-E928 IonicContact NZ-OE1 3.48Å; K841-E928 PolarHBondContact NZ-OE1 3.03Å
842	E	51.7	Low	62.8	Low	129 Å²	129	77.4 Å²	77.4	60%	0.603	44%	0.441	S	S	*	.			trans	-149.4	97.5	155.6	-120.6	174.9	-157.1	0	0	113.1	S844	E842-S844 PolarHBondContact O-N 3.21Å
843	N	37.3	Very low	63	Low	174 Å²	174	78 Å²	78	93%	0.93	44%	0.444	S	S	*	.			trans	-76.8	88.7	148.7	-86.1	-31.2	0	0	0	107.6
844	S	39.5	Very low	63.3	Low	61 Å²	61	74.1 Å²	74.1	43%	0.427	43%	0.429	S	S	.	.			trans	-146	105.6	152.2	60.4	0	0	0	0	110.1	E842 G846	E842-S844 PolarHBondContact O-N 3.21Å; S844-G846 PolarHBondContact O-N 3.34Å
845	V	34.5	Very low	63.7	Low	162 Å²	162	69.8 Å²	69.8	98%	0.982	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	98.6	162.3	178.2	0	0	0	0	107.6
846	G	32.2	Very low	64.1	Low	70 Å²	70	69.8 Å²	69.8	72%	0.722	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	149.9	-15.1	169.2	0	0	0	0	0	119.1	S844	S844-G846 PolarHBondContact O-N 3.34Å
847	S	37.6	Very low	64.4	Low	96 Å²	96	69.6 Å²	69.6	67%	0.671	41%	0.408	S	S	*	.			trans	-102	95	-179.9	-62.5	0	0	0	0	111.6	S849	S847-S849 PolarHBondContact O-N 3.18Å
848	S	39.3	Very low	64.9	Low	110 Å²	110	64.3 Å²	64.3	77%	0.769	38%	0.383	S	S	*	.			trans	-53.7	124.6	159	47.9	0	0	0	0	110.3
849	S	49.6	Very low	65.5	Low	74 Å²	74	61.4 Å²	61.4	52%	0.517	37%	0.365	S	S	.	.			trans	132.9	43.5	149.8	79.3	0	0	0	0	117	S847 H851	S847-S849 PolarHBondContact O-N 3.18Å; S849-H851 WeakPolarHBondContact CA-NE2 3.39Å; S849-H851 WeakPolarHBondContact CB-NE2 3Å; S849-H851 PolarHBondContact O-N 2.67Å
850	N	59.6	Low	66.1	Low	97 Å²	97	60.3 Å²	60.3	52%	0.519	36%	0.361	S	S	.	.			trans	-89.7	88.1	155.9	-81.1	-4.1	0	0	0	107.9	V852	N850-V852 VanDerWaalsContact C-N 3.32Å
851	H	71.2	Confident	66.8	Low	75 Å²	75	60.2 Å²	60.2	35%	0.347	36%	0.36	S	S	.	.			trans	-79.9	-16.5	-174.9	-65.6	-85.8	0	0	0	112.7	E819 Q820 S849	E819-H851 HydrophobicContact CB-CB 4.11Å; E819-H851 IonicContact OE1-CE1 3.94Å; E819-H851 IonicContact OE2-CD2 3.27Å; E819-H851 IonicContact OE2-CE1 3.49Å; E819-H851 PolarHBondContact OE2-CE1 2.87Å; E819-H851 IonicContact OE2-CG 2.79Å; E819-H851 IonicContact OE2-ND1 2.8Å; E819-H851 PolarHBondContact OE2-ND1 3.23Å; E819-H851 IonicContact OE2-NE2 2.87Å; Q820-H851 VanDerWaalsContact CG-O 3.22Å; Q820-H851 WeakPolarHBondContact CG-O 3.34Å; Q820-H851 PolarHBondContact NE2-O 2.63Å; S849-H851 WeakPolarHBondContact CA-NE2 3.39Å; S849-H851 WeakPolarHBondContact CB-NE2 3Å; S849-H851 PolarHBondContact O-N 2.67Å
852	V	81.5	Confident	68.2	Low	7 Å²	7	54.2 Å²	54.2	4%	0.042	33%	0.334	C	S	.	.	S	Bend	trans	-86.6	133.9	-178.1	-177.9	0	0	0	0	111.9	Q820 E823 F824 I827 N850 M856 I857	Q820-V852 HydrophobicContact CB-CG2 4.47Å; Q820-V852 HydrophobicContact CG-CG2 4.31Å; E823-V852 HydrophobicContact CB-CG2 4.03Å; E823-V852 HydrophobicContact CG-CG2 4.16Å; F824-V852 HydrophobicContact CD2-CG1 4.34Å; I827-V852 HydrophobicContact CD1-CB 4.18Å; I827-V852 HydrophobicContact CD1-CG1 4.03Å; I827-V852 HydrophobicContact CD1-CG2 3.85Å; N850-V852 VanDerWaalsContact C-N 3.32Å; V852-M856 HydrophobicContact CG1-CB 4.39Å; V852-M856 HydrophobicContact CG1-SD 4.44Å; V852-I857 HydrophobicContact CG1-CD1 4.17Å; V852-I857 HydrophobicContact CG1-CG1 3.85Å
853	L	87.4	Confident	70	Confident	45 Å²	45	48.1 Å²	48.1	24%	0.236	31%	0.305	C	S	.	.			trans	-68.6	131.9	-178.6	-70.3	151.3	0	0	0	111.9	W771 S855 M856 I857 D893	W771-L853 HydrophobicContact CZ2-CD1 4.29Å; L853-S855 VanDerWaalsContact C-N 3.26Å; L853-S855 PolarHBondContact O-N 3.06Å; L853-M856 HydrophobicContact CB-CB 4.25Å; L853-M856 VanDerWaalsContact O-CB 3.3Å; L853-M856 WeakPolarHBondContact O-CB 3.34Å; L853-M856 PolarHBondContact O-N 3.43Å; L853-I857 PolarHBondContact O-N 3.21Å; L853-D893 HydrophobicContact CD2-CB 4.1Å; L853-D893 WeakPolarHBondContact CD2-OD1 3.33Å
854	P	87.1	Confident	72.5	Confident	35 Å²	35	41.2 Å²	41.2	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-53.2	-38.8	175.9	-29.3	34.7	0	0	0	114	M856 I857 C858 D893 L897 F929	P854-M856 VanDerWaalsContact C-N 3.26Å; P854-M856 PolarHBondContact O-N 3.48Å; P854-I857 PolarHBondContact O-N 3.32Å; P854-C858 WeakPolarHBondContact O-CB 3.39Å; P854-C858 PolarHBondContact O-N 2.99Å; P854-D893 VanDerWaalsContact CD-OD2 3.28Å; P854-D893 WeakPolarHBondContact CD-OD2 3.48Å; P854-L897 HydrophobicContact CB-CD1 4.22Å; P854-L897 HydrophobicContact CB-CD2 4.47Å; P854-F929 HydrophobicContact CB-CE1 4.31Å; P854-F929 HydrophobicContact CB-CZ 4.21Å; P854-F929 WeakPolarHBondContact O-CE1 3.33Å
855	S	90.1	Very high	74.8	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-30.7	176.5	69.2	0	0	0	0	113.4	W771 L853 Q859 D893 R896	W771-S855 VanDerWaalsContact CH2-OG 3.29Å; W771-S855 WeakPolarHBondContact CH2-OG 3.25Å; L853-S855 VanDerWaalsContact C-N 3.26Å; L853-S855 PolarHBondContact O-N 3.06Å; S855-Q859 VanDerWaalsContact O-CB 3.26Å; S855-Q859 WeakPolarHBondContact O-CB 3.39Å; S855-Q859 PolarHBondContact O-N 3.48Å; S855-D893 VanDerWaalsContact CB-OD1 3.29Å; S855-D893 WeakPolarHBondContact CB-OD1 3.25Å; S855-D893 PolarHBondContact N-OD2 3.28Å; S855-D893 VanDerWaalsContact N-OD2 3.08Å; S855-D893 PolarHBondContact OG-OD1 3.23Å; S855-R896 WeakPolarHBondContact OG-CD 3.32Å
856	M	90.7	Very high	77.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.6	-40.3	177	-164.9	174.5	-75.3	0	0	111.6	L770 W771 T774 F824 V852 L853 P854 Q859 H860	L770-M856 HydrophobicContact CB-CE 3.78Å; L770-M856 HydrophobicContact CB-SD 4.04Å; L770-M856 HydrophobicContact CD1-CE 4.31Å; W771-M856 HydrophobicContact CD2-CE 3.78Å; W771-M856 VanDerWaalsContact CE2-CE 3.49Å; W771-M856 HydrophobicContact CE3-CE 4.18Å; W771-M856 HydrophobicContact CE3-CG 4.26Å; W771-M856 HydrophobicContact CG-CE 4.32Å; W771-M856 HydrophobicContact CH2-CB 3.63Å; W771-M856 HydrophobicContact CH2-CE 4.01Å; W771-M856 HydrophobicContact CH2-CG 4.14Å; W771-M856 HydrophobicContact CZ2-CB 4.34Å; W771-M856 HydrophobicContact CZ2-CE 3.61Å; W771-M856 VanDerWaalsContact CZ3-CA 3.49Å; W771-M856 HydrophobicContact CZ3-CB 3.8Å; W771-M856 HydrophobicContact CZ3-CE 4.31Å; W771-M856 HydrophobicContact CZ3-CG 3.95Å; T774-M856 HydrophobicContact CG2-CG 3.53Å; T774-M856 HydrophobicContact CG2-SD 4.45Å; F824-M856 HydrophobicContact CD2-SD 4.18Å; F824-M856 HydrophobicContact CE2-CG 3.83Å; F824-M856 HydrophobicContact CE2-SD 3.98Å; F824-M856 HydrophobicContact CZ-CG 4.43Å; V852-M856 HydrophobicContact CG1-CB 4.39Å; V852-M856 HydrophobicContact CG1-SD 4.44Å; L853-M856 HydrophobicContact CB-CB 4.25Å; L853-M856 VanDerWaalsContact O-CB 3.3Å; L853-M856 WeakPolarHBondContact O-CB 3.34Å; L853-M856 PolarHBondContact O-N 3.43Å; P854-M856 VanDerWaalsContact C-N 3.26Å; P854-M856 PolarHBondContact O-N 3.48Å; M856-Q859 PolarHBondContact O-N 3.26Å; M856-H860 PolarHBondContact O-N 3.19Å
857	I	89.6	Confident	79.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-47.3	175.6	-58.2	176.5	0	0	0	110	Y839 V852 L853 P854 Q859 H860 M861 F929	Y839-I857 HydrophobicContact CD1-CD1 3.25Å; Y839-I857 HydrophobicContact CD2-CD1 3.63Å; Y839-I857 HydrophobicContact CE1-CD1 3.53Å; Y839-I857 HydrophobicContact CE2-CD1 3.88Å; Y839-I857 HydrophobicContact CG-CD1 3.29Å; V852-I857 HydrophobicContact CG1-CD1 4.17Å; V852-I857 HydrophobicContact CG1-CG1 3.85Å; L853-I857 PolarHBondContact O-N 3.21Å; P854-I857 PolarHBondContact O-N 3.32Å; I857-Q859 VanDerWaalsContact C-N 3.33Å; I857-Q859 PolarHBondContact O-N 3.24Å; I857-H860 WeakPolarHBondContact O-CB 3.49Å; I857-H860 PolarHBondContact O-N 3.46Å; I857-H860 VanDerWaalsContact O-N 3.15Å; I857-M861 WeakPolarHBondContact O-CG 3.29Å; I857-M861 PolarHBondContact O-N 3.11Å; I857-F929 HydrophobicContact CB-CZ 4.04Å; I857-F929 HydrophobicContact CG2-CE2 4.06Å; I857-F929 HydrophobicContact CG2-CZ 4.01Å
858	C	90.7	Very high	81.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.8	-45.3	176.8	-171.8	0	0	0	0	111.3	P854 H860 M861 F862 L897 L900 F929 L930	P854-C858 WeakPolarHBondContact O-CB 3.39Å; P854-C858 PolarHBondContact O-N 2.99Å; C858-H860 VanDerWaalsContact C-N 3.32Å; C858-H860 PolarHBondContact O-N 2.9Å; C858-M861 WeakPolarHBondContact O-CB 3.3Å; C858-M861 PolarHBondContact O-N 3.44Å; C858-M861 VanDerWaalsContact O-N 3.11Å; C858-F862 VanDerWaalsContact O-CD2 3.31Å; C858-F862 WeakPolarHBondContact O-CD2 3.39Å; C858-F862 PolarHBondContact O-N 3.21Å; C858-L897 HydrophobicContact CB-CD2 4.14Å; C858-L900 HydrophobicContact CB-CD1 3.74Å; C858-F929 HydrophobicContact CB-CD1 3.86Å; C858-F929 HydrophobicContact CB-CE1 3.74Å; C858-L930 WeakPolarHBondContact SG-CD2 3.41Å
859	Q	91.9	Very high	83.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-39.8	176.4	-174.9	64.5	69.7	0	0	112.2	W771 T774 L775 S855 M856 I857 F862 S863 Y883 L900	W771-Q859 HydrophobicContact CZ3-CB 4.36Å; T774-Q859 VanDerWaalsContact OG1-CG 3.25Å; T774-Q859 WeakPolarHBondContact OG1-CG 3.45Å; L775-Q859 HydrophobicContact CD2-CG 4.2Å; L775-Q859 VanDerWaalsContact CD2-NE2 3.34Å; S855-Q859 VanDerWaalsContact O-CB 3.26Å; S855-Q859 WeakPolarHBondContact O-CB 3.39Å; S855-Q859 PolarHBondContact O-N 3.48Å; M856-Q859 PolarHBondContact O-N 3.26Å; I857-Q859 VanDerWaalsContact C-N 3.33Å; I857-Q859 PolarHBondContact O-N 3.24Å; Q859-F862 WeakPolarHBondContact O-CB 3.41Å; Q859-F862 PolarHBondContact O-N 3.31Å; Q859-S863 PolarHBondContact O-N 2.95Å; Q859-S863 VanDerWaalsContact O-N 3.15Å; Q859-Y883 PolarHBondContact OE1-OH 3.41Å; Q859-L900 HydrophobicContact CB-CD1 4.44Å
860	H	91.7	Very high	85.5	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-38.2	173.3	177.5	50.3	0	0	0	112.4	T774 S778 F824 L828 M856 I857 C858 F862 S863 R864	T774-H860 HydrophobicContact CG2-CB 4.48Å; S778-H860 PolarHBondContact OG-CE1 3.49Å; F824-H860 HydrophobicContact CZ-CB 4.07Å; L828-H860 VanDerWaalsContact CD2-CE1 3.44Å; L828-H860 WeakPolarHBondContact CD2-CE1 3.16Å; M856-H860 PolarHBondContact O-N 3.19Å; I857-H860 WeakPolarHBondContact O-CB 3.49Å; I857-H860 PolarHBondContact O-N 3.46Å; I857-H860 VanDerWaalsContact O-N 3.15Å; C858-H860 VanDerWaalsContact C-N 3.32Å; C858-H860 PolarHBondContact O-N 2.9Å; H860-F862 VanDerWaalsContact C-N 3.32Å; H860-F862 PolarHBondContact O-N 3.04Å; H860-S863 CarbonylContact O-C 3.32Å; H860-S863 VanDerWaalsContact O-CA 3.3Å; H860-S863 WeakPolarHBondContact O-CA 3.3Å; H860-S863 WeakPolarHBondContact O-CB 3.49Å; H860-S863 PolarHBondContact O-N 3.2Å; H860-S863 PolarHBondContact O-OG 3.1Å; H860-R864 PolarHBondContact O-N 2.62Å
861	M	89.2	Confident	87	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-38.5	174.1	-69.2	176.5	70.3	0	0	112	V836 I857 C858 S863 R864 A865 I922 Q925 L926 F929	V836-M861 HydrophobicContact CG2-CE 3.61Å; V836-M861 HydrophobicContact CG2-SD 4.28Å; I857-M861 WeakPolarHBondContact O-CG 3.29Å; I857-M861 PolarHBondContact O-N 3.11Å; C858-M861 WeakPolarHBondContact O-CB 3.3Å; C858-M861 PolarHBondContact O-N 3.44Å; C858-M861 VanDerWaalsContact O-N 3.11Å; M861-S863 PolarHBondContact O-N 3.24Å; M861-R864 PolarHBondContact O-N 3.06Å; M861-R864 VanDerWaalsContact O-N 3.13Å; M861-A865 PolarHBondContact O-N 3.2Å; M861-I922 WeakPolarHBondContact O-CD1 3.27Å; M861-Q925 HydrophobicContact CE-CB 3.77Å; M861-L926 HydrophobicContact CB-CD2 3.45Å; M861-L926 VanDerWaalsContact CB-CD2 3.45Å; M861-L926 HydrophobicContact CB-CG 4.15Å; M861-L926 HydrophobicContact CE-CD2 4.28Å; M861-L926 HydrophobicContact CE-CG 4.29Å; M861-L926 HydrophobicContact SD-CD2 4.43Å; M861-F929 HydrophobicContact SD-CB 4.35Å; M861-F929 HydrophobicContact SD-CD2 4.28Å; M861-F929 HydrophobicContact SD-CG 4.21Å
862	F	90.2	Very high	87.7	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-59.5	-34.9	169	-83.3	-82.6	0	0	0	112.1	R777 C858 Q859 H860 R864 A865 I869 Y871 P872 L900 L904 L926	R777-F862 PolarHBondContact NH1-O 3.25Å; C858-F862 VanDerWaalsContact O-CD2 3.31Å; C858-F862 WeakPolarHBondContact O-CD2 3.39Å; C858-F862 PolarHBondContact O-N 3.21Å; Q859-F862 WeakPolarHBondContact O-CB 3.41Å; Q859-F862 PolarHBondContact O-N 3.31Å; H860-F862 VanDerWaalsContact C-N 3.32Å; H860-F862 PolarHBondContact O-N 3.04Å; F862-R864 PolarHBondContact O-N 3.02Å; F862-A865 WeakPolarHBondContact O-CB 3.43Å; F862-A865 PolarHBondContact O-N 3.39Å; F862-I869 HydrophobicContact CD1-CG2 3.91Å; F862-I869 HydrophobicContact CE1-CG2 4Å; F862-Y871 HydrophobicContact CB-CD1 3.99Å; F862-Y871 HydrophobicContact CB-CE1 4.1Å; F862-P872 HydrophobicContact CD1-CG 4.44Å; F862-P872 HydrophobicContact CE1-CG 4.07Å; F862-P872 HydrophobicContact CE2-CG 4.3Å; F862-P872 HydrophobicContact CZ-CG 3.99Å; F862-L900 HydrophobicContact CD2-CD2 4.38Å; F862-L900 HydrophobicContact CE2-CB 4.07Å; F862-L900 HydrophobicContact CE2-CD2 4.26Å; F862-L904 HydrophobicContact CE1-CD1 4.03Å; F862-L904 HydrophobicContact CZ-CB 4.05Å; F862-L904 HydrophobicContact CZ-CD1 4.08Å; F862-L926 HydrophobicContact CD1-CD1 4.17Å; F862-L926 HydrophobicContact CD2-CD2 3.85Å; F862-L926 HydrophobicContact CE1-CD1 4.23Å; F862-L926 HydrophobicContact CE2-CD2 3.9Å; F862-L926 HydrophobicContact CG-CD1 4.33Å; F862-L926 HydrophobicContact CG-CD2 4.36Å; F862-L926 HydrophobicContact CZ-CD1 4.43Å; F862-L926 HydrophobicContact CZ-CD2 4.48Å
863	S	89.6	Confident	88.2	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.7	-23.7	177.5	131.1	0	0	0	0	113.5	T774 I776 R777 S778 Q859 H860 M861 Y871	T774-S863 WeakPolarHBondContact O-CB 3.25Å; I776-S863 VanDerWaalsContact O-CB 3.26Å; I776-S863 WeakPolarHBondContact O-CB 3.3Å; I776-S863 PolarHBondContact O-OG 2.85Å; R777-S863 WeakPolarHBondContact CD-O 3.33Å; S778-S863 WeakPolarHBondContact CB-OG 3.4Å; S778-S863 PolarHBondContact N-O 3.12Å; S778-S863 PolarHBondContact OG-OG 3.4Å; Q859-S863 PolarHBondContact O-N 2.95Å; Q859-S863 VanDerWaalsContact O-N 3.15Å; H860-S863 CarbonylContact O-C 3.32Å; H860-S863 VanDerWaalsContact O-CA 3.3Å; H860-S863 WeakPolarHBondContact O-CA 3.3Å; H860-S863 WeakPolarHBondContact O-CB 3.49Å; H860-S863 PolarHBondContact O-N 3.2Å; H860-S863 PolarHBondContact O-OG 3.1Å; M861-S863 PolarHBondContact O-N 3.24Å; S863-Y871 VanDerWaalsContact CA-OH 3.27Å; S863-Y871 WeakPolarHBondContact CA-OH 3.15Å; S863-Y871 WeakPolarHBondContact CB-OH 3.32Å
864	R	89	Confident	88.3	Confident	29 Å²	29	26.1 Å²	26.1	11%	0.109	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-9	174.7	-64	179.1	80.1	167	5.3	113.7	S778 M830 N832 H860 M861 F862 I922	S778-R864 VanDerWaalsContact OG-CG 3.32Å; S778-R864 WeakPolarHBondContact OG-CG 3.34Å; M830-R864 PolarHBondContact O-NH1 3.15Å; M830-R864 PolarHBondContact O-NH2 3.08Å; M830-R864 VanDerWaalsContact O-NH2 3.15Å; N832-R864 WeakPolarHBondContact OD1-CD 3.34Å; N832-R864 PolarHBondContact OD1-NE 3.18Å; N832-R864 PolarHBondContact OD1-NH1 2.7Å; H860-R864 PolarHBondContact O-N 2.62Å; M861-R864 PolarHBondContact O-N 3.06Å; M861-R864 VanDerWaalsContact O-N 3.13Å; F862-R864 PolarHBondContact O-N 3.02Å; R864-I922 HydrophobicContact CB-CD1 3.67Å
865	A	87.1	Confident	88.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-69.6	160.2	-176.1	0	0	0	0	0	112.9	R777 M861 F862 I869 I922	R777-A865 PolarHBondContact NE-O 2.8Å; R777-A865 PolarHBondContact NH1-O 3.44Å; R777-A865 VanDerWaalsContact NH1-O 3.14Å; R777-A865 PolarHBondContact NH2-O 3Å; M861-A865 PolarHBondContact O-N 3.2Å; F862-A865 WeakPolarHBondContact O-CB 3.43Å; F862-A865 PolarHBondContact O-N 3.39Å; A865-I869 HydrophobicContact CB-CB 3.87Å; A865-I869 HydrophobicContact CB-CD1 4.14Å; A865-I869 HydrophobicContact CB-CG1 4.47Å; A865-I869 HydrophobicContact CB-CG2 4.21Å; A865-I922 HydrophobicContact CB-CD1 4.38Å; A865-I922 HydrophobicContact CB-CG2 3.91Å
866	P	83.6	Confident	88.2	Confident	61 Å²	61	29.6 Å²	29.6	40%	0.396	15%	0.152	S	C	.	.			trans	-70.5	158	171	-13.7	28.2	0	0	0	112	R777 E868 I869 P920	R777-P866 PolarHBondContact NH2-O 3.37Å; P866-E868 PolarHBondContact O-N 3.03Å; P866-I869 PolarHBondContact O-N 2.88Å; P866-P920 HydrophobicContact CG-CB 4.19Å; P866-P920 HydrophobicContact CG-CG 4.46Å
867	D	80.7	Confident	88.1	Confident	121 Å²	121	32.8 Å²	32.8	65%	0.647	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-13.7	-174.3	-62.3	-21.2	0	0	0	114.9	R777 I869	R777-D867 IonicContact CZ-OD1 3.03Å; R777-D867 IonicContact NE-OD1 3.29Å; R777-D867 PolarHBondContact NE-OD1 3.49Å; R777-D867 IonicContact NH2-OD1 3.42Å; R777-D867 PolarHBondContact NH2-OD1 3.19Å; D867-I869 VanDerWaalsContact C-N 3.35Å
868	E	84	Confident	88.3	Confident	53 Å²	53	36.2 Å²	36.2	25%	0.248	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-39.5	167.7	-151.3	-162.2	131.7	0	0	113	P866 R870 Y907 Q916	P866-E868 PolarHBondContact O-N 3.03Å; E868-R870 PolarHBondContact O-N 3.17Å; E868-Y907 HydrophobicContact CB-CE2 4.46Å; E868-Y907 VanDerWaalsContact CD-OH 3.27Å; E868-Y907 HydrophobicContact CG-CE2 4Å; E868-Y907 WeakPolarHBondContact OE1-CE2 3.35Å; E868-Y907 PolarHBondContact OE1-OH 3.45Å; E868-Q916 PolarHBondContact OE1-NE2 3.17Å; E868-Q916 PolarHBondContact OE1-OE1 3.25Å; E868-Q916 PolarHBondContact OE2-NE2 3.27Å
869	I	85.6	Confident	88.3	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.221	C	C	.	.	S	Bend	trans	-91.9	99.3	176.7	-56.6	178.2	0	0	0	108.4	F862 A865 P866 D867 Y907 P920 I922	F862-I869 HydrophobicContact CD1-CG2 3.91Å; F862-I869 HydrophobicContact CE1-CG2 4Å; A865-I869 HydrophobicContact CB-CB 3.87Å; A865-I869 HydrophobicContact CB-CD1 4.14Å; A865-I869 HydrophobicContact CB-CG1 4.47Å; A865-I869 HydrophobicContact CB-CG2 4.21Å; P866-I869 PolarHBondContact O-N 2.88Å; D867-I869 VanDerWaalsContact C-N 3.35Å; I869-Y907 HydrophobicContact CD1-CD1 4.41Å; I869-Y907 HydrophobicContact CD1-CE1 3.95Å; I869-Y907 HydrophobicContact CG1-CD1 4.05Å; I869-Y907 HydrophobicContact CG1-CD2 4.09Å; I869-Y907 HydrophobicContact CG1-CE1 3.71Å; I869-Y907 HydrophobicContact CG1-CE2 3.77Å; I869-Y907 HydrophobicContact CG1-CG 4.22Å; I869-P920 HydrophobicContact CD1-CG 4.33Å; I869-I922 HydrophobicContact CD1-CG2 4.16Å
870	R	85.7	Confident	88.1	Confident	126 Å²	126	41.9 Å²	41.9	48%	0.475	24%	0.235	S	C	.	.			trans	-74.4	152.9	176.2	-60.3	178.9	-171.6	168.4	2.7	110.9	E868 I875	E868-R870 PolarHBondContact O-N 3.17Å; R870-I875 HydrophobicContact CB-CD1 4.43Å; R870-I875 HydrophobicContact CB-CG1 4.17Å
871	Y	89.5	Confident	88	Confident	21 Å²	21	45.6 Å²	45.6	8%	0.082	26%	0.255	C	S	.	.			trans	-64.9	143.4	174.3	-67.2	-71.8	0	0	0	111.7	L775 R777 F862 S863 H873 I874 I875	L775-Y871 HydrophobicContact CD2-CD1 4.31Å; L775-Y871 HydrophobicContact CD2-CE1 4.48Å; L775-Y871 PolarHBondContact O-OH 2.59Å; R777-Y871 PolarHBondContact N-OH 3.1Å; F862-Y871 HydrophobicContact CB-CD1 3.99Å; F862-Y871 HydrophobicContact CB-CE1 4.1Å; S863-Y871 VanDerWaalsContact CA-OH 3.27Å; S863-Y871 WeakPolarHBondContact CA-OH 3.15Å; S863-Y871 WeakPolarHBondContact CB-OH 3.32Å; Y871-H873 VanDerWaalsContact C-N 3.26Å; Y871-H873 VanDerWaalsContact CB-CE1 3.4Å; Y871-H873 WeakPolarHBondContact CB-CE1 3.28Å; Y871-H873 WeakPolarHBondContact CB-ND1 3.38Å; Y871-H873 AromaticContact CG-CE1 3.83Å; Y871-H873 PolarHBondContact O-N 2.96Å; Y871-H873 VanDerWaalsContact O-N 3.16Å; Y871-I874 HydrophobicContact CD2-CD1 4Å; Y871-I874 WeakPolarHBondContact O-CB 3.35Å; Y871-I874 PolarHBondContact O-N 3.32Å; Y871-I875 PolarHBondContact O-N 3.29Å
872	P	87.6	Confident	88.1	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-54.1	-36.5	180	-32.3	39.7	0	0	0	114.8	F862 I874 I875 A876 F899 L900	F862-P872 HydrophobicContact CD1-CG 4.44Å; F862-P872 HydrophobicContact CE1-CG 4.07Å; F862-P872 HydrophobicContact CE2-CG 4.3Å; F862-P872 HydrophobicContact CZ-CG 3.99Å; P872-I874 VanDerWaalsContact C-N 3.34Å; P872-I874 PolarHBondContact O-N 2.75Å; P872-I875 PolarHBondContact O-N 2.9Å; P872-A876 PolarHBondContact O-N 3.24Å; P872-F899 HydrophobicContact CB-CD1 4.17Å; P872-F899 HydrophobicContact CB-CE1 3.8Å; P872-L900 HydrophobicContact CB-CD2 4.33Å; P872-L900 HydrophobicContact CG-CD2 3.78Å
873	H	91	Very high	88.2	Confident	7 Å²	7	51.2 Å²	51.2	3%	0.032	28%	0.277	C	S	.	.	H	α-helix	trans	-66.9	-32.8	178.4	73	-88.6	0	0	0	113.2	Y871 A876 G877 W878 Y883	Y871-H873 VanDerWaalsContact C-N 3.26Å; Y871-H873 VanDerWaalsContact CB-CE1 3.4Å; Y871-H873 WeakPolarHBondContact CB-CE1 3.28Å; Y871-H873 WeakPolarHBondContact CB-ND1 3.38Å; Y871-H873 AromaticContact CG-CE1 3.83Å; Y871-H873 PolarHBondContact O-N 2.96Å; Y871-H873 VanDerWaalsContact O-N 3.16Å; H873-A876 PolarHBondContact O-N 3.23Å; H873-G877 PolarHBondContact O-N 3.36Å; H873-W878 HydrophobicContact CB-CB 4.23Å; H873-W878 PolarHBondContact CD2-O 3.37Å; H873-W878 PolarHBondContact O-N 3.03Å; H873-Y883 HydrophobicContact CB-CD1 3.63Å; H873-Y883 HydrophobicContact CB-CD2 3.87Å; H873-Y883 HydrophobicContact CB-CE1 4.12Å; H873-Y883 HydrophobicContact CB-CE2 4.33Å; H873-Y883 HydrophobicContact CB-CG 3.48Å; H873-Y883 VanDerWaalsContact CB-CG 3.48Å; H873-Y883 AromaticContact CG-CD1 3.72Å; H873-Y883 AromaticContact CG-CG 3.99Å; H873-Y883 AromaticContact ND1-CD1 3.68Å; H873-Y883 AromaticContact ND1-CE1 3.98Å
874	I	88.8	Confident	88.3	Confident	88 Å²	88	51.3 Å²	51.3	45%	0.451	28%	0.278	S	S	.	.	H	α-helix	trans	-69.5	-41.1	176.9	-59.8	177.6	0	0	0	109.8	Y871 P872 A876 G877	Y871-I874 HydrophobicContact CD2-CD1 4Å; Y871-I874 WeakPolarHBondContact O-CB 3.35Å; Y871-I874 PolarHBondContact O-N 3.32Å; P872-I874 VanDerWaalsContact C-N 3.34Å; P872-I874 PolarHBondContact O-N 2.75Å; I874-A876 VanDerWaalsContact C-N 3.27Å; I874-A876 PolarHBondContact O-N 3.04Å; I874-G877 PolarHBondContact O-N 3.38Å
875	I	86.9	Confident	88.3	Confident	61 Å²	61	52.1 Å²	52.1	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-38.7	176.2	-59.3	172.5	0	0	0	110.4	R870 Y871 P872 G877 A906	R870-I875 HydrophobicContact CB-CD1 4.43Å; R870-I875 HydrophobicContact CB-CG1 4.17Å; Y871-I875 PolarHBondContact O-N 3.29Å; P872-I875 PolarHBondContact O-N 2.9Å; I875-G877 PolarHBondContact O-N 3.27Å; I875-A906 HydrophobicContact CD1-CB 4.29Å; I875-A906 HydrophobicContact CG2-CB 3.82Å
876	A	88.6	Confident	88.6	Confident	47 Å²	47	53.4 Å²	53.4	39%	0.388	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.8	175.9	0	0	0	0	0	114.4	P872 H873 I874 W878 F899	P872-A876 PolarHBondContact O-N 3.24Å; H873-A876 PolarHBondContact O-N 3.23Å; I874-A876 VanDerWaalsContact C-N 3.27Å; I874-A876 PolarHBondContact O-N 3.04Å; A876-W878 VanDerWaalsContact C-N 3.32Å; A876-W878 HydrophobicContact CB-CD2 4.35Å; A876-W878 HydrophobicContact CB-CG 4.25Å; A876-W878 PolarHBondContact O-N 2.79Å; A876-F899 HydrophobicContact CB-CE2 4.34Å; A876-F899 HydrophobicContact CB-CZ 4.03Å
877	G	89.5	Confident	88.9	Confident	68 Å²	68	50.5 Å²	50.5	70%	0.701	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	20.4	-177.3	0	0	0	0	0	114.6	H873 I874 I875	H873-G877 PolarHBondContact O-N 3.36Å; I874-G877 PolarHBondContact O-N 3.38Å; I875-G877 PolarHBondContact O-N 3.27Å
878	W	92.4	Very high	89.2	Confident	73 Å²	73	46.4 Å²	46.4	28%	0.277	25%	0.253	S	S	.	.			trans	-88.6	144.1	179.3	-67.7	3	0	0	0	111.4	H873 A876 Y882 Y883 W886 F899	H873-W878 HydrophobicContact CB-CB 4.23Å; H873-W878 PolarHBondContact CD2-O 3.37Å; H873-W878 PolarHBondContact O-N 3.03Å; A876-W878 VanDerWaalsContact C-N 3.32Å; A876-W878 HydrophobicContact CB-CD2 4.35Å; A876-W878 HydrophobicContact CB-CG 4.25Å; A876-W878 PolarHBondContact O-N 2.79Å; W878-Y882 HydrophobicContact CB-CD1 3.99Å; W878-Y882 AromaticContact CD2-CD1 3.75Å; W878-Y882 HydrophobicContact CD2-CD1 3.75Å; W878-Y882 AromaticContact CD2-CE1 3.62Å; W878-Y882 HydrophobicContact CD2-CE1 3.62Å; W878-Y882 AromaticContact CE2-CE1 3.77Å; W878-Y882 AromaticContact CE3-CD1 3.98Å; W878-Y882 HydrophobicContact CE3-CD1 3.98Å; W878-Y882 AromaticContact CE3-CE1 3.91Å; W878-Y882 HydrophobicContact CE3-CE1 3.91Å; W878-Y882 AromaticContact CG-CD1 3.76Å; W878-Y882 HydrophobicContact CG-CD1 3.76Å; W878-Y882 AromaticContact CG-CE1 3.97Å; W878-Y882 HydrophobicContact CG-CE1 3.97Å; W878-Y882 HydrophobicContact CH2-CE1 4.45Å; W878-Y882 HydrophobicContact CZ2-CE1 4.2Å; W878-Y882 HydrophobicContact CZ3-CE1 4.32Å; W878-Y883 AromaticContact CE3-CD2 3.74Å; W878-Y883 HydrophobicContact CE3-CD2 3.74Å; W878-Y883 AromaticContact CZ3-CD2 3.94Å; W878-Y883 HydrophobicContact CZ3-CD2 3.94Å; W878-Y883 HydrophobicContact CZ3-CE2 4.43Å; W878-W886 HydrophobicContact CH2-CD2 4.37Å; W878-W886 HydrophobicContact CH2-CG 4.47Å; W878-W886 AromaticContact CH2-NE1 3.98Å; W878-W886 AromaticContact CZ3-CD2 3.95Å; W878-W886 HydrophobicContact CZ3-CD2 3.95Å; W878-W886 HydrophobicContact CZ3-CE3 4.31Å; W878-W886 HydrophobicContact CZ3-CG 4.08Å; W878-F899 HydrophobicContact CD2-CZ 4.45Å; W878-F899 HydrophobicContact CE3-CE2 4.32Å; W878-F899 AromaticContact CE3-CZ 3.86Å; W878-F899 HydrophobicContact CE3-CZ 3.86Å; W878-F899 HydrophobicContact CH2-CD2 4.35Å; W878-F899 AromaticContact CH2-CE2 3.67Å; W878-F899 HydrophobicContact CH2-CE2 3.67Å; W878-F899 HydrophobicContact CH2-CZ 4.05Å; W878-F899 HydrophobicContact CZ2-CE2 4.19Å; W878-F899 HydrophobicContact CZ3-CE1 4.33Å; W878-F899 AromaticContact CZ3-CE2 3.74Å; W878-F899 HydrophobicContact CZ3-CE2 3.74Å; W878-F899 AromaticContact CZ3-CZ 3.64Å; W878-F899 HydrophobicContact CZ3-CZ 3.64Å
879	S	91.2	Very high	89.3	Confident	71 Å²	71	51.8 Å²	51.8	50%	0.497	28%	0.276	S	S	.	.			trans	-74.4	153.5	170.2	71	0	0	0	0	111.1	N881 Y882 Y883	S879-N881 VanDerWaalsContact C-N 3.27Å; S879-N881 PolarHBondContact O-N 3.38Å; S879-Y882 PolarHBondContact O-N 2.75Å; S879-Y882 VanDerWaalsContact O-N 3.15Å; S879-Y882 VanDerWaalsContact OG-CB 3.31Å; S879-Y882 WeakPolarHBondContact OG-CB 3.5Å; S879-Y882 PolarHBondContact OG-N 3.13Å; S879-Y883 PolarHBondContact O-N 3.45Å
880	T	89.1	Confident	89.2	Confident	48 Å²	48	56.2 Å²	56.2	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-54.9	-43.8	178.4	-44.8	0	0	0	0	111.8	L775 Y883 V884	L775-T880 HydrophobicContact CD1-CG2 3.94Å; T880-Y883 PolarHBondContact O-N 2.72Å; T880-V884 VanDerWaalsContact O-CG2 3.28Å; T880-V884 WeakPolarHBondContact O-CG2 3.44Å; T880-V884 PolarHBondContact O-N 3.34Å
881	N	88.6	Confident	88.7	Confident	78 Å²	78	59.3 Å²	59.3	42%	0.417	31%	0.312	S	S	.	.	H	α-helix	trans	-66.3	-41.2	179.3	-69.5	-20	0	0	0	112.5	S685 R772 S879 Y883 S885	S685-N881 PolarHBondContact OG-OD1 3.39Å; S685-N881 VanDerWaalsContact OG-OD1 3.1Å; R772-N881 PolarHBondContact NH1-OD1 3.03Å; R772-N881 PolarHBondContact NH2-OD1 3.01Å; S879-N881 VanDerWaalsContact C-N 3.27Å; S879-N881 PolarHBondContact O-N 3.38Å; N881-Y883 VanDerWaalsContact C-N 3.34Å; N881-S885 WeakPolarHBondContact O-CB 3.48Å; N881-S885 PolarHBondContact O-N 3.23Å
882	Y	91.2	Very high	88.5	Confident	119 Å²	119	61.5 Å²	61.5	47%	0.467	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-46.1	176	179.4	-98.8	0	0	0	110.7	W878 S879 S885 W886	W878-Y882 HydrophobicContact CB-CD1 3.99Å; W878-Y882 AromaticContact CD2-CD1 3.75Å; W878-Y882 HydrophobicContact CD2-CD1 3.75Å; W878-Y882 AromaticContact CD2-CE1 3.62Å; W878-Y882 HydrophobicContact CD2-CE1 3.62Å; W878-Y882 AromaticContact CE2-CE1 3.77Å; W878-Y882 AromaticContact CE3-CD1 3.98Å; W878-Y882 HydrophobicContact CE3-CD1 3.98Å; W878-Y882 AromaticContact CE3-CE1 3.91Å; W878-Y882 HydrophobicContact CE3-CE1 3.91Å; W878-Y882 AromaticContact CG-CD1 3.76Å; W878-Y882 HydrophobicContact CG-CD1 3.76Å; W878-Y882 AromaticContact CG-CE1 3.97Å; W878-Y882 HydrophobicContact CG-CE1 3.97Å; W878-Y882 HydrophobicContact CH2-CE1 4.45Å; W878-Y882 HydrophobicContact CZ2-CE1 4.2Å; W878-Y882 HydrophobicContact CZ3-CE1 4.32Å; S879-Y882 PolarHBondContact O-N 2.75Å; S879-Y882 VanDerWaalsContact O-N 3.15Å; S879-Y882 VanDerWaalsContact OG-CB 3.31Å; S879-Y882 WeakPolarHBondContact OG-CB 3.5Å; S879-Y882 PolarHBondContact OG-N 3.13Å; Y882-S885 PolarHBondContact O-N 2.94Å; Y882-S885 PolarHBondContact O-OG 2.96Å; Y882-W886 WeakPolarHBondContact O-CB 3.49Å; Y882-W886 PolarHBondContact O-N 3.15Å
883	Y	93	Very high	88.4	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-44.7	-179.7	-177.4	-127.5	0	0	0	112.9	L775 Q859 H873 W878 S879 T880 N881 S885 W886 L887 F899	L775-Y883 HydrophobicContact CD1-CD1 3.95Å; L775-Y883 HydrophobicContact CD1-CE1 4.39Å; L775-Y883 HydrophobicContact CD2-CD1 4.13Å; L775-Y883 HydrophobicContact CD2-CE1 3.94Å; Q859-Y883 PolarHBondContact OE1-OH 3.41Å; H873-Y883 HydrophobicContact CB-CD1 3.63Å; H873-Y883 HydrophobicContact CB-CD2 3.87Å; H873-Y883 HydrophobicContact CB-CE1 4.12Å; H873-Y883 HydrophobicContact CB-CE2 4.33Å; H873-Y883 HydrophobicContact CB-CG 3.48Å; H873-Y883 VanDerWaalsContact CB-CG 3.48Å; H873-Y883 AromaticContact CG-CD1 3.72Å; H873-Y883 AromaticContact CG-CG 3.99Å; H873-Y883 AromaticContact ND1-CD1 3.68Å; H873-Y883 AromaticContact ND1-CE1 3.98Å; W878-Y883 AromaticContact CE3-CD2 3.74Å; W878-Y883 HydrophobicContact CE3-CD2 3.74Å; W878-Y883 AromaticContact CZ3-CD2 3.94Å; W878-Y883 HydrophobicContact CZ3-CD2 3.94Å; W878-Y883 HydrophobicContact CZ3-CE2 4.43Å; S879-Y883 PolarHBondContact O-N 3.45Å; T880-Y883 PolarHBondContact O-N 2.72Å; N881-Y883 VanDerWaalsContact C-N 3.34Å; Y883-S885 VanDerWaalsContact C-N 3.33Å; Y883-S885 PolarHBondContact O-N 3.24Å; Y883-W886 HydrophobicContact CD2-CE3 4.05Å; Y883-W886 AromaticContact CE2-CE3 3.83Å; Y883-W886 HydrophobicContact CE2-CE3 3.83Å; Y883-W886 AromaticContact CE2-CZ3 3.9Å; Y883-W886 HydrophobicContact CE2-CZ3 3.9Å; Y883-W886 WeakPolarHBondContact O-CB 3.22Å; Y883-W886 PolarHBondContact O-N 3.2Å; Y883-W886 VanDerWaalsContact O-N 3.15Å; Y883-L887 HydrophobicContact CD1-CD1 3.88Å; Y883-L887 HydrophobicContact CD2-CD1 4.45Å; Y883-L887 HydrophobicContact CD2-CG 4.34Å; Y883-L887 HydrophobicContact CE1-CD1 3.51Å; Y883-L887 HydrophobicContact CE1-CG 4.28Å; Y883-L887 HydrophobicContact CE2-CD1 4.15Å; Y883-L887 HydrophobicContact CE2-CD2 4.2Å; Y883-L887 HydrophobicContact CE2-CG 4.01Å; Y883-L887 HydrophobicContact CG-CD1 4.35Å; Y883-L887 WeakPolarHBondContact O-CG 3.31Å; Y883-L887 PolarHBondContact O-N 2.63Å; Y883-F899 HydrophobicContact CD2-CE1 4.18Å; Y883-F899 AromaticContact CE2-CD1 3.83Å; Y883-F899 HydrophobicContact CE2-CD1 3.83Å; Y883-F899 AromaticContact CE2-CE1 3.44Å; Y883-F899 HydrophobicContact CE2-CE1 3.44Å; Y883-F899 VanDerWaalsContact CE2-CE1 3.44Å; Y883-F899 HydrophobicContact CE2-CZ 4.28Å; Y883-F899 AromaticContact CZ-CE1 3.99Å
884	V	91	Very high	88.2	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-43.5	175.4	172.1	0	0	0	0	110.7	W771 R772 L775 T880 W886 L887 V888	W771-V884 HydrophobicContact CB-CG1 4.37Å; R772-V884 HydrophobicContact CG-CB 4.36Å; R772-V884 HydrophobicContact CG-CG1 3.89Å; R772-V884 HydrophobicContact CG-CG2 3.68Å; L775-V884 HydrophobicContact CD1-CG2 3.6Å; T880-V884 VanDerWaalsContact O-CG2 3.28Å; T880-V884 WeakPolarHBondContact O-CG2 3.44Å; T880-V884 PolarHBondContact O-N 3.34Å; V884-W886 PolarHBondContact O-N 3.05Å; V884-L887 PolarHBondContact O-N 3.06Å; V884-V888 HydrophobicContact CG1-CG2 4.27Å; V884-V888 WeakPolarHBondContact O-CG2 3.23Å; V884-V888 PolarHBondContact O-N 3.19Å
885	S	89.4	Confident	88.1	Confident	46 Å²	46	65.2 Å²	65.2	32%	0.322	35%	0.347	S	S	.	.	H	α-helix	trans	-61.2	-34.8	176.8	89.3	0	0	0	0	112.3	N881 Y882 Y883 K889	N881-S885 WeakPolarHBondContact O-CB 3.48Å; N881-S885 PolarHBondContact O-N 3.23Å; Y882-S885 PolarHBondContact O-N 2.94Å; Y882-S885 PolarHBondContact O-OG 2.96Å; Y883-S885 VanDerWaalsContact C-N 3.33Å; Y883-S885 PolarHBondContact O-N 3.24Å; S885-K889 WeakPolarHBondContact O-CB 3.35Å; S885-K889 VanDerWaalsContact O-CG 3.23Å; S885-K889 WeakPolarHBondContact O-CG 3.45Å; S885-K889 PolarHBondContact O-N 3.04Å
886	W	92.4	Very high	88.3	Confident	26 Å²	26	63 Å²	63	10%	0.098	33%	0.334	C	S	.	.	H	α-helix	trans	-70.2	-42.5	177	177.4	94.5	0	0	0	111.6	W878 Y882 Y883 V884 K889 R890 R896 F899	W878-W886 HydrophobicContact CH2-CD2 4.37Å; W878-W886 HydrophobicContact CH2-CG 4.47Å; W878-W886 AromaticContact CH2-NE1 3.98Å; W878-W886 AromaticContact CZ3-CD2 3.95Å; W878-W886 HydrophobicContact CZ3-CD2 3.95Å; W878-W886 HydrophobicContact CZ3-CE3 4.31Å; W878-W886 HydrophobicContact CZ3-CG 4.08Å; Y882-W886 WeakPolarHBondContact O-CB 3.49Å; Y882-W886 PolarHBondContact O-N 3.15Å; Y883-W886 HydrophobicContact CD2-CE3 4.05Å; Y883-W886 AromaticContact CE2-CE3 3.83Å; Y883-W886 HydrophobicContact CE2-CE3 3.83Å; Y883-W886 AromaticContact CE2-CZ3 3.9Å; Y883-W886 HydrophobicContact CE2-CZ3 3.9Å; Y883-W886 WeakPolarHBondContact O-CB 3.22Å; Y883-W886 PolarHBondContact O-N 3.2Å; Y883-W886 VanDerWaalsContact O-N 3.15Å; V884-W886 PolarHBondContact O-N 3.05Å; W886-K889 PolarHBondContact O-N 3.21Å; W886-R890 VanDerWaalsContact CE2-CZ 3.46Å; W886-R890 VanDerWaalsContact CE2-NE 3.26Å; W886-R890 VanDerWaalsContact CZ2-NH1 3.34Å; W886-R890 PolarHBondContact O-N 3.01Å; W886-R896 HydrophobicContact CH2-CG 4.45Å; W886-R896 HydrophobicContact CZ3-CG 4.26Å; W886-F899 HydrophobicContact CH2-CB 3.92Å; W886-F899 HydrophobicContact CH2-CD1 4.49Å; W886-F899 HydrophobicContact CH2-CG 4.07Å; W886-F899 HydrophobicContact CZ3-CD1 4.49Å
887	L	90.4	Very high	88.4	Confident	1 Å²	1	61 Å²	61	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-46.2	176.6	-74.7	168.6	0	0	0	111.8	W771 Y883 V884 K889 R896	W771-L887 HydrophobicContact CB-CD1 4.32Å; W771-L887 HydrophobicContact CD2-CB 3.97Å; W771-L887 HydrophobicContact CD2-CD1 3.91Å; W771-L887 HydrophobicContact CD2-CG 4.37Å; W771-L887 HydrophobicContact CE3-CB 4.46Å; W771-L887 HydrophobicContact CE3-CD1 3.65Å; W771-L887 HydrophobicContact CE3-CD2 4.3Å; W771-L887 HydrophobicContact CE3-CG 4.37Å; W771-L887 HydrophobicContact CG-CB 4.03Å; W771-L887 HydrophobicContact CG-CD1 4.2Å; W771-L887 HydrophobicContact CH2-CD2 4.38Å; W771-L887 HydrophobicContact CZ3-CD1 4.26Å; W771-L887 HydrophobicContact CZ3-CD2 4.19Å; Y883-L887 HydrophobicContact CD1-CD1 3.88Å; Y883-L887 HydrophobicContact CD2-CD1 4.45Å; Y883-L887 HydrophobicContact CD2-CG 4.34Å; Y883-L887 HydrophobicContact CE1-CD1 3.51Å; Y883-L887 HydrophobicContact CE1-CG 4.28Å; Y883-L887 HydrophobicContact CE2-CD1 4.15Å; Y883-L887 HydrophobicContact CE2-CD2 4.2Å; Y883-L887 HydrophobicContact CE2-CG 4.01Å; Y883-L887 HydrophobicContact CG-CD1 4.35Å; Y883-L887 WeakPolarHBondContact O-CG 3.31Å; Y883-L887 PolarHBondContact O-N 2.63Å; V884-L887 PolarHBondContact O-N 3.06Å; L887-K889 VanDerWaalsContact C-N 3.35Å; L887-K889 PolarHBondContact O-N 3.37Å; L887-R896 HydrophobicContact CD2-CG 4.12Å; L887-R896 PolarHBondContact O-NE 2.62Å; L887-R896 PolarHBondContact O-NH2 2.94Å
888	V	87.2	Confident	88.3	Confident	34 Å²	34	61.3 Å²	61.3	21%	0.206	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-35.8	-178.8	174.5	0	0	0	0	111.8	M764 N767 V884	M764-V888 HydrophobicContact CG-CG1 3.91Å; N767-V888 HydrophobicContact CB-CG1 4.49Å; N767-V888 HydrophobicContact CB-CG2 4.38Å; V884-V888 HydrophobicContact CG1-CG2 4.27Å; V884-V888 WeakPolarHBondContact O-CG2 3.23Å; V884-V888 PolarHBondContact O-N 3.19Å
889	K	86	Confident	88.3	Confident	167 Å²	167	59.5 Å²	59.5	73%	0.726	30%	0.296	S	S	*	.	H	α-helix	trans	-80	-24.9	-177.3	-75.1	175.5	-179.2	177.2	0	114.9	S885 W886 L887	S885-K889 WeakPolarHBondContact O-CB 3.35Å; S885-K889 VanDerWaalsContact O-CG 3.23Å; S885-K889 WeakPolarHBondContact O-CG 3.45Å; S885-K889 PolarHBondContact O-N 3.04Å; W886-K889 PolarHBondContact O-N 3.21Å; L887-K889 VanDerWaalsContact C-N 3.35Å; L887-K889 PolarHBondContact O-N 3.37Å
890	R	83.6	Confident	88.3	Confident	94 Å²	94	56.2 Å²	56.2	36%	0.355	27%	0.273	S	S	.	.			trans	-90.4	124.5	-178.3	-75.4	-164.7	174.5	-162.7	7.4	110.7	W886 E895 R896	W886-R890 VanDerWaalsContact CE2-CZ 3.46Å; W886-R890 VanDerWaalsContact CE2-NE 3.26Å; W886-R890 VanDerWaalsContact CZ2-NH1 3.34Å; W886-R890 PolarHBondContact O-N 3.01Å; R890-E895 IonicContact CZ-OE2 2.95Å; R890-E895 IonicContact NE-OE2 3.99Å; R890-E895 IonicContact NH1-OE2 2.74Å; R890-E895 PolarHBondContact NH1-OE2 3.44Å; R890-R896 PolarHBondContact O-NE 3.29Å; R890-R896 PolarHBondContact O-NH2 3.09Å
891	E	76.1	Confident	88.3	Confident	190 Å²	190	56.5 Å²	56.5	89%	0.888	27%	0.268	S	S	*	.			trans	-84.2	-24.5	178.5	-65.3	177.1	177.8	0	0	113.2	D893	E891-D893 PolarHBondContact O-N 3.22Å
892	N	84.5	Confident	88.3	Confident	68 Å²	68	57.6 Å²	57.6	36%	0.364	27%	0.274	S	S	.	.			trans	-78.7	110.8	-175.3	-172	0.6	0	0	0	112.7	T894 E895	N892-T894 VanDerWaalsContact CG-OG1 3.31Å; N892-T894 PolarHBondContact ND2-OG1 3.19Å; N892-T894 PolarHBondContact O-N 3.18Å; N892-T894 PolarHBondContact OD1-N 3.24Å; N892-T894 PolarHBondContact OD1-OG1 3.31Å; N892-E895 HydrophobicContact CB-CG 4.38Å; N892-E895 PolarHBondContact ND2-OE1 3.42Å; N892-E895 VanDerWaalsContact ND2-OE1 3.1Å
893	D	86.2	Confident	88.2	Confident	24 Å²	24	52.2 Å²	52.2	13%	0.128	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-31.7	-178.1	-153.9	59.3	0	0	0	113.7	L853 P854 S855 E891 E895 R896 L897	L853-D893 HydrophobicContact CD2-CB 4.1Å; L853-D893 WeakPolarHBondContact CD2-OD1 3.33Å; P854-D893 VanDerWaalsContact CD-OD2 3.28Å; P854-D893 WeakPolarHBondContact CD-OD2 3.48Å; S855-D893 VanDerWaalsContact CB-OD1 3.29Å; S855-D893 WeakPolarHBondContact CB-OD1 3.25Å; S855-D893 PolarHBondContact N-OD2 3.28Å; S855-D893 VanDerWaalsContact N-OD2 3.08Å; S855-D893 PolarHBondContact OG-OD1 3.23Å; E891-D893 PolarHBondContact O-N 3.22Å; D893-E895 PolarHBondContact O-N 3.44Å; D893-R896 WeakPolarHBondContact O-CB 3.37Å; D893-R896 PolarHBondContact O-N 3.43Å; D893-R896 IonicContact OD1-NH1 2.87Å; D893-R896 PolarHBondContact OD1-NH1 3.41Å; D893-L897 PolarHBondContact O-N 3.26Å
894	T	85.8	Confident	87.9	Confident	73 Å²	73	52.7 Å²	52.7	45%	0.448	26%	0.258	S	S	.	.	H	α-helix	trans	-64.4	-40	-179.3	59.2	0	0	0	0	112.2	N892 R896 L897 I898	N892-T894 VanDerWaalsContact CG-OG1 3.31Å; N892-T894 PolarHBondContact ND2-OG1 3.19Å; N892-T894 PolarHBondContact O-N 3.18Å; N892-T894 PolarHBondContact OD1-N 3.24Å; N892-T894 PolarHBondContact OD1-OG1 3.31Å; T894-R896 VanDerWaalsContact C-N 3.3Å; T894-R896 PolarHBondContact O-N 2.96Å; T894-L897 WeakPolarHBondContact O-CB 3.48Å; T894-L897 PolarHBondContact O-N 2.8Å; T894-I898 VanDerWaalsContact O-CG1 3.28Å; T894-I898 WeakPolarHBondContact O-CG1 3.35Å; T894-I898 PolarHBondContact O-N 2.79Å
895	E	87.5	Confident	87.8	Confident	79 Å²	79	55.6 Å²	55.6	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-37.7	175.7	-76	174.4	-149.9	0	0	112.3	R890 N892 D893 I898 F899	R890-E895 IonicContact CZ-OE2 2.95Å; R890-E895 IonicContact NE-OE2 3.99Å; R890-E895 IonicContact NH1-OE2 2.74Å; R890-E895 PolarHBondContact NH1-OE2 3.44Å; N892-E895 HydrophobicContact CB-CG 4.38Å; N892-E895 PolarHBondContact ND2-OE1 3.42Å; N892-E895 VanDerWaalsContact ND2-OE1 3.1Å; D893-E895 PolarHBondContact O-N 3.44Å; E895-I898 PolarHBondContact O-N 3.06Å; E895-F899 PolarHBondContact O-N 2.61Å
896	R	91.3	Very high	87.6	Confident	15 Å²	15	54.9 Å²	54.9	6%	0.057	28%	0.275	C	S	.	.	H	α-helix	trans	-63.7	-45.8	175.3	-61	176.3	-177.6	148.9	-13.6	110	S855 W886 L887 R890 D893 T894 I898 F899 L900	S855-R896 WeakPolarHBondContact OG-CD 3.32Å; W886-R896 HydrophobicContact CH2-CG 4.45Å; W886-R896 HydrophobicContact CZ3-CG 4.26Å; L887-R896 HydrophobicContact CD2-CG 4.12Å; L887-R896 PolarHBondContact O-NE 2.62Å; L887-R896 PolarHBondContact O-NH2 2.94Å; R890-R896 PolarHBondContact O-NE 3.29Å; R890-R896 PolarHBondContact O-NH2 3.09Å; D893-R896 WeakPolarHBondContact O-CB 3.37Å; D893-R896 PolarHBondContact O-N 3.43Å; D893-R896 IonicContact OD1-NH1 2.87Å; D893-R896 PolarHBondContact OD1-NH1 3.41Å; T894-R896 VanDerWaalsContact C-N 3.3Å; T894-R896 PolarHBondContact O-N 2.96Å; R896-I898 PolarHBondContact O-N 3.43Å; R896-F899 WeakPolarHBondContact O-CB 3.35Å; R896-F899 PolarHBondContact O-N 2.95Å; R896-L900 WeakPolarHBondContact O-CG 3.42Å; R896-L900 PolarHBondContact O-N 2.99Å
897	L	89.4	Confident	87.4	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-42.3	176.3	-72.2	169.9	0	0	0	112.5	P854 C858 D893 T894 F899 L900 R901 L930 H933 I934	P854-L897 HydrophobicContact CB-CD1 4.22Å; P854-L897 HydrophobicContact CB-CD2 4.47Å; C858-L897 HydrophobicContact CB-CD2 4.14Å; D893-L897 PolarHBondContact O-N 3.26Å; T894-L897 WeakPolarHBondContact O-CB 3.48Å; T894-L897 PolarHBondContact O-N 2.8Å; L897-F899 VanDerWaalsContact C-N 3.31Å; L897-F899 PolarHBondContact O-N 3.27Å; L897-L900 WeakPolarHBondContact O-CB 3.4Å; L897-L900 PolarHBondContact O-N 2.87Å; L897-L900 VanDerWaalsContact O-N 3.13Å; L897-R901 PolarHBondContact O-N 3.45Å; L897-L930 HydrophobicContact CD2-CD2 3.98Å; L897-H933 HydrophobicContact CD1-CB 3.7Å; L897-I934 HydrophobicContact CB-CD1 3.84Å; L897-I934 HydrophobicContact CB-CG1 3.85Å; L897-I934 WeakPolarHBondContact O-CD1 3.36Å
898	I	88.9	Confident	87.1	Confident	74 Å²	74	55 Å²	55	38%	0.379	28%	0.278	S	S	.	.	H	α-helix	trans	-60.3	-42.3	175.7	-68.5	163.1	0	0	0	110.7	T894 E895 R896 L900 R901 N902 I934	T894-I898 VanDerWaalsContact O-CG1 3.28Å; T894-I898 WeakPolarHBondContact O-CG1 3.35Å; T894-I898 PolarHBondContact O-N 2.79Å; E895-I898 PolarHBondContact O-N 3.06Å; R896-I898 PolarHBondContact O-N 3.43Å; I898-L900 VanDerWaalsContact C-N 3.32Å; I898-L900 PolarHBondContact O-N 3.31Å; I898-R901 PolarHBondContact O-N 3.11Å; I898-N902 VanDerWaalsContact O-CG 3.28Å; I898-N902 PolarHBondContact O-N 3.35Å; I898-N902 PolarHBondContact O-ND2 2.92Å; I898-I934 HydrophobicContact CG1-CD1 4.4Å; I898-I934 HydrophobicContact CG1-CG2 4.25Å
899	F	91.3	Very high	87	Confident	35 Å²	35	58.8 Å²	58.8	15%	0.154	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-42.3	174.9	-176.8	-96.5	0	0	0	111.9	P872 A876 W878 Y883 W886 E895 R896 L897 N902 G903	P872-F899 HydrophobicContact CB-CD1 4.17Å; P872-F899 HydrophobicContact CB-CE1 3.8Å; A876-F899 HydrophobicContact CB-CE2 4.34Å; A876-F899 HydrophobicContact CB-CZ 4.03Å; W878-F899 HydrophobicContact CD2-CZ 4.45Å; W878-F899 HydrophobicContact CE3-CE2 4.32Å; W878-F899 AromaticContact CE3-CZ 3.86Å; W878-F899 HydrophobicContact CE3-CZ 3.86Å; W878-F899 HydrophobicContact CH2-CD2 4.35Å; W878-F899 AromaticContact CH2-CE2 3.67Å; W878-F899 HydrophobicContact CH2-CE2 3.67Å; W878-F899 HydrophobicContact CH2-CZ 4.05Å; W878-F899 HydrophobicContact CZ2-CE2 4.19Å; W878-F899 HydrophobicContact CZ3-CE1 4.33Å; W878-F899 AromaticContact CZ3-CE2 3.74Å; W878-F899 HydrophobicContact CZ3-CE2 3.74Å; W878-F899 AromaticContact CZ3-CZ 3.64Å; W878-F899 HydrophobicContact CZ3-CZ 3.64Å; Y883-F899 HydrophobicContact CD2-CE1 4.18Å; Y883-F899 AromaticContact CE2-CD1 3.83Å; Y883-F899 HydrophobicContact CE2-CD1 3.83Å; Y883-F899 AromaticContact CE2-CE1 3.44Å; Y883-F899 HydrophobicContact CE2-CE1 3.44Å; Y883-F899 VanDerWaalsContact CE2-CE1 3.44Å; Y883-F899 HydrophobicContact CE2-CZ 4.28Å; Y883-F899 AromaticContact CZ-CE1 3.99Å; W886-F899 HydrophobicContact CH2-CB 3.92Å; W886-F899 HydrophobicContact CH2-CD1 4.49Å; W886-F899 HydrophobicContact CH2-CG 4.07Å; W886-F899 HydrophobicContact CZ3-CD1 4.49Å; E895-F899 PolarHBondContact O-N 2.61Å; R896-F899 WeakPolarHBondContact O-CB 3.35Å; R896-F899 PolarHBondContact O-N 2.95Å; L897-F899 VanDerWaalsContact C-N 3.31Å; L897-F899 PolarHBondContact O-N 3.27Å; F899-N902 PolarHBondContact O-N 3.46Å; F899-G903 PolarHBondContact O-N 3.38Å; F899-G903 VanDerWaalsContact O-N 3.15Å
900	L	91.4	Very high	87	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-40.9	175.2	-63.4	177.2	0	0	0	112.4	C858 Q859 F862 P872 R896 L897 I898 N902 G903 L904 L930	C858-L900 HydrophobicContact CB-CD1 3.74Å; Q859-L900 HydrophobicContact CB-CD1 4.44Å; F862-L900 HydrophobicContact CD2-CD2 4.38Å; F862-L900 HydrophobicContact CE2-CB 4.07Å; F862-L900 HydrophobicContact CE2-CD2 4.26Å; P872-L900 HydrophobicContact CB-CD2 4.33Å; P872-L900 HydrophobicContact CG-CD2 3.78Å; R896-L900 WeakPolarHBondContact O-CG 3.42Å; R896-L900 PolarHBondContact O-N 2.99Å; L897-L900 WeakPolarHBondContact O-CB 3.4Å; L897-L900 PolarHBondContact O-N 2.87Å; L897-L900 VanDerWaalsContact O-N 3.13Å; I898-L900 VanDerWaalsContact C-N 3.32Å; I898-L900 PolarHBondContact O-N 3.31Å; L900-N902 VanDerWaalsContact C-N 3.34Å; L900-N902 PolarHBondContact O-N 3.22Å; L900-G903 PolarHBondContact O-N 2.89Å; L900-L904 PolarHBondContact O-N 3.23Å; L900-L930 HydrophobicContact CB-CD2 4.33Å
901	R	89.9	Confident	87	Confident	55 Å²	55	48.7 Å²	48.7	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-41.8	174.8	-175.5	-178	-178.1	-165.3	-1.3	112	L897 I898 G903 L904 S905 L930 I934 D937	L897-R901 PolarHBondContact O-N 3.45Å; I898-R901 PolarHBondContact O-N 3.11Å; R901-G903 VanDerWaalsContact C-N 3.34Å; R901-G903 PolarHBondContact O-N 3.4Å; R901-L904 PolarHBondContact O-N 3.13Å; R901-S905 WeakPolarHBondContact O-CB 3.4Å; R901-S905 PolarHBondContact O-N 3.42Å; R901-S905 PolarHBondContact O-OG 3.18Å; R901-L930 HydrophobicContact CB-CD1 4.33Å; R901-I934 HydrophobicContact CB-CD1 3.77Å; R901-I934 HydrophobicContact CG-CD1 4.33Å; R901-D937 IonicContact CZ-OD2 2.85Å; R901-D937 IonicContact NH1-OD2 2.67Å; R901-D937 PolarHBondContact NH1-OD2 3.47Å; R901-D937 IonicContact NH2-OD2 2.82Å
902	N	89	Confident	87.4	Confident	100 Å²	100	45.5 Å²	45.5	54%	0.535	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-40.8	177	-67.9	-16.2	0	0	0	111.5	I898 F899 L900 S905 A906	I898-N902 VanDerWaalsContact O-CG 3.28Å; I898-N902 PolarHBondContact O-N 3.35Å; I898-N902 PolarHBondContact O-ND2 2.92Å; F899-N902 PolarHBondContact O-N 3.46Å; L900-N902 VanDerWaalsContact C-N 3.34Å; L900-N902 PolarHBondContact O-N 3.22Å; N902-S905 PolarHBondContact O-N 3.23Å; N902-A906 PolarHBondContact O-N 3.44Å
903	G	87.2	Confident	87.4	Confident	7 Å²	7	48 Å²	48	7%	0.072	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-42.4	173.9	0	0	0	0	0	113.2	F899 L900 R901 S905 A906 Y907	F899-G903 PolarHBondContact O-N 3.38Å; F899-G903 VanDerWaalsContact O-N 3.15Å; L900-G903 PolarHBondContact O-N 2.89Å; R901-G903 VanDerWaalsContact C-N 3.34Å; R901-G903 PolarHBondContact O-N 3.4Å; G903-S905 VanDerWaalsContact C-N 3.33Å; G903-S905 PolarHBondContact O-N 3.08Å; G903-A906 PolarHBondContact O-N 2.9Å; G903-Y907 PolarHBondContact O-N 3.37Å
904	L	88.2	Confident	87.3	Confident	10 Å²	10	52.5 Å²	52.5	5%	0.052	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-39.1	175.3	-164.5	63.5	0	0	0	111.9	F862 L900 R901 A906 Y907 V908 Y923 L926 K927 L930	F862-L904 HydrophobicContact CE1-CD1 4.03Å; F862-L904 HydrophobicContact CZ-CB 4.05Å; F862-L904 HydrophobicContact CZ-CD1 4.08Å; L900-L904 PolarHBondContact O-N 3.23Å; R901-L904 PolarHBondContact O-N 3.13Å; L904-A906 VanDerWaalsContact C-N 3.34Å; L904-A906 PolarHBondContact O-N 3.2Å; L904-Y907 WeakPolarHBondContact O-CB 3.38Å; L904-Y907 PolarHBondContact O-N 3.44Å; L904-V908 WeakPolarHBondContact O-CG2 3.47Å; L904-V908 PolarHBondContact O-N 2.62Å; L904-V908 VanDerWaalsContact O-N 3.07Å; L904-Y923 HydrophobicContact CD1-CD2 3.79Å; L904-Y923 HydrophobicContact CD1-CE2 4.05Å; L904-Y923 HydrophobicContact CD2-CD2 4.45Å; L904-Y923 HydrophobicContact CD2-CE2 4.2Å; L904-Y923 HydrophobicContact CG-CD2 4.22Å; L904-Y923 HydrophobicContact CG-CE2 3.96Å; L904-L926 HydrophobicContact CD1-CB 4.48Å; L904-L926 HydrophobicContact CD1-CD1 4.33Å; L904-L926 HydrophobicContact CD2-CB 4.11Å; L904-K927 HydrophobicContact CD2-CB 4.4Å; L904-L930 HydrophobicContact CB-CD1 4.39Å; L904-L930 HydrophobicContact CD2-CD1 3.82Å
905	S	87.8	Confident	86.9	Confident	63 Å²	63	57.1 Å²	57.1	44%	0.441	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-37.3	178.7	-57.4	0	0	0	0	111.9	R901 N902 G903 Y907 V908 H909	R901-S905 WeakPolarHBondContact O-CB 3.4Å; R901-S905 PolarHBondContact O-N 3.42Å; R901-S905 PolarHBondContact O-OG 3.18Å; N902-S905 PolarHBondContact O-N 3.23Å; G903-S905 VanDerWaalsContact C-N 3.33Å; G903-S905 PolarHBondContact O-N 3.08Å; S905-Y907 VanDerWaalsContact C-N 3.34Å; S905-Y907 PolarHBondContact O-N 2.86Å; S905-V908 WeakPolarHBondContact O-CB 3.49Å; S905-V908 PolarHBondContact O-N 3.43Å; S905-H909 PolarHBondContact O-N 3.05Å; S905-H909 VanDerWaalsContact O-N 3.08Å
906	A	86.2	Confident	86.6	Confident	31 Å²	31	57 Å²	57	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-40.4	172.9	0	0	0	0	0	112.1	I875 N902 G903 L904 H909 E910	I875-A906 HydrophobicContact CD1-CB 4.29Å; I875-A906 HydrophobicContact CG2-CB 3.82Å; N902-A906 PolarHBondContact O-N 3.44Å; G903-A906 PolarHBondContact O-N 2.9Å; L904-A906 VanDerWaalsContact C-N 3.34Å; L904-A906 PolarHBondContact O-N 3.2Å; A906-H909 PolarHBondContact O-N 2.94Å; A906-E910 PolarHBondContact O-N 2.95Å
907	Y	86.8	Confident	85.7	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-43.3	172.9	169.5	-105.8	0	0	0	112	E868 I869 G903 L904 S905 H909 E910 V911 Y919 P920 Y923	E868-Y907 HydrophobicContact CB-CE2 4.46Å; E868-Y907 VanDerWaalsContact CD-OH 3.27Å; E868-Y907 HydrophobicContact CG-CE2 4Å; E868-Y907 WeakPolarHBondContact OE1-CE2 3.35Å; E868-Y907 PolarHBondContact OE1-OH 3.45Å; I869-Y907 HydrophobicContact CD1-CD1 4.41Å; I869-Y907 HydrophobicContact CD1-CE1 3.95Å; I869-Y907 HydrophobicContact CG1-CD1 4.05Å; I869-Y907 HydrophobicContact CG1-CD2 4.09Å; I869-Y907 HydrophobicContact CG1-CE1 3.71Å; I869-Y907 HydrophobicContact CG1-CE2 3.77Å; I869-Y907 HydrophobicContact CG1-CG 4.22Å; G903-Y907 PolarHBondContact O-N 3.37Å; L904-Y907 WeakPolarHBondContact O-CB 3.38Å; L904-Y907 PolarHBondContact O-N 3.44Å; S905-Y907 VanDerWaalsContact C-N 3.34Å; S905-Y907 PolarHBondContact O-N 2.86Å; Y907-H909 VanDerWaalsContact C-N 3.27Å; Y907-H909 PolarHBondContact O-N 3.13Å; Y907-E910 WeakPolarHBondContact O-CB 3.36Å; Y907-E910 PolarHBondContact O-N 3.05Å; Y907-E910 VanDerWaalsContact O-N 3.1Å; Y907-V911 HydrophobicContact CD1-CG2 4.24Å; Y907-V911 HydrophobicContact CD2-CG2 4.02Å; Y907-V911 HydrophobicContact CE1-CG2 3.73Å; Y907-V911 HydrophobicContact CE2-CG2 3.46Å; Y907-V911 VanDerWaalsContact CE2-CG2 3.46Å; Y907-V911 HydrophobicContact CG-CG2 4.38Å; Y907-V911 WeakPolarHBondContact O-CG2 3.48Å; Y907-V911 PolarHBondContact O-N 3.18Å; Y907-V911 WeakPolarHBondContact OH-CG2 3.34Å; Y907-Y919 HydrophobicContact CE1-CD1 4.28Å; Y907-P920 WeakPolarHBondContact OH-CD 3.42Å; Y907-Y923 HydrophobicContact CD1-CD2 4.08Å; Y907-Y923 HydrophobicContact CD1-CE2 4.43Å; Y907-Y923 HydrophobicContact CE1-CD2 4.04Å
908	V	85.5	Confident	85.1	Confident	26 Å²	26	75.2 Å²	75.2	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-57.4	-42.8	176	175.6	0	0	0	0	111.3	L904 S905 V911 Q912 Y923	L904-V908 WeakPolarHBondContact O-CG2 3.47Å; L904-V908 PolarHBondContact O-N 2.62Å; L904-V908 VanDerWaalsContact O-N 3.07Å; S905-V908 WeakPolarHBondContact O-CB 3.49Å; S905-V908 PolarHBondContact O-N 3.43Å; V908-V911 PolarHBondContact O-N 3.19Å; V908-Q912 WeakPolarHBondContact O-CG 3.38Å; V908-Q912 PolarHBondContact O-N 3.32Å; V908-Y923 HydrophobicContact CG2-CE2 3.46Å; V908-Y923 VanDerWaalsContact CG2-CE2 3.46Å; V908-Y923 WeakPolarHBondContact CG2-OH 3.33Å
909	H	85.2	Confident	84.9	Confident	113 Å²	113	75.9 Å²	75.9	52%	0.523	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-40.5	176.6	-171.2	-86.2	0	0	0	112	S905 A906 Y907 Q912 I913	S905-H909 PolarHBondContact O-N 3.05Å; S905-H909 VanDerWaalsContact O-N 3.08Å; A906-H909 PolarHBondContact O-N 2.94Å; Y907-H909 VanDerWaalsContact C-N 3.27Å; Y907-H909 PolarHBondContact O-N 3.13Å; H909-Q912 PolarHBondContact O-N 3.04Å; H909-I913 WeakPolarHBondContact ND1-CD1 3.34Å; H909-I913 WeakPolarHBondContact O-CG1 3.33Å; H909-I913 PolarHBondContact O-N 3.38Å; H909-I913 VanDerWaalsContact O-N 3.1Å
910	E	84.8	Confident	84.4	Confident	48 Å²	48	75 Å²	75	22%	0.224	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-42.1	173.3	-73.3	-170.4	-173.4	0	0	112.6	A906 Y907 I913 R914	A906-E910 PolarHBondContact O-N 2.95Å; Y907-E910 WeakPolarHBondContact O-CB 3.36Å; Y907-E910 PolarHBondContact O-N 3.05Å; Y907-E910 VanDerWaalsContact O-N 3.1Å; E910-I913 PolarHBondContact O-N 2.7Å; E910-R914 WeakPolarHBondContact O-CG 3.47Å; E910-R914 PolarHBondContact O-N 3.09Å; E910-R914 IonicContact OE2-CZ 3.69Å; E910-R914 IonicContact OE2-NH2 3.97Å; E910-R914 PolarHBondContact OE2-NH2 3.12Å
911	V	84.6	Confident	84.1	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.006	38%	0.384	C	S	.	.	H	α-helix	trans	-64.6	-40.1	177.7	174.5	0	0	0	0	111.3	Y907 V908 I913 R914 Q915 Q916 Y919	Y907-V911 HydrophobicContact CD1-CG2 4.24Å; Y907-V911 HydrophobicContact CD2-CG2 4.02Å; Y907-V911 HydrophobicContact CE1-CG2 3.73Å; Y907-V911 HydrophobicContact CE2-CG2 3.46Å; Y907-V911 VanDerWaalsContact CE2-CG2 3.46Å; Y907-V911 HydrophobicContact CG-CG2 4.38Å; Y907-V911 WeakPolarHBondContact O-CG2 3.48Å; Y907-V911 PolarHBondContact O-N 3.18Å; Y907-V911 WeakPolarHBondContact OH-CG2 3.34Å; V908-V911 PolarHBondContact O-N 3.19Å; V911-I913 VanDerWaalsContact C-N 3.33Å; V911-I913 PolarHBondContact O-N 3.31Å; V911-R914 CarbonylContact O-C 3.59Å; V911-R914 PolarHBondContact O-N 2.86Å; V911-R914 VanDerWaalsContact O-N 3.14Å; V911-Q915 PolarHBondContact O-N 3.27Å; V911-Q915 VanDerWaalsContact O-N 3.09Å; V911-Q916 HydrophobicContact CG1-CB 4.07Å; V911-Y919 HydrophobicContact CB-CE1 4.03Å; V911-Y919 HydrophobicContact CG1-CD1 4.21Å; V911-Y919 HydrophobicContact CG1-CE1 3.61Å; V911-Y919 HydrophobicContact CG2-CE1 4.25Å
912	Q	84.2	Confident	83.9	Confident	124 Å²	124	77.6 Å²	77.6	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-61.1	-41.1	175	-75.2	174.9	-6.7	0	0	111.8	V908 H909 R914 Q915	V908-Q912 WeakPolarHBondContact O-CG 3.38Å; V908-Q912 PolarHBondContact O-N 3.32Å; H909-Q912 PolarHBondContact O-N 3.04Å; Q912-R914 VanDerWaalsContact C-N 3.33Å; Q912-Q915 PolarHBondContact O-N 2.95Å
913	I	83.5	Confident	83.8	Confident	119 Å²	119	73.7 Å²	73.7	61%	0.61	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-38.8	174.3	-66.8	166.2	0	0	0	111.1	H909 E910 V911 Q915	H909-I913 WeakPolarHBondContact ND1-CD1 3.34Å; H909-I913 WeakPolarHBondContact O-CG1 3.33Å; H909-I913 PolarHBondContact O-N 3.38Å; H909-I913 VanDerWaalsContact O-N 3.1Å; E910-I913 PolarHBondContact O-N 2.7Å; V911-I913 VanDerWaalsContact C-N 3.33Å; V911-I913 PolarHBondContact O-N 3.31Å; I913-Q915 VanDerWaalsContact C-N 3.28Å; I913-Q915 PolarHBondContact O-N 3.43Å
914	R	84.6	Confident	83.7	Confident	119 Å²	119	78.5 Å²	78.5	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-75.3	-8.6	179.6	-69	176.7	-169.7	155.3	15	114.4	E910 V911 Q912 Q916	E910-R914 WeakPolarHBondContact O-CG 3.47Å; E910-R914 PolarHBondContact O-N 3.09Å; E910-R914 IonicContact OE2-CZ 3.69Å; E910-R914 IonicContact OE2-NH2 3.97Å; E910-R914 PolarHBondContact OE2-NH2 3.12Å; V911-R914 CarbonylContact O-C 3.59Å; V911-R914 PolarHBondContact O-N 2.86Å; V911-R914 VanDerWaalsContact O-N 3.14Å; Q912-R914 VanDerWaalsContact C-N 3.33Å; R914-Q916 PolarHBondContact O-N 3.4Å
915	Q	78.7	Confident	83.6	Confident	171 Å²	171	79.4 Å²	79.4	80%	0.799	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	30.2	-175.8	-58.6	-173.8	-1.4	0	0	114.5	V911 Q912 I913	V911-Q915 PolarHBondContact O-N 3.27Å; V911-Q915 VanDerWaalsContact O-N 3.09Å; Q912-Q915 PolarHBondContact O-N 2.95Å; I913-Q915 VanDerWaalsContact C-N 3.28Å; I913-Q915 PolarHBondContact O-N 3.43Å
916	Q	79.7	Confident	83.6	Confident	76 Å²	76	76.4 Å²	76.4	36%	0.355	36%	0.36	S	S	.	.			trans	-75.6	135	178.3	175.9	174.5	-13.8	0	0	110.3	E868 V911 R914 E918	E868-Q916 PolarHBondContact OE1-NE2 3.17Å; E868-Q916 PolarHBondContact OE1-OE1 3.25Å; E868-Q916 PolarHBondContact OE2-NE2 3.27Å; V911-Q916 HydrophobicContact CG1-CB 4.07Å; R914-Q916 PolarHBondContact O-N 3.4Å; Q916-E918 PolarHBondContact NE2-O 3.48Å
917	R	72.5	Confident	83.7	Confident	243 Å²	243	79.3 Å²	79.3	92%	0.917	37%	0.367	S	S	*	.	S	Bend	trans	-88	-20.1	-171	-68.9	-174.5	178.5	-175.1	-0.5	114.6
918	E	78.2	Confident	83.6	Confident	159 Å²	159	83.3 Å²	83.3	74%	0.743	39%	0.386	S	S	*	.			trans	-129	132.3	-174.7	-68.1	-178.2	177.6	0	0	110.7	Q916	Q916-E918 PolarHBondContact NE2-O 3.48Å
919	Y	82.8	Confident	83.7	Confident	88 Å²	88	82 Å²	82	35%	0.345	38%	0.379	S	S	.	.			trans	-87.9	147.1	172.6	-67.2	-79.4	0	0	0	110.3	Y907 V911 Y923	Y907-Y919 HydrophobicContact CE1-CD1 4.28Å; V911-Y919 HydrophobicContact CB-CE1 4.03Å; V911-Y919 HydrophobicContact CG1-CD1 4.21Å; V911-Y919 HydrophobicContact CG1-CE1 3.61Å; V911-Y919 HydrophobicContact CG2-CE1 4.25Å; Y919-Y923 AromaticContact CD1-CD1 3.75Å; Y919-Y923 HydrophobicContact CD1-CD1 3.75Å; Y919-Y923 HydrophobicContact CD1-CD2 4.44Å; Y919-Y923 AromaticContact CD1-CE1 3.86Å; Y919-Y923 HydrophobicContact CD1-CE1 3.86Å; Y919-Y923 HydrophobicContact CD1-CG 4.06Å; Y919-Y923 HydrophobicContact CD2-CD1 4.27Å; Y919-Y923 HydrophobicContact CD2-CE1 4.14Å; Y919-Y923 HydrophobicContact CE1-CE1 4.2Å; Y919-Y923 HydrophobicContact CE2-CE1 4.47Å; Y919-Y923 AromaticContact CG-CD1 3.6Å; Y919-Y923 HydrophobicContact CG-CD1 3.6Å; Y919-Y923 AromaticContact CG-CE1 3.83Å; Y919-Y923 HydrophobicContact CG-CE1 3.83Å; Y919-Y923 HydrophobicContact CG-CG 4.27Å
920	P	82.5	Confident	83.8	Confident	16 Å²	16	76.8 Å²	76.8	10%	0.104	35%	0.354	C	S	.	.			trans	-56.6	144.5	170.5	-25.2	34.6	0	0	0	111.9	P866 I869 Y907 I922 Y923	P866-P920 HydrophobicContact CG-CB 4.19Å; P866-P920 HydrophobicContact CG-CG 4.46Å; I869-P920 HydrophobicContact CD1-CG 4.33Å; Y907-P920 WeakPolarHBondContact OH-CD 3.42Å; P920-I922 HydrophobicContact CB-CG2 4.29Å; P920-I922 PolarHBondContact O-N 3.13Å; P920-I922 VanDerWaalsContact O-N 3.09Å; P920-Y923 VanDerWaalsContact O-CB 3.25Å; P920-Y923 WeakPolarHBondContact O-CB 3.32Å; P920-Y923 PolarHBondContact O-N 3.3Å
921	P	83.5	Confident	83.8	Confident	103 Å²	103	76.3 Å²	76.3	67%	0.669	35%	0.353	S	S	*	.	H	α-helix	trans	-54.4	-35.9	-178.4	-26.6	33.1	0	0	0	113.9	Y923 L924	P921-Y923 VanDerWaalsContact C-N 3.26Å; P921-Y923 PolarHBondContact O-N 3.3Å; P921-L924 PolarHBondContact O-N 3.43Å
922	I	85.6	Confident	83.8	Confident	9 Å²	9	82 Å²	82	5%	0.046	38%	0.375	C	S	.	.	H	α-helix	trans	-68.1	-23.1	179.4	-158.6	166.3	0	0	0	113.5	N832 M861 R864 A865 I869 P920 L924 Q925 L926	N832-I922 VanDerWaalsContact ND2-CD1 3.35Å; N832-I922 WeakPolarHBondContact ND2-CD1 3.5Å; M861-I922 WeakPolarHBondContact O-CD1 3.27Å; R864-I922 HydrophobicContact CB-CD1 3.67Å; A865-I922 HydrophobicContact CB-CD1 4.38Å; A865-I922 HydrophobicContact CB-CG2 3.91Å; I869-I922 HydrophobicContact CD1-CG2 4.16Å; P920-I922 HydrophobicContact CB-CG2 4.29Å; P920-I922 PolarHBondContact O-N 3.13Å; P920-I922 VanDerWaalsContact O-N 3.09Å; I922-L924 VanDerWaalsContact C-N 3.35Å; I922-Q925 PolarHBondContact O-N 3.41Å; I922-L926 WeakPolarHBondContact O-CB 3.49Å; I922-L926 WeakPolarHBondContact O-CG 3.41Å; I922-L926 PolarHBondContact O-N 3.41Å
923	Y	86.7	Confident	83.6	Confident	18 Å²	18	78.7 Å²	78.7	7%	0.071	36%	0.36	C	S	.	.	H	α-helix	trans	-63.5	-43.5	175.2	165	-96.7	0	0	0	110.8	L904 Y907 V908 Y919 P920 P921 Q925 L926 K927	L904-Y923 HydrophobicContact CD1-CD2 3.79Å; L904-Y923 HydrophobicContact CD1-CE2 4.05Å; L904-Y923 HydrophobicContact CD2-CD2 4.45Å; L904-Y923 HydrophobicContact CD2-CE2 4.2Å; L904-Y923 HydrophobicContact CG-CD2 4.22Å; L904-Y923 HydrophobicContact CG-CE2 3.96Å; Y907-Y923 HydrophobicContact CD1-CD2 4.08Å; Y907-Y923 HydrophobicContact CD1-CE2 4.43Å; Y907-Y923 HydrophobicContact CE1-CD2 4.04Å; V908-Y923 HydrophobicContact CG2-CE2 3.46Å; V908-Y923 VanDerWaalsContact CG2-CE2 3.46Å; V908-Y923 WeakPolarHBondContact CG2-OH 3.33Å; Y919-Y923 AromaticContact CD1-CD1 3.75Å; Y919-Y923 HydrophobicContact CD1-CD1 3.75Å; Y919-Y923 HydrophobicContact CD1-CD2 4.44Å; Y919-Y923 AromaticContact CD1-CE1 3.86Å; Y919-Y923 HydrophobicContact CD1-CE1 3.86Å; Y919-Y923 HydrophobicContact CD1-CG 4.06Å; Y919-Y923 HydrophobicContact CD2-CD1 4.27Å; Y919-Y923 HydrophobicContact CD2-CE1 4.14Å; Y919-Y923 HydrophobicContact CE1-CE1 4.2Å; Y919-Y923 HydrophobicContact CE2-CE1 4.47Å; Y919-Y923 AromaticContact CG-CD1 3.6Å; Y919-Y923 HydrophobicContact CG-CD1 3.6Å; Y919-Y923 AromaticContact CG-CE1 3.83Å; Y919-Y923 HydrophobicContact CG-CE1 3.83Å; Y919-Y923 HydrophobicContact CG-CG 4.27Å; P920-Y923 VanDerWaalsContact O-CB 3.25Å; P920-Y923 WeakPolarHBondContact O-CB 3.32Å; P920-Y923 PolarHBondContact O-N 3.3Å; P921-Y923 VanDerWaalsContact C-N 3.26Å; P921-Y923 PolarHBondContact O-N 3.3Å; Y923-Q925 VanDerWaalsContact C-N 3.29Å; Y923-Q925 PolarHBondContact O-N 3.37Å; Y923-L926 PolarHBondContact O-N 3.23Å; Y923-K927 HydrophobicContact CE1-CD 4.49Å; Y923-K927 WeakPolarHBondContact O-CB 3.36Å; Y923-K927 PolarHBondContact O-N 2.93Å
924	L	85.9	Confident	83.4	Confident	108 Å²	108	75.2 Å²	75.2	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-63.5	-39.5	178.5	-63.3	175.5	0	0	0	111	P921 I922 K927 E928	P921-L924 PolarHBondContact O-N 3.43Å; I922-L924 VanDerWaalsContact C-N 3.35Å; L924-K927 PolarHBondContact O-N 3.09Å; L924-E928 WeakPolarHBondContact O-CB 3.46Å; L924-E928 PolarHBondContact O-N 2.59Å
925	Q	87.2	Confident	82.5	Confident	28 Å²	28	71.1 Å²	71.1	13%	0.131	34%	0.337	C	S	.	.	H	α-helix	trans	-66.7	-44.6	176.7	-66.5	168.7	-17.7	0	0	112.1	N832 E833 V836 M861 I922 Y923 K927 E928 F929	N832-Q925 PolarHBondContact ND2-OE1 2.87Å; E833-Q925 VanDerWaalsContact CG-NE2 3.32Å; V836-Q925 HydrophobicContact CG2-CB 4.09Å; M861-Q925 HydrophobicContact CE-CB 3.77Å; I922-Q925 PolarHBondContact O-N 3.41Å; Y923-Q925 VanDerWaalsContact C-N 3.29Å; Y923-Q925 PolarHBondContact O-N 3.37Å; Q925-K927 VanDerWaalsContact C-N 3.31Å; Q925-K927 PolarHBondContact O-N 3.34Å; Q925-E928 PolarHBondContact O-N 3.07Å; Q925-F929 WeakPolarHBondContact O-CB 3.49Å; Q925-F929 PolarHBondContact O-N 3.16Å
926	L	87.4	Confident	81.4	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.1	-41	175	-83.7	168.2	0	0	0	111.7	M861 F862 L904 I922 Y923 L930	M861-L926 HydrophobicContact CB-CD2 3.45Å; M861-L926 VanDerWaalsContact CB-CD2 3.45Å; M861-L926 HydrophobicContact CB-CG 4.15Å; M861-L926 HydrophobicContact CE-CD2 4.28Å; M861-L926 HydrophobicContact CE-CG 4.29Å; M861-L926 HydrophobicContact SD-CD2 4.43Å; F862-L926 HydrophobicContact CD1-CD1 4.17Å; F862-L926 HydrophobicContact CD2-CD2 3.85Å; F862-L926 HydrophobicContact CE1-CD1 4.23Å; F862-L926 HydrophobicContact CE2-CD2 3.9Å; F862-L926 HydrophobicContact CG-CD1 4.33Å; F862-L926 HydrophobicContact CG-CD2 4.36Å; F862-L926 HydrophobicContact CZ-CD1 4.43Å; F862-L926 HydrophobicContact CZ-CD2 4.48Å; L904-L926 HydrophobicContact CD1-CB 4.48Å; L904-L926 HydrophobicContact CD1-CD1 4.33Å; L904-L926 HydrophobicContact CD2-CB 4.11Å; I922-L926 WeakPolarHBondContact O-CB 3.49Å; I922-L926 WeakPolarHBondContact O-CG 3.41Å; I922-L926 PolarHBondContact O-N 3.41Å; Y923-L926 PolarHBondContact O-N 3.23Å; L926-L930 WeakPolarHBondContact O-CB 3.24Å; L926-L930 WeakPolarHBondContact O-CG 3.49Å; L926-L930 PolarHBondContact O-N 3.18Å
927	K	86.9	Confident	79.5	Confident	92 Å²	92	76.8 Å²	76.8	40%	0.4	37%	0.367	S	S	.	.	H	α-helix	trans	-65.6	-47.9	176.7	-173.4	-179.9	178.4	-179.5	0	111.5	L904 Y923 L924 Q925 F929 L930 D931	L904-K927 HydrophobicContact CD2-CB 4.4Å; Y923-K927 HydrophobicContact CE1-CD 4.49Å; Y923-K927 WeakPolarHBondContact O-CB 3.36Å; Y923-K927 PolarHBondContact O-N 2.93Å; L924-K927 PolarHBondContact O-N 3.09Å; Q925-K927 VanDerWaalsContact C-N 3.31Å; Q925-K927 PolarHBondContact O-N 3.34Å; K927-F929 VanDerWaalsContact C-N 3.28Å; K927-F929 PolarHBondContact O-N 3.07Å; K927-L930 PolarHBondContact O-N 3.13Å; K927-D931 WeakPolarHBondContact O-CB 3.36Å; K927-D931 VanDerWaalsContact O-CG 3.25Å; K927-D931 PolarHBondContact O-N 2.59Å
928	E	86	Confident	79.9	Confident	88 Å²	88	68.5 Å²	68.5	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-43.2	176.6	-174.8	178.4	179.1	0	0	111.3	V836 K841 L924 Q925 Y932	V836-E928 HydrophobicContact CG1-CG 4.2Å; K841-E928 WeakPolarHBondContact CE-OE1 3.41Å; K841-E928 IonicContact NZ-OE1 3.48Å; K841-E928 PolarHBondContact NZ-OE1 3.03Å; L924-E928 WeakPolarHBondContact O-CB 3.46Å; L924-E928 PolarHBondContact O-N 2.59Å; Q925-E928 PolarHBondContact O-N 3.07Å; E928-Y932 PolarHBondContact O-N 2.82Å
929	F	87.7	Confident	79.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-46.6	179.1	-169.9	-88	0	0	0	112.8	A840 P854 I857 C858 M861 Q925 K927 Y932 H933	A840-F929 HydrophobicContact CB-CD2 4.13Å; P854-F929 HydrophobicContact CB-CE1 4.31Å; P854-F929 HydrophobicContact CB-CZ 4.21Å; P854-F929 WeakPolarHBondContact O-CE1 3.33Å; I857-F929 HydrophobicContact CB-CZ 4.04Å; I857-F929 HydrophobicContact CG2-CE2 4.06Å; I857-F929 HydrophobicContact CG2-CZ 4.01Å; C858-F929 HydrophobicContact CB-CD1 3.86Å; C858-F929 HydrophobicContact CB-CE1 3.74Å; M861-F929 HydrophobicContact SD-CB 4.35Å; M861-F929 HydrophobicContact SD-CD2 4.28Å; M861-F929 HydrophobicContact SD-CG 4.21Å; Q925-F929 WeakPolarHBondContact O-CB 3.49Å; Q925-F929 PolarHBondContact O-N 3.16Å; K927-F929 VanDerWaalsContact C-N 3.28Å; K927-F929 PolarHBondContact O-N 3.07Å; F929-Y932 PolarHBondContact O-N 3.44Å; F929-H933 AromaticContact CD1-CD2 3.95Å; F929-H933 AromaticContact CE1-CD2 3.54Å; F929-H933 AromaticContact CE1-NE2 3.99Å; F929-H933 AromaticContact CE2-NE2 3.83Å; F929-H933 AromaticContact CZ-CD2 3.6Å; F929-H933 AromaticContact CZ-NE2 3.54Å; F929-H933 PolarHBondContact O-CD2 2.99Å; F929-H933 PolarHBondContact O-N 2.79Å
930	L	86.6	Confident	79.8	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-41.3	-179.2	-76.2	171.9	0	0	0	112.5	C858 L897 L900 R901 L904 L926 K927 Y932 H933 I934	C858-L930 WeakPolarHBondContact SG-CD2 3.41Å; L897-L930 HydrophobicContact CD2-CD2 3.98Å; L900-L930 HydrophobicContact CB-CD2 4.33Å; R901-L930 HydrophobicContact CB-CD1 4.33Å; L904-L930 HydrophobicContact CB-CD1 4.39Å; L904-L930 HydrophobicContact CD2-CD1 3.82Å; L926-L930 WeakPolarHBondContact O-CB 3.24Å; L926-L930 WeakPolarHBondContact O-CG 3.49Å; L926-L930 PolarHBondContact O-N 3.18Å; K927-L930 PolarHBondContact O-N 3.13Å; L930-Y932 PolarHBondContact O-N 2.75Å; L930-H933 PolarHBondContact O-N 3.48Å; L930-I934 HydrophobicContact CD2-CD1 4.06Å; L930-I934 WeakPolarHBondContact O-CB 3.21Å; L930-I934 PolarHBondContact O-N 3.44Å
931	D	85.7	Confident	79.6	Confident	38 Å²	38	65.1 Å²	65.1	20%	0.203	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-31.6	178	-73.3	-9.6	0	0	0	111.5	K927 G935 K936	K927-D931 WeakPolarHBondContact O-CB 3.36Å; K927-D931 VanDerWaalsContact O-CG 3.25Å; K927-D931 PolarHBondContact O-N 2.59Å; D931-G935 CarbonylContact O-C 3.58Å; D931-G935 VanDerWaalsContact O-C 3.32Å; D931-G935 WeakPolarHBondContact O-CA 3.17Å; D931-G935 PolarHBondContact O-N 3.4Å; D931-K936 HydrophobicContact CB-CG 4.1Å
932	Y	83.8	Confident	79.4	Confident	121 Å²	121	62.8 Å²	62.8	48%	0.475	31%	0.308	S	S	.	.	H	α-helix	trans	-69.1	-46.5	176.1	178.8	-98.5	0	0	0	112.6	A840 E928 F929 L930	A840-Y932 HydrophobicContact CB-CD1 3.95Å; A840-Y932 HydrophobicContact CB-CE1 4.49Å; A840-Y932 HydrophobicContact CB-CG 4.05Å; A840-Y932 VanDerWaalsContact O-CD2 3.27Å; A840-Y932 WeakPolarHBondContact O-CD2 3.46Å; A840-Y932 WeakPolarHBondContact O-CE2 3.34Å; A840-Y932 VanDerWaalsContact O-CZ 3.23Å; E928-Y932 PolarHBondContact O-N 2.82Å; F929-Y932 PolarHBondContact O-N 3.44Å; L930-Y932 PolarHBondContact O-N 2.75Å
933	H	80.4	Confident	79	Confident	55 Å²	55	66.3 Å²	66.3	26%	0.255	33%	0.325	S	S	.	.	H	α-helix	trans	-84.6	-26.4	-173.4	-76.2	-73.8	0	0	0	114.6	Y839 L897 F929 L930	Y839-H933 PolarHBondContact O-CE1 3.12Å; Y839-H933 PolarHBondContact O-NE2 3.15Å; L897-H933 HydrophobicContact CD1-CB 3.7Å; F929-H933 AromaticContact CD1-CD2 3.95Å; F929-H933 AromaticContact CE1-CD2 3.54Å; F929-H933 AromaticContact CE1-NE2 3.99Å; F929-H933 AromaticContact CE2-NE2 3.83Å; F929-H933 AromaticContact CZ-CD2 3.6Å; F929-H933 AromaticContact CZ-NE2 3.54Å; F929-H933 PolarHBondContact O-CD2 2.99Å; F929-H933 PolarHBondContact O-N 2.79Å; L930-H933 PolarHBondContact O-N 3.48Å
934	I	78.9	Confident	78.4	Confident	45 Å²	45	69.8 Å²	69.8	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-97.7	-18.9	179.6	-58.1	168.8	0	0	0	111.5	L897 I898 R901 L930	L897-I934 HydrophobicContact CB-CD1 3.84Å; L897-I934 HydrophobicContact CB-CG1 3.85Å; L897-I934 WeakPolarHBondContact O-CD1 3.36Å; I898-I934 HydrophobicContact CG1-CD1 4.4Å; I898-I934 HydrophobicContact CG1-CG2 4.25Å; R901-I934 HydrophobicContact CB-CD1 3.77Å; R901-I934 HydrophobicContact CG-CD1 4.33Å; L930-I934 HydrophobicContact CD2-CD1 4.06Å; L930-I934 WeakPolarHBondContact O-CB 3.21Å; L930-I934 PolarHBondContact O-N 3.44Å
935	G	65.4	Low	77.8	Confident	33 Å²	33	66.8 Å²	66.8	34%	0.34	33%	0.326	S	S	.	.			trans	88.7	148.6	-168.5	0	0	0	0	0	111.6	D931 D937	D931-G935 CarbonylContact O-C 3.58Å; D931-G935 VanDerWaalsContact O-C 3.32Å; D931-G935 WeakPolarHBondContact O-CA 3.17Å; D931-G935 PolarHBondContact O-N 3.4Å; G935-D937 PolarHBondContact O-N 2.97Å
936	K	56.9	Low	77.1	Confident	177 Å²	177	70.1 Å²	70.1	77%	0.77	34%	0.343	S	S	*	.			trans	-77.3	110.3	173.5	-72.4	-177.6	177.5	178.8	0	109.1	D931	D931-K936 HydrophobicContact CB-CG 4.1Å
937	D	39.2	Very low	76.1	Confident	190 Å²	190	76.5 Å²	76.5	100%	1.016	37%	0.374	S	S	*	.			trans	-86	0	156.9	-61.4	-52.9	0	0	0	110.4	R901 G935	R901-D937 IonicContact CZ-OD2 2.85Å; R901-D937 IonicContact NH1-OD2 2.67Å; R901-D937 PolarHBondContact NH1-OD2 3.47Å; R901-D937 IonicContact NH2-OD2 2.82Å; G935-D937 PolarHBondContact O-N 2.97Å

Retrieved 937 of 937 residues in 1942.3 ms (Link to these results)

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